#METABOLOMICS WORKBENCH krueger_20231003_090520 DATATRACK_ID:4369 STUDY_ID:ST002909 ANALYSIS_ID:AN004775 PROJECT_ID:PR001809
VERSION 1
CREATED_ON October 3, 2023, 11:37 am
#PROJECT
PR:PROJECT_TITLE Plasma metabolomics reveals distinct biological and diagnostic signatures for
PR:PROJECT_TITLE melioidosis
PR:PROJECT_SUMMARY Rationale: The global burden of sepsis is greatest in low-resource settings.
PR:PROJECT_SUMMARY Melioidosis, infection with the Gram-negative bacterium Burkholderia
PR:PROJECT_SUMMARY pseudomallei, is a frequent cause of fatal sepsis in endemic tropical regions
PR:PROJECT_SUMMARY such as Southeast Asia. Objectives: To investigate whether plasma metabolomics
PR:PROJECT_SUMMARY would identify biological pathways specific to melioidosis and yield clinically
PR:PROJECT_SUMMARY meaningful biomarkers. Methods: Using a comprehensive approach, differential
PR:PROJECT_SUMMARY enrichment of plasma metabolites and pathways was systematically evaluated in
PR:PROJECT_SUMMARY individuals selected from a prospective cohort of patients hospitalized in rural
PR:PROJECT_SUMMARY Thailand with infection. Statistical and bioinformatics methods were used to
PR:PROJECT_SUMMARY distinguish metabolomic features and processes specific to melioidosis patients,
PR:PROJECT_SUMMARY and between fatal and non-fatal cases. Measurements and Main Results:
PR:PROJECT_SUMMARY Metabolomic profiling and pathway enrichment analysis of plasma samples of
PR:PROJECT_SUMMARY melioidosis (n=175) and non-melioidosis infections (n=75) revealed a distinct
PR:PROJECT_SUMMARY immuno-metabolic state among patients with melioidosis, as suggested by
PR:PROJECT_SUMMARY excessive tryptophan catabolism in the kynurenine pathway and significantly
PR:PROJECT_SUMMARY increased levels of sphingomyelins and ceramide species. We derived a
PR:PROJECT_SUMMARY 12-metabolite classifier to distinguish melioidosis from other infections,
PR:PROJECT_SUMMARY yielding an area under the receiver operating characteristic curve of 0.87 in a
PR:PROJECT_SUMMARY second validation set of patients. Melioidosis non-survivors (n=94) had a
PR:PROJECT_SUMMARY significantly disturbed metabolome compared to survivors (n=81) with increased
PR:PROJECT_SUMMARY leucine, isoleucine and valine metabolism, and elevated circulating free fatty
PR:PROJECT_SUMMARY acids and acylcarnitines. A limited 8-metabolite panel showed promise as an
PR:PROJECT_SUMMARY early prognosticator of mortality in melioidosis. Conclusions: Melioidosis
PR:PROJECT_SUMMARY induces a distinct metabolomic state that can be examined to distinguish
PR:PROJECT_SUMMARY underlying pathophysiological mechanisms associated with death. A
PR:PROJECT_SUMMARY twelve-metabolite signature accurately differentiates melioidosis from other
PR:PROJECT_SUMMARY infections and may have diagnostic applications.
PR:INSTITUTE University of Washington
PR:DEPARTMENT Medicine
PR:LAST_NAME Gharib
PR:FIRST_NAME Sina
PR:ADDRESS Center for Lung Biology, 850 Republican St, Seattle WA 98109
PR:EMAIL sagharib@uw.edu
PR:PHONE 206-221-0630
PR:FUNDING_SOURCE NIH (R01HL113382, R01AI137111, R01GM114029, R21AI173435) and the Wellcome Trust
PR:FUNDING_SOURCE (090219/Z/09/Z, 101103/Z/13/Z)
PR:CONTRIBUTORS Lu Xia, T. Eoin West
#STUDY
ST:STUDY_TITLE Plasma metabolomics reveals distinct biological and diagnostic signatures for
ST:STUDY_TITLE melioidosis
ST:STUDY_SUMMARY Rationale: The global burden of sepsis is greatest in low-resource settings.
ST:STUDY_SUMMARY Melioidosis, infection with the Gram-negative bacterium Burkholderia
ST:STUDY_SUMMARY pseudomallei, is a frequent cause of fatal sepsis in endemic tropical regions
ST:STUDY_SUMMARY such as Southeast Asia. Objectives: To investigate whether plasma metabolomics
ST:STUDY_SUMMARY would identify biological pathways specific to melioidosis and yield clinically
ST:STUDY_SUMMARY meaningful biomarkers. Methods: Using a comprehensive approach, differential
ST:STUDY_SUMMARY enrichment of plasma metabolites and pathways was systematically evaluated in
ST:STUDY_SUMMARY individuals selected from a prospective cohort of patients hospitalized in rural
ST:STUDY_SUMMARY Thailand with infection. Statistical and bioinformatics methods were used to
ST:STUDY_SUMMARY distinguish metabolomic features and processes specific to melioidosis patients,
ST:STUDY_SUMMARY and between fatal and non-fatal cases. Measurements and Main Results:
ST:STUDY_SUMMARY Metabolomic profiling and pathway enrichment analysis of plasma samples of
ST:STUDY_SUMMARY melioidosis (n=175) and non-melioidosis infections (n=75) revealed a distinct
ST:STUDY_SUMMARY immuno-metabolic state among patients with melioidosis, as suggested by
ST:STUDY_SUMMARY excessive tryptophan catabolism in the kynurenine pathway and significantly
ST:STUDY_SUMMARY increased levels of sphingomyelins and ceramide species. We derived a
ST:STUDY_SUMMARY 12-metabolite classifier to distinguish melioidosis from other infections,
ST:STUDY_SUMMARY yielding an area under the receiver operating characteristic curve of 0.87 in a
ST:STUDY_SUMMARY second validation set of patients. Melioidosis non-survivors (n=94) had a
ST:STUDY_SUMMARY significantly disturbed metabolome compared to survivors (n=81) with increased
ST:STUDY_SUMMARY leucine, isoleucine and valine metabolism, and elevated circulating free fatty
ST:STUDY_SUMMARY acids and acylcarnitines. A limited 8-metabolite panel showed promise as an
ST:STUDY_SUMMARY early prognosticator of mortality in melioidosis. Conclusions: Melioidosis
ST:STUDY_SUMMARY induces a distinct metabolomic state that can be examined to distinguish
ST:STUDY_SUMMARY underlying pathophysiological mechanisms associated with death. A
ST:STUDY_SUMMARY twelve-metabolite signature accurately differentiates melioidosis from other
ST:STUDY_SUMMARY infections and may have diagnostic applications.
ST:INSTITUTE University of Washington
ST:LAST_NAME Gharib
ST:FIRST_NAME Sina
ST:ADDRESS Center for Lung Biology, 850 Republican St. Seattle WA 98109
ST:EMAIL sagharib@uw.edu
ST:PHONE 206-221-0630
#SUBJECT
SU:SUBJECT_TYPE Human
SU:SUBJECT_SPECIES Homo sapiens
SU:TAXONOMY_ID 9606
SU:GENDER Male and female
#SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data
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SUBJECT_SAMPLE_FACTORS - 4 Group:control age=65; sex=F; mortality=NA
SUBJECT_SAMPLE_FACTORS - 5 Group:control age=48; sex=F; mortality=NA
SUBJECT_SAMPLE_FACTORS - 6 Group:control age=67; sex=M; mortality=NA
SUBJECT_SAMPLE_FACTORS - 7 Group:control age=41; sex=F; mortality=NA
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SUBJECT_SAMPLE_FACTORS - 19 Group:control age=48; sex=M; mortality=NA
SUBJECT_SAMPLE_FACTORS - 20 Group:control age=73; sex=M; mortality=NA
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SUBJECT_SAMPLE_FACTORS - 37 Group:control age=47; sex=F; mortality=NA
SUBJECT_SAMPLE_FACTORS - 38 Group:control age=56; sex=F; mortality=NA
SUBJECT_SAMPLE_FACTORS - 39 Group:control age=58; sex=M; mortality=NA
SUBJECT_SAMPLE_FACTORS - 40 Group:control age=69; sex=M; mortality=NA
SUBJECT_SAMPLE_FACTORS - 41 Group:control age=40; sex=F; mortality=NA
SUBJECT_SAMPLE_FACTORS - 42 Group:control age=80; sex=F; mortality=NA
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SUBJECT_SAMPLE_FACTORS - 50 Group:control age=66; sex=M; mortality=NA
SUBJECT_SAMPLE_FACTORS - 51 Group:melioid age=86; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 52 Group:melioid age=60; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 53 Group:melioid age=66; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 54 Group:melioid age=88; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 55 Group:melioid age=56; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 56 Group:melioid age=89; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 57 Group:melioid age=49; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 58 Group:melioid age=53; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 59 Group:melioid age=48; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 60 Group:melioid age=66; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 61 Group:melioid age=57; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 62 Group:melioid age=37; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 63 Group:melioid age=40; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 64 Group:melioid age=73; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 65 Group:melioid age=67; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 66 Group:melioid age=41; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 67 Group:melioid age=63; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 68 Group:melioid age=55; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 69 Group:melioid age=42; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 70 Group:melioid age=56; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 71 Group:melioid age=48; sex=F; mortality=dead
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SUBJECT_SAMPLE_FACTORS - 73 Group:melioid age=41; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 74 Group:melioid age=37; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 75 Group:melioid age=46; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 76 Group:melioid age=42; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 77 Group:melioid age=51; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 78 Group:melioid age=52; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 79 Group:melioid age=47; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 80 Group:melioid age=70; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 81 Group:melioid age=49; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 82 Group:melioid age=56; sex=F; mortality=dead
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SUBJECT_SAMPLE_FACTORS - 85 Group:melioid age=51; sex=F; mortality=alive
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SUBJECT_SAMPLE_FACTORS - 95 Group:melioid age=80; sex=M; mortality=dead
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SUBJECT_SAMPLE_FACTORS - 108 Group:melioid age=47; sex=M; mortality=dead
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SUBJECT_SAMPLE_FACTORS - 110 Group:melioid age=58; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 111 Group:melioid age=26; sex=F; mortality=alive
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SUBJECT_SAMPLE_FACTORS - 121 Group:melioid age=40; sex=M; mortality=dead
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SUBJECT_SAMPLE_FACTORS - 160 Group:melioid age=49; sex=M; mortality=alive
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SUBJECT_SAMPLE_FACTORS - 170 Group:melioid age=46; sex=M; mortality=alive
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SUBJECT_SAMPLE_FACTORS - 174 Group:melioid age=89; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 175 Group:melioid age=57; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 176 Group:melioid age=64; sex=M; mortality=alive
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SUBJECT_SAMPLE_FACTORS - 186 Group:melioid age=69; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 187 Group:melioid age=76; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 188 Group:melioid age=46; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 189 Group:melioid age=56; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 190 Group:melioid age=79; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 191 Group:melioid age=57; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 192 Group:melioid age=52; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 193 Group:melioid age=37; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 194 Group:melioid age=48; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 195 Group:melioid age=35; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 196 Group:melioid age=54; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 197 Group:melioid age=63; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 198 Group:melioid age=78; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 199 Group:melioid age=54; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 200 Group:melioid age=33; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 201 Group:melioid age=49; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 202 Group:melioid age=53; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 203 Group:melioid age=56; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 204 Group:melioid age=46; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 205 Group:melioid age=53; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 206 Group:melioid age=50; sex=M; mortality=alive
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SUBJECT_SAMPLE_FACTORS - 208 Group:melioid age=20; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 209 Group:melioid age=70; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 210 Group:melioid age=47; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 211 Group:melioid age=33; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 212 Group:melioid age=67; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 213 Group:melioid age=44; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 214 Group:melioid age=66; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 215 Group:melioid age=56; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 216 Group:melioid age=60; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 217 Group:melioid age=69; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 218 Group:melioid age=64; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 219 Group:melioid age=55; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 220 Group:melioid age=62; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 221 Group:melioid age=84; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 222 Group:melioid age=33; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 223 Group:melioid age=51; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 224 Group:melioid age=49; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 225 Group:melioid age=69; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 226 Group:ecoli age=36; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 227 Group:ecoli age=74; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 228 Group:ecoli age=40; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 229 Group:ecoli age=83; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 230 Group:ecoli age=82; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 231 Group:ecoli age=49; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 232 Group:ecoli age=71; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 233 Group:ecoli age=67; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 234 Group:ecoli age=61; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 235 Group:ecoli age=74; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 236 Group:ecoli age=63; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 237 Group:ecoli age=68; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 238 Group:ecoli age=70; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 239 Group:ecoli age=82; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 240 Group:ecoli age=54; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 241 Group:ecoli age=51; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 242 Group:ecoli age=66; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 243 Group:ecoli age=61; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 244 Group:ecoli age=58; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 245 Group:ecoli age=72; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 246 Group:ecoli age=67; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 247 Group:ecoli age=85; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 248 Group:staph age=48; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 249 Group:staph age=51; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 250 Group:staph age=64; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 251 Group:staph age=82; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 252 Group:staph age=64; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 253 Group:staph age=37; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 254 Group:staph age=70; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 255 Group:staph age=65; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 256 Group:staph age=22; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 257 Group:staph age=75; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 258 Group:staph age=59; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 259 Group:staph age=47; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 260 Group:staph age=70; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 261 Group:staph age=44; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 262 Group:staph age=68; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 263 Group:staph age=27; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 264 Group:klebs age=38; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 265 Group:klebs age=78; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 266 Group:klebs age=75; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 267 Group:klebs age=62; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 268 Group:klebs age=77; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 269 Group:klebs age=64; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 270 Group:klebs age=80; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 271 Group:klebs age=36; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 272 Group:klebs age=32; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 273 Group:klebs age=95; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 274 Group:klebs age=44; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 275 Group:klebs age=74; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 276 Group:klebs age=45; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 277 Group:klebs age=68; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 278 Group:klebs age=63; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 279 Group:culture neg age=46; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 280 Group:culture neg age=55; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 281 Group:culture neg age=45; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 282 Group:culture neg age=25; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 283 Group:culture neg age=89; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 284 Group:culture neg age=67; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 285 Group:culture neg age=44; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 286 Group:culture neg age=67; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 287 Group:culture neg age=63; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 288 Group:culture neg age=82; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 289 Group:culture neg age=66; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 290 Group:culture neg age=79; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 291 Group:culture neg age=39; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 292 Group:culture neg age=65; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 293 Group:culture neg age=77; sex=F; mortality=dead
SUBJECT_SAMPLE_FACTORS - 294 Group:culture neg age=51; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 295 Group:culture neg age=40; sex=M; mortality=alive
SUBJECT_SAMPLE_FACTORS - 296 Group:culture neg age=54; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 297 Group:culture neg age=69; sex=M; mortality=dead
SUBJECT_SAMPLE_FACTORS - 298 Group:culture neg age=53; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 299 Group:culture neg age=23; sex=F; mortality=alive
SUBJECT_SAMPLE_FACTORS - 300 Group:culture neg age=76; sex=F; mortality=dead
#COLLECTION
CO:COLLECTION_SUMMARY Subjects at least 18 years of age admitted to Sunpasitthiprasong Hospital in
CO:COLLECTION_SUMMARY Ubon Ratchathani, Thailand with suspected community-acquired infection were
CO:COLLECTION_SUMMARY sequentially and prospectively enrolled within 24 hours of admission into the
CO:COLLECTION_SUMMARY “Ubon-Sepsis” parent study from 2013 through 2017. Plasma samples were
CO:COLLECTION_SUMMARY obtained from all participants at the time of enrollment.
CO:SAMPLE_TYPE Blood (plasma)
#TREATMENT
TR:TREATMENT_SUMMARY N/A
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY Metabolon standard protocol
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY Low pH polar (LC/MS Pos early)
CH:CHROMATOGRAPHY_TYPE Reversed phase
CH:INSTRUMENT_NAME Waters Acquity
CH:COLUMN_NAME Waters Acquity BEH C18 (100 x 2mm, 1.7um)
CH:SOLVENT_A 100% water; 0.1% formic acid; 0.05% PFPA, pH ~2.5
CH:SOLVENT_B 100% methanol; 0.1% formic acid; 0.05% PFPA, pH ~2.5
CH:FLOW_GRADIENT Linear gradient from 5% B to 80% B over 3.35 minutes
CH:FLOW_RATE 0.35 mL/min
CH:COLUMN_TEMPERATURE 40-50
#ANALYSIS
AN:ANALYSIS_TYPE MS
#MS
MS:INSTRUMENT_NAME Thermo Q Exactive Orbitrap
MS:INSTRUMENT_TYPE Orbitrap
MS:MS_TYPE Other
MS:ION_MODE POSITIVE
MS:MS_COMMENTS Metabolon (LC/MS Pos early)
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS Peak area
MS_METABOLITE_DATA_START
Samples 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300
Factors Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:control Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:melioid Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:ecoli Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:staph Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:klebs Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg Group:culture neg
S-1-pyrroline-5-carboxylate 848678.625 526852.9375 919136.6875 739087.6875 810191.9375 1008574.875 1747292.125 606781.5625 1293893.375 1749033 1193739.125 990511.625 1467672.625 689810.3125 1409273.375 1233944.875 761075.125 1133378.75 697434.0625 2035300.375 1266270.25 1405795.875 691921.375 2961335.5 3393639.5 2532135.5 1421108.25 993630.875 1421346.75 637472.1875 2630437.5 5449427.5 1778084.75 1919287.125 2078063.25 1429495.375 3661314.25 3312285.75 1919712.125 700880.6875 1489823.375 826617.6875 1071992.875 678471.75 2692839.75 1127962.25 1480589.125 5040936 1212332.375 1327474.625 263855 782268.8125 1239201.5 434661.625 964547.9375 1127170.5 619948.125 357279.7813 333417 321363.3125 608119.125 515134.9375 402128.0938 382358.6875 292970.875 356224.125 602408.875 1000754.125 398921.25 678947.5625 360092.8438 497909.6875 110912.0313 201770.125 371281.7188 228488.4688 253439.8594 327169.875 541742.25 239172.5 121775.6172 720157.9375 802841.5 143092.5156 399336.75 820711.1875 162933.0625 661371.9375 469266.5625 244123.7344 165536.1875 328130.9375 285070.375 307676.2813 897544.875 743508.9375 344597.2188 686967.75 229969.1563 218112.3594 133636.75 476823.5313 703330.8125 262631.9063 112360.625 592283.4375 187389.1563 567326.875 388014.3125 694901.1875 701860.5625 662888.125 281521.75 774306.75 180696.125 522268.625 558326.5 497319 287365.5938 552067.1875 440204.4688 686294.625 184701 623573.9375 446275.5313 501690.8125 504332.0938 1052979.875 226568.2656 489390.6563 157756.2656 191650.9688 251008.4219 215659.0781 453150.5625 1468012.125 396734.6875 438407.625 662709.0625 151742.6719 690691.125 1088081 441420.75 463873.1875 86862.6016 551883.25 693168.4375 315669.6563 325164.9063 468228.7188 943650.8125 484427.7188 978822 378082.5313 850832.25 141302 565107 803114.75 129266.3906 326692.4688 467218.75 337058.8125 514836.5625 851539.125 152863.4688 1106255 956936.25 847315.4375 637329.0625 363802.4375 258277.4688 571621.375 283789.3125 904373.75 89020.0313 843274.0625 201482.8438 629733.1875 459973.5313 355234.2813 553051.75 477812.3438 490098.5313 269235.5313 396131.0625 564284.1875 173496.9219 1049519.25 524623.5625 164188.1563 481521.5625 548184.375 1059708.875 390420.9063 495667.9688 1112960.125 917720.375 995528.75 424496.5313 464312.25 455781.625 601997.75 1616254.125 852716.5 551159.4375 470407.2188 363970.125 771191 488917.9375 361493.375 545051.875 778133.125 756103.375 456999.7188 592651.1875 556750.6875 205635 627434.0625 552867.8125 609820.125 764237.6875 273334.1875 465799.1875 625659.625 229382.1875 864942.4375 831694.375 720085.8125 389753.1875 193379.0781 602045.6875 351278.9688 652082.6875 518830.1875 574610.625 832910.625 1374791.75 483709.5 208076.9063 134836.0781 382724.1875 126464.6797 412454.5 694976.0625 305905.875 624486.5 453888.9063 148264.0938 973707.9375 481704.5313 290382.5 489854.8125 353586.3125 575392.1875 528468.0625 556263.75 1056981.25 836657.875 557522.3125 542682.5625 525020.5625 490214.0625 771816.5 368560.4375
spermidine 77867.7344 337610.3125 129359.5547 190844.0781 93319.4531 205093 308812.5313 111697.0156 378048.0625 63806.6563 505071.5625 174161.7344 129783.9297 131925.9531 380648.4688 159738.8906 129569.0313 180477.2344 238700.4375 50460.6211 255202.6719 502092.2813 75375.9531 73672.1094 64855.3711 736794.0625 94435.375 42531.4258 270803.8125 93809.4141 119340.3359 416984.5313 221624.0469 273575.6875 550129.625 100351.0859 155310.4375 390639.5313 110127.0703 87437.0234 107473.8438 42759.4961 118644.5078 34554.0898 258440.4375 107500.4844 102868.9453 165704.7031 377168.375 361201.0625 202781.7031 308045.7188 316524.875 339593.8438 538133.25 234235.5156 158923.3594 134030.8594 232083.4531 131755.8906 473184.0938 167952.9063 286190.375 87855.0313 81488.5156 263733.625 143794.7656 371371.5625 185238.9688 60155.7227 172372.2188 59455.3789 185502.5781 522710.1563 310953.7813 46399.2188 74277.875 285884.25 109611.4375 45827.1914 302618.4063 80603.4141 691659.5 225165.7813 156071.7188 83601.1563 254427.3438 185063.5 131678.5781 71794.9531 977952.625 402847.0313 49800.4688 239873.0938 181730.2813 278291.75 55206.9102 176577.3906 233030.4063 45287.6328 110264.625 187885 393054.5313 317954.9375 47763.5859 310511.625 316737.4688 93886.8438 294923.0625 412371.3125 234169.0313 657324.625 44552.5 245019.0156 54441.6289 192870.1563 632882 74490.4453 533301.9375 182988.7344 278922.5313 52151.9688 913859.25 949355.0625 142581.1406 46549.1836 178832.2656 158821.3125 250356.6719 1680256.375 384972.2813 354495.4688 89067.0156 219489.3281 166151.0156 223842.9688 77677.6797 320977.25 191913.5156 562477.5625 443729.4688 115274.4219 168600.1094 117110.1953 363957.7813 382373 117277.2031 304082 226974.1563 150868.3906 232140.4219 292910.2188 36130.0977 877070.3125 125619.5625 129517.0625 397005.8125 85402.4922 149539.2813 203855.8281 238536.125 65131.8633 314408.8438 524815.875 129286.8906 358930.4688 171262.5313 168003.6094 534292.625 448999.5625 331358.875 166713.8125 70062.3281 186379.5469 374726.7813 307369 792922.5625 72282.6563 410410.5625 281955.9375 183857.4688 152161.5781 676786.375 82411.6563 135547.875 107983.2813 160659.1563 50678.6953 346553.0938 221277.375 404976.25 220525.0938 138801.1563 394308.3125 1368671.5 752012.1875 111633.7656 166887.8438 42225.1797 140485.1406 281617.7813 93148.2813 217401.0625 608231.375 144389.875 475643.5625 49000.9922 162697.9688 288454.125 80627.8203 209500.6719 170351.6719 130716.5547 98606.5469 91069.7969 101541.25 337165.125 466016.9375 577465.5625 249314.6406 415276.2813 61186.9258 269862.8438 130968.1875 2028089.75 285596.625 364943.4375 678059.3125 411800.0313 369873.5313 286483.5938 493829.9063 299941.7188 228065.9375 99560.9219 250739.6719 399801.4063 130884.0547 51411.3203 994674.4375 222442.4688 363667.7188 109916 572401.6875 245549.3594 312247.5313 715883.4375 5089720.5 240265.2188 353884.9375 388294.3438 205422.125 2845466.5 471439.4375 353258.9688 203708.5313 322311.625 875630.6875 217512.2031 93973.4219 223024.5313 192171.75 555423.5625 772890.5 354440.6875 58581.9609 248113.9844 383286.5625 457055.75 239497.6563 755399.625 1008654.313 232728.9063 120132.1172 273492.0938 705493.3125 722356.5 414736.7188 127795.75 413864.7813 171010.9375 409636.375 424515.3125 129097.5 456875.0625 214346.9375 507509.7813 174487.75 589614.0625 74862.2734 637268.25 172724.9688
1-methylnicotinamide 1581890.5 3719030 2818952.5 3157583.75 2561036 8615504 2478558 3483845.75 2718504.25 6339626 3064036.75 4390864.5 9999187 1229579.125 1269405.375 7550531 2991007.25 3097484 3164707.25 2016972.125 4026483 2033080.125 2870802.5 1187708 1026465 8307417.5 1961808.75 832889.1875 1150856.375 4212453 1150340.5 2512663 1707581.875 4076497.5 1332016.125 1346726.875 1305088 3547136.25 5130292.5 1055383.125 1581028 3348595.5 2370712 983538.8125 4825498.5 4489810.5 1868148.25 10009880 1400799.125 1661407.25 6116185.5 11903625 1676650.75 7643861.5 3183582.5 10836792 1377843.75 10756321 536027.3125 11823235 1152615.25 342482.5938 9982525 9678614 8727243 2558632 1852168.125 1886528.375 4111659.5 931838.5625 820044.25 437657.5 2252097.5 1983505.125 3346765.5 12020770 2788188 1382709.25 12993592 3210344.5 2477326.75 1081068.75 3314975 8783262 2463282.25 15474044 1841690.75 4738493 1687937.75 2676592 3985403 1674800.5 35711652 2509156.75 28435168 18455988 21495134 7662315.5 5614379.5 304808.7813 17372436 2653361.75 1737188.625 469888.2813 2328755.25 9383919 4528657.5 8912779 745362.0625 510774.8125 3229772 10334070 1502961.875 2994850 560619.25 4354036.5 7074116.5 9896110 2600772.5 4348146 9533347 3877626 1033615.625 1973989.375 10394250 2300838 6469247 2010359.125 1406825.375 5804175.5 5800363.5 1930839 5516295 7284597 11064379 3092217.5 1800140.375 3094236.5 8299822 753306.75 522413.4063 2767102.5 17703262 4165618.5 2648559.25 605674.1875 528666.0625 5102530.5 5012195.5 17021004 2370921.5 3064463.75 135125.3438 7831508 11734888 840702.5 23091094 7392522 2129432.5 7607449 316051.7188 2757972.25 4795747.5 11095344 1524362.875 20675196 8084356 16669402 2663056.25 5231904 3087154.75 26193368 2485417.5 250172.0156 1622769.125 5278504 206503.8281 1036017.625 18057726 21662056 1130423.75 2634835.75 4372956.5 106235.6563 4183479.75 3285938 8817620 11160764 2501910.25 439852.9063 4759338 1119501.625 7800895 11499498 350764.875 1428934.5 2179698.75 653197.75 370606.375 32446340 954100.0625 1931562.875 966839.5625 1899856.5 11769785 3012325.75 8030666 17592234 6557674 10272811 12652081 175922.3906 4399224 6759748.5 6998326 2735899.25 4110520.25 1070012.625 2698559 9235384 7661006 13318886 418563.8438 172575.1563 200345.2813 6519034 3058028 2081782.125 27022068 4273833 6688665 5335352 123041.6094 2051711 3504029 6365297.5 406780.3438 896800.6875 2284586.75 16062604 545266.3125 1036993.625 620783.0625 590175.625 17452050 1825463.25 942173.75 1140206.75 2123835 4005827 3058732.5 1023765.438 27132606 20013992 2165342 389996 996360.125 32009648 495901.3438 170067.2188 1321676.625 916814.625 6766094.5 425617.25 7703747 2951240.5 1615180.625 10211457 203458.875 3054379.5 2818952.5 553386.75 3006299.5 582009.375 170897.0156 1788339.25 2153505.5 3352749.5 1815217.875 2027677.5 14248295 3729416 656703.4375 3742184.5 850307.3125 3123389 609779.5 615701.375 480516.6563 1791011 3356761.5 2304941 1406578.875 3359916.5 5757651.5 3045174.25
3-phosphoglycerate 97733.4375 739490.1875 75019.2344 120848.0156 196265.7344 165056.5625 156428.4531 111992.9844 217836.9688 97478.3984 123093.6484 1400767.375 249791.5625 115914.1719 141553.7969 193072.1563 85715.7656 128484.1094 87357.5703 207630.8125 99801.8594 192948.2188 115970.5078 106940.1719 144173.125 62733.2266 79455.7031 109643.6328 61109.7969 170446.7813 296268.3438 83121.9531 218671.7188 223322.1719 937744.8125 197597.5469 294868.125 182460.1875 192698.2344 101449.6172 70611.7656 196161.1875 254021.1563 82621.4844 145535 201281.8281 217998.6719 182589.0469 92164.6875 112499.3125 98844.5313 72578.5703 28280.0059 101375.2109 66114.5078 217783.5156 84383.3906 57304.4961 114923.0938 129638.3359 183192.2969 109701.4063 275599.0313 54711.9336 112644.6406 139166.5938 131044.7891 124616.3594 87121.2813 150442.5781 134257.125 231911.7969 140984.6563 7800072.5 146475.4375 140963.0938 60821.5625 154886.9688 188423.3594 216287.0469 549495.3125 845818.875 383520.8125 102354.0938 116920.2578 142105.125 182159.9531 178780.7344 629062.0625 124110.9844 1419511.75 155087.625 73684.0391 100596.0313 108233.0703 212004.875 120220.7344 362875.9375 585845.5625 178553.8125 271062.75 88070.1719 62475.5469 206353.7344 145697.2188 255589.8906 233128.8594 565362.9375 329393 6412894.5 97574.0391 299616.5313 145372.7813 33361.9883 257298.2656 785567.375 3406721.25 62270.207 95343.4063 423424.6563 472096.3438 218869.2969 2884418.25 2568248.5 184114.9219 210095.8438 138648.0781 131763.0156 9228324 293691.1875 117782.2109 2490261.5 95996.6641 77477.1484 227086.5 103063.1016 75018.3203 97122.9219 69773.7344 46303.875 132946.6406 101083.4141 151769.4219 97348.3984 876098.375 1522773.125 1697147.75 92316.8828 364672.3438 93203.0078 106020.2266 3802948.25 65620.4531 100683.1953 146896.875 52273.3672 239761.6719 245097.5781 121208.3281 106933.4063 105177.6641 261317.5938 94287.5547 1023496.938 213450.7969 955848.3125 181972.0156 114312.125 124893.7422 57009.5039 170415.2188 212258.0313 169481.7344 125868.9297 3386878.5 96794.8516 72399.4063 108482.4297 89932.5156 485189.5625 139400.9063 550660.0625 106176.9297 130006.4219 781197.5625 197400.2656 119898.3125 63661.0625 2077407.25 390645 326536.3438 226512.6563 141867.4844 145333.5625 76137.0469 114869.3594 513560.3125 609662.8125 91652.8516 227004.25 236088.5156 162471.9844 91159.0625 116326.7578 163689.25 295866.7813 244477.5156 209273.8594 232610.6875 344160.7188 100909.7969 72146.3203 153554.5938 148919.8594 195882.25 299289.75 131469.2188 56158.7656 3811612 85301.1875 181853.6406 336439.2813 224771.7969 106948.0625 92513.5547 68123.6094 143305.0313 104131.8516 81556.4219 73190.8438 160609.2344 93913.2656 112693.2031 335816.9688 148476.3281 104229.9453 159640.8125 26150.7773 4315226.5 207696.0313 201821.8594 276216.9375 3189447.75 4836059 122998.9453 287584.8125 388218.8438 205462.1719 229314.9844 121625.1484 165288.8906 110961.7891 1844635.375 93509.3906 89909.8125 53798.6797 69540.625 261107.875 338948.4375 419190.2813 62369.5977 686872.9375 133262.2969 97159.6016 82600.9453 48442.5195 79461.3359 101101.4531 65198.8164 164073.6875 43833.7813
"5,6-dihydrothymine" 1180550.125 1825216.375 1794647.375 1334094 1426931.75 1048425.625 1100871.25 2001260.125 1203293.125 2375878.75 1207606.5 1342742.125 1184801.625 1189050.375 2021966.125 1801864 1921946.75 1593007 2261653 1727992.25 1247388.125 2021583.5 1466062.875 1423195.75 1587223.125 1192832.25 5125237 1838506.125 2163833.25 2139019.75 2009454.5 1451732.125 2788397.25 1786250.875 2199406 1233396 1573145.75 2652665 2287233.75 4236427 1824728.5 964221.6875 1673117.75 1512896.25 2134426.5 1776452.5 3177041.75 1595400.125 1176422.125 2251227 3404471 1221470.875 1938822.25 605903.875 1833446.25 1842141.25 1607618.625 1039023.438 1574067.5 1110089 809355 1597147 1812672.25 863262.0625 1823334.25 1272462.125 1665824.625 1334022.625 894754.25 905127.3125 1032633.125 854588.375 879675 1601902.5 1668509.25 1851401.375 1111269.875 2065841 908765.6875 2240211.75 1448260 3706018 9933097 921009.75 1451168.25 1598278.5 505135.5625 4732950 639187.25 2812865.25 3160173.25 1219429.875 5218190 1350586.125 1342268.625 8235146.5 2524009 1301993.125 2773277.5 2991296.75 2757036.25 714484.75 1227659.75 880755.5625 1896228.375 1893606.75 2632526 1135070.25 3210776.75 2243329.75 1272528.375 3564453 638200.3125 1415722.25 1841144.125 10490741 1259041.5 1993722.125 808271.9375 1458177.375 5277243.5 894856.3125 1728878.875 1154300.625 1186885.125 2995630.75 2626067.75 2006928.125 694700.75 1006683.875 1211172 1436235.25 1470240.5 2019873.125 2107804 1052238.75 4240002 1037209.75 3100682.25 1501743.375 711336 2752149.25 1866657.125 2292544.75 1512038.375 1318364 1096164.25 3421188 1478296.25 336899.6875 1041050.313 1214920.5 815445.1875 1529949 1241198.375 1434384.125 2169648.5 733382.25 3519995.5 1122640.875 1115346.5 862087.4375 5101652 2149557 4543217 1479087.875 863673.0625 1206060.875 1865043.5 1523538.25 2024598.75 2366856.75 1021801.375 2440738.25 1235262.875 2277307.25 1379213.25 2068815.125 781876.5625 2467902.5 2283032 1662056.25 1503480.625 1181982.125 1340145.5 2098915.5 1170076.125 2832387 1590613.875 1349177.25 1282375.625 2274231.75 1470956.875 871991.875 1408937.375 2884342.25 1193119.375 2254923 1135449 1448052.125 1692582.25 839086.5625 1687531.625 1638815.125 1271782.375 5450526.5 1078745.875 866181.375 1305754.875 1004623 1970280.125 1354227.125 1915093.125 843671.25 962319.0625 8643519 930706.125 5414195 2839350.5 2062158.375 2816632.25 1619367.375 4311910 2010748.125 1167147.125 2744020.75 1659863.25 6289554.5 9376879 1310149.875 1472945.125 2639590.25 1005666.813 7716247.5 1459306.375 2443179.75 1209269.25 7230100.5 1327485.375 2531286.5 1692121.375 4788510.5 509729.625 2156559.5 2107509.5 1230971.375 4598400 2413009 1118235.375 1523106.875 1322228.25 2373450.75 1440474.875 924364.375 2211201.5 2279214.25 1402540.375 1482812.875 1169722.625 2740286.25 4663717 1403908.75 832802.75 909644.75 5230271 1572180.25 1344920.125 2157662.75 2785315 1966738 7355322 2019602.875 1903523.25 3013759.25 933710.4375 2895835.75 896146.75 4859785.5 1466204.75 2560536 1519342.5 7521154.5 974728.75 1589539.75 2456942
hypoxanthine 26799398 37625816 26376448 35099916 25555114 33624600 26294486 9680934 20938134 16229083 21659358 51999088 10893378 17676296 6700924.5 19166910 20755506 21042962 37099592 25711284 15654904 18605828 6862365.5 21523096 27642494 9308698 22380790 9513540 21171624 28898610 12592971 13918092 15580193 16302297 17661540 57007056 8904544 68194008 32859986 36594572 14472487 19015742 16498404 55298888 8836626 45240708 29398028 11920565 25719350 28976950 6924879 3800040 12174362 3167271.75 4923336 17808960 19290466 19662624 12560038 19019994 14186468 12972694 21768542 45486480 8896619 23837826 24209820 21293746 1823632 148859.3594 18714572 6530650.5 14839118 10041527 51839160 29871664 30045682 26317154 18366248 16098103 4958666 31319654 52431112 24297676 4611406 33350396 11851418 34952456 1460025.625 40072392 1894838.75 247302736 41867844 20651616 8876183 184356.9063 25117506 18154784 11004639 2172020.5 18565480 37318828 23629834 25125698 485534.0313 28433624 12183054 17021956 13861403 56840160 23827902 37462588 7147429 2166392.5 31002696 6164969.5 60992024 30027002 10669882 14912957 43201900 15230355 34619340 7618434 16609118 15099275 27682762 24348164 33788648 75238392 11453269 175343.6563 10788227 1267396.375 12192591 12199067 8172842.5 46534992 857800.6875 48563020 101905.2266 7231756 14884378 25829994 22211574 25041970 7787113.5 22534476 24253312 25500554 31241248 32048408 487374.0938 13817056 9171436 20018292 19909928 28491128 11128991 636273.375 37099760 71896096 30410066 1637933.875 121896864 5925502 8480848 19201490 9323313 38602156 20518252 23491272 15804399 22688834 3223082 60208548 28982938 403412.9375 35873572 4885715 29126180 20998402 20890424 10924371 503600288 20484742 8018464.5 24584096 17603270 827924.5625 6890952 53552776 848580.8125 30567754 28733746 18790124 20135610 25367154 278176.9688 5793202 4089352 19044740 26755732 50679168 8250981 22291618 2496953.25 19235818 87476440 9318981 27189066 7208476.5 32797690 592241 5256518.5 544084.4375 2528326 16379984 26110734 25854758 40448392 32893204 26290352 4824900 36047468 17872514 23445112 27720652 19577792 7791809 24634024 32925612 38648436 23632970 6241259 16815344 30843536 45826104 12695589 5259346.5 30291692 129022.5859 22099312 28319250 14265729 22060934 1873554.125 52434808 18611708 48094452 91562488 253130.8906 15642379 25805080 11784484 263573712 19662624 21485430 42959724 4265909 25109924 33858196 11975507 90775.3828 19415320 40137412 14897019 34578256 4800756 23576436 19499470 10255236 52316944 25919800 9913436 15439711 17529632 18516152 36819592 21437698 44433476 51301936 23468090 47316568 3111453.25 19230182 9767894 10852370 22163942 30051170 34551272 19259432 64250880 11861170
quinolinate 312744.7188 325852.4688 499167 617113.25 515782.8125 788423.6875 405696.7188 545244.6875 533217.125 1677949.5 558809.625 560141.3125 540771.1875 319971.6875 288161.2188 611356.0625 667945.625 584684.875 488773.5938 747740.5 370759.0313 745942.125 599832.625 313837.9688 700610.5 577201.9375 617630.9375 596022.125 1249498.625 909755.5625 537333.5625 350648.0625 743966.5625 550868.3125 426579.4063 307223.2813 781413.125 1141156.125 447517.9688 800594.0625 571888.5 2201013.25 473616.6563 1056415.625 2097775.5 1216304 1018613.625 601403.8125 579358.6875 433395.9688 70118616 30607666 3099360 5631887.5 7837238 15484433 1036483.938 863362.6875 292133.0625 53316560 5265395 1659189.375 76540712 2573625.75 19479090 1961033.125 36383272 811147.75 40644844 106010.2813 18908882 2198278.5 1137043 4937903.5 30797512 26953454 958912.75 2073851.75 5822434 22071900 36045796 15879765 13122860 14399368 3607767 17917608 778185.8125 36223500 1317125.875 3524690.75 7233449 2969594.25 7133551.5 75176432 9157412 12958516 61442552 19828930 110706840 517049.8125 12398179 5713078 40393832 4426143.5 1554552.875 16075778 14340826 670567.625 1012861.438 4157325.75 5639350 13530996 4910943.5 3420631.5 2523236 7607308 3377838.75 44377808 5755823 9633629 27593274 70526872 455251.9375 39273480 66083036 7639573.5 7858158 13170290 2788125.25 124449128 6329965.5 11452975 3470561.25 47448452 8036197 1198095.125 11852899 2807952.75 5768075.5 105814744 8531366 3406256 73365152 53014692 1462836.625 1001720.25 2592090.5 2387005.25 24620922 9714788 6411769.5 92248144 366590.2813 30353742 82429016 6348707.5 4369683.5 4805592.5 5140717.5 1380283.375 1460661.75 2168328.5 14443238 6472390.5 74342280 24133982 23710976 13795436 8073116.5 18526394 13828095 5524648 37622676 4781486 2215678.75 646616 13417498 2433629.75 1258287.25 5704370 4655913 112397016 1774361.25 30139326 64969268 1437446.75 44602912 7005057.5 2601579 51805028 13112913 8582607 625528.8125 15223424 1688138 68428144 3989601.25 8863768 70174384 372731.4688 19791084 999458.3125 19738786 19780004 1676667.5 8413501 8335905.5 1172690.375 37385512 48201032 17878802 3277575.5 3848760.25 25031138 6703322.5 7576833.5 4738641 51297416 23451156 9276417 22441596 3382797.5 275946336 38452072 9020626 568676.75 474608.2188 3317831.25 2441242.25 3880430.75 6653885 4386304 2619203.25 20189160 38878044 2212172.5 3373309 47000696 22327846 560371.125 5019106.5 12367079 12877409 4697277 2423558.25 640605.9375 3968312.25 9983526 6813354 7916336 251048.5938 6553462.5 16666155 9607323 2446483 32186644 2503675 15497988 460486.9688 1304283.375 21103256 2860512.25 420438.2188 6175401 4890990.5 3443080.75 1190491.75 8401660 5204404.5 1857566.25 10032945 1299091.25 23031254 627140.125 3311203 911562.375 6191260.5 1278908.625 864472 5443689.5 193476.9844 1531995.375 5375421 12090709 8205175 1308240.875 4697277 407301.75 15440560 2219673.75 404975.625 11114102 3854112.25 7528061 398395.8125 3722997.75 2407750 6583276 14043803 14767213
N-formylkynurenine 84356.0156 145364.0469 185632.6094 221062.2188 201979.2031 226167.5469 224554 153035.7813 372256.9688 357079.4375 216765.6875 223457.0156 360500.7813 142867.25 179413.2813 281039.625 120775.75 174104.75 178341.375 159035.7188 122143.1641 278376.8438 251098.3906 288668.5313 264625.3438 304940.2813 317664.75 161089.8906 240911.5781 167462.3125 242377.3594 239390.3438 225492.1094 169435.1719 347169.1875 257785.5 159894.6406 213935.7344 256920.75 577485.8125 336216.7813 372791.3125 313078.5938 320777.9688 761316.0625 1104854.5 433173.1563 238026.4375 998348.75 136875.8125 2226942.75 1933035.5 420527.5938 617432.25 1705766 1416838.5 261649.7656 597583.375 160798.2031 2437249.5 738866.25 283721.8125 2240435.5 262402.6875 2735064.25 308153.8438 2021346.25 256473.2031 1136019 99119.0156 3126005.75 295815.5938 355973.5313 274677.8125 2017028.625 1264083.75 152537.0781 524326.0625 624746.9375 1648329.125 1078946.5 9129169 1645128.875 1792670.625 247594.3281 1564012 245729.8281 1440598.625 443373.6563 288492.7813 472879.4375 277772.0625 1907556.625 1407107.125 515875.5 2891179.5 3131865.5 733458.875 2199716.75 215493 773295.9375 1415276 1127028.5 355876.375 246903.75 1070079.875 704658.3125 261691.875 142727.1875 554392.9375 239057.1406 1489991.375 413676.7813 645659.625 288134.125 526470.6875 372226.2188 1747789 855712.1875 956208.3125 1945983.25 2842033 271364.9375 1501983 3186095.75 893216.75 881510 639910.75 2410962 3619831.75 642747.5625 1227131.25 427236.5 2431701 521927.5625 307625.0938 616137.5625 794648.0625 311394.2188 3229174.25 389235.125 476777.3125 1197585.625 2047208.5 213839.5313 348745.875 284830.375 703775.9375 1096423.625 592480.3125 243446.9688 1201175.875 197479.5 1626690.875 2231912.75 480428.7188 317138.4375 457381.5625 412127.1875 141919.4219 195024.4688 486376.6563 883173.75 551136.5625 2201188 1805157.25 616615.25 385730.875 494622.3125 1380688 563755.8125 502868 2933006 555801 1647223 216020.6406 686464 361866.5313 174534.2344 288458 818508.9375 2606882.75 544996.1875 1369811.875 1267081.25 127093.0625 1091037 490499.5 801567.125 1975194.5 425921.2813 561561.125 572799.375 1198106.25 1709412.375 172457.25 1143726.75 3537179.75 3469732.75 191102.5469 1223846.125 648506.75 219596.2188 445363.75 298615.25 231989.1406 913531.0625 656225.5625 1320383.25 369786.2188 186779.75 994556.3125 573544 569270.25 696023.75 2415858.5 861059.3125 619467.9375 794954.75 386117.9375 3970648.25 1763429.625 681692 201085.3906 99773.9844 495859.875 330470.4063 390620.2813 1710719.25 1181691.875 601648.4375 904325.875 897911.3125 160428.8906 369461.3438 1298430.625 1344805.5 157267.5781 227617.7656 553037.5625 819782.3125 199371.1094 175394.2656 95681.4375 290842.875 837548.8125 439784.6875 777195 185606.7031 838728.6875 1338439.875 769740.125 507598.0938 1992455.375 208369.2031 1405689.875 193894.8594 131711.1094 1298321.375 361737.3125 206449.5469 1849289 500175 490499.5 1762352 320829.7188 331374.7188 415033.8125 1004623.375 128248.7031 1694441.375 88658.3672 215684.3281 392082.4688 433017.5625 396674.5313 333790.5625 302856.6563 285639.75 296636.5313 413360.25 1256054.125 901010.75 1512541 852352.3125 292998.1875 1636319.625 347679.2188 295469.875 877519.4375 464617.4688 554561.5625 118555.375 172035.0625 442984.1875 322062.0938 1389348 939169.625
N('1)-acetylspermidine 741522.5 1248510.375 960862.1875 987226.4375 806861.75 612970.125 708525.75 952586.125 802483.8125 2341538.25 932958.0625 1263132.375 513790.1563 630012.9375 995020.875 932384.375 937179.6875 968889.6875 1376827.75 1201484.375 1084693.25 1436349 1085443.625 1037606.188 679236.875 2132586 684610.75 1387072.25 1012000.688 1207153.25 260019.1563 1566353.375 467585.75 1014411.875 401738.1875 1365515.25 1588426 1506994.125 815225.5625 1035240.875 884289.75 686048.6875 1122383.5 861717.875 1763110.625 881203.875 786747.875 1504797.5 8832402 31637854 3064490 10190544 50017864 6980813 1769217.5 2003060.125 1317582.375 3595333 12168299 3304772.5 42669528 2886632.75 18191886 2256170.75 1738509.75 2137038.5 18924664 6461928.5 19392666 1372662.125 2851865 3546584.75 28817100 6811445 2280985.5 5698390 5720793 4850768.5 2923328 5652596.5 13989107 3324717.75 5994410 20361692 1743740.625 3272430 7874785.5 1974052.75 3425758.25 983619.375 72079304 28622718 5708929.5 10630558 13520489 19328732 5547830.5 1600516.5 15839540 4868623.5 7232994.5 5832727 2350113.5 4793002.5 3329548.25 2557989.25 2432378 2282477.25 2757462.25 9113605 4240583.5 4735637.5 2610282.25 2390463.75 2565622 24245136 9971074 8226888 26623284 7002719 4205750.5 6571765 48265908 5590459.5 5217216 3460920 5228233.5 10937484 17798354 3068911.25 3738663.75 5493539 4528757 1361890.25 7266112.5 1811113.375 1916428 25734788 2470584 29330094 26574602 8235287 2036195.375 1040211.625 2246268.75 4231265 7158356.5 3521382.75 4202643.5 2622565.75 1164857.25 2127669.5 25867276 1531180.25 13423033 11337636 3839927.75 2010250.25 2743110.5 3429647 2387347.75 2965991 13077934 2982978.5 14423049 3590222.25 19209616 2622524.75 6744920 2499541 24641100 22368898 1558139 1887664.25 3451323.75 6592644 1676272.75 3740023 7560463.5 8166552 4660532 8762356 27268662 2083036.875 8884126 2068603.375 42548916 4243026 4789833.5 4525253 3657487.25 12374241 4227014.5 7539237.5 1901692.5 6242681 7925843 1934094.875 14898833 2528058 121499000 1339537.25 1981260.75 2348762 5794062.5 7511273.5 4815076.5 13207273 69004152 2312183.75 7090286.5 4032770 4485763.5 3516789.75 2376205.5 12959098 4848642 4131426 2447939 4256446.5 14941114 4709696 8273471.5 1735540.5 1969131.75 10650035 3698185.25 2563005 3181114 56340048 10810366 21784872 6644455 5851052 7109011 29325430 8773174 1804698 2083007.75 11815103 12495945 3477937.25 1376297.25 1431450 2308511.25 10904714 6580987 6400395 1591608.875 14163146 15379471 3181411 12898386 57213900 15895601 4426221 1839868.75 4653781.5 43692452 10605621 1545387.5 26558056 3308330 7066146.5 3269091.25 3809105.75 5028362 2986239 7081413.5 3670348 29686914 3670348 3575737.5 2723289.75 3251433.25 4878496.5 2313203.25 4133287.25 935820.6875 1891460.125 3642510.75 9867423 12433917 5172362.5 4313885 4645739 6808200.5 5905170 3504261 2404223 11439945 4041956.5 3056065 1469254.125 5386796.5 2863682 10059086 5857220.5
"N6,N6,N6-trimethyllysine" 31321548 20894880 54339960 11861410 32560802 23219706 40449140 25290928 34424176 21703788 53847032 10752243 34274052 8646989 29058388 8404014 22271484 12411719 27048008 46788592 22271466 20191086 44551024 37212076 51945820 25750694 37418596 22568606 17943108 33953776 41094068 19047816 33298386 40857800 29892716 25528582 39982384 32052624 41960532 18820080 17564474 22575232 23569204 34060152 35820048 37621824 39778304 25844126 13079281 29557858 191909136 96843808 31484850 94803832 103875784 64420556 43256344 28162008 19249700 123848832 102302136 79725104 194584432 40194280 96772400 32845434 147426720 16814658 56117272 28828618 116693504 34975152 38982424 32176476 100184256 122207288 26199426 46683184 77475152 96712464 110350040 83646712 135555808 105940472 20048354 108616488 18168726 120181656 86927560 22973702 53255464 14816588 143546752 104831808 92751568 120044096 172067920 115920480 142635856 15090453 33903244 66222736 77564480 50445452 27168464 57163340 67025984 36454328 19168296 18626296 43588520 64339596 65505292 44860396 30720466 55537632 54111224 194862400 134253008 103309000 127815992 134162352 27565864 69292424 123149104 109986064 40781988 69909536 53095832 175664048 60570956 540017024 38131024 153439360 50916624 28709608 142431392 70581864 41915112 163893472 29069566 98525416 252535984 123442160 19808342 24451772 45143784 40304292 114466920 48662476 52139556 132980160 30090536 41530056 202845888 60969552 78000216 131802208 83653920 33579744 30415400 41158660 172035504 60307380 121303768 98807960 106596376 83329584 121161312 87687056 96009592 47324888 44027868 38282044 45973440 35413472 122267840 123893256 40756700 21179452 76336520 154789216 46759516 176378336 266324544 28152048 101521352 50434944 140966976 128510664 94637928 181360704 23263220 156238720 43579556 126047088 19177802 199828512 169361344 32272116 115424184 29677716 144895936 154965776 32254568 41937612 57736700 90966576 63773820 77528824 95107024 49480016 35772012 59267196 86823176 68200896 37563400 134822336 89123232 90171304 66146084 93490848 248525920 157297152 82108624 25742450 25075990 64596620 25830160 37776604 63485276 117914112 52380368 240963792 114219368 61910676 122448000 216413920 118327976 27382750 66624524 75736560 88629576 57783024 16408081 31335502 48834824 143348720 52271600 62025552 15607743 71941552 94120168 54561804 109490816 419979968 49289836 61585580 25806966 23068872 143905248 45071220 21763514 127919072 68866496 38097824 39183536 63058524 63029132 40281688 50932472 57455368 137817504 33842164 25576230 9538042 56605436 53334288 38952992 74431064 32403522 15827349 34875216 72607408 33361518 69775424 88666024 26588532 112992784 80049232 35347888 53334288 48622964 86807968 24450348 41628192 87106912 26606956 81417640 54288208
N-acetylputrescine 2446220.5 2007229.5 1585448.125 1822894.625 1139480.875 4962456.5 2630191.5 2142598 1399431.625 2188135 1759763.875 2452788 1209411.375 1301440.625 1840572.125 2495862.75 2270453 2331426.75 1516127 3181895 1681407.625 2672602.5 1986113 3054814.75 2035347.625 1720230 2926364 2075309.25 1736618.625 2153983.25 2506890.25 1153359.5 2131096.5 1901752 2558269 1583803.375 1956553.5 3049157.5 2684938 3224416.25 1973424.875 2731637.25 2939381.5 1710500.625 3084948.25 3231427.5 2720978 1706395.25 2780921.75 2904694 8023004 15683255 2454101.75 5279288.5 6317329.5 1990583.25 1846788 2190368 1386980.5 15143239 5206168 3212980 11531148 3447255.75 28878066 1638720.875 8707009 1414308.75 8800835 10015899 6455799 2373984.25 2364049.5 2456722 7226434 11183243 1677342.625 5633291.5 7932514.5 13662295 5660765 10556482 7095248.5 16908544 10663448 1305492.375 1827476 17296710 5382408 1963222.5 4679209.5 1130461.25 9360578 2593209.75 7500626 11110312 37819460 2616739 4215213.5 811837.125 4064785.75 4745982.5 2892541 3170476.75 3052463.75 4126668.25 3307884.25 2001962 1535052.75 3714587 1961055.375 4948630.5 5263330.5 3934048.5 5154199 6942229 2329934.75 26102486 3849006.5 7171399.5 11935774 9677470 4138407.75 5118871 2235311.75 8878237 2764672.75 3454954.25 2923143.5 10041021 3001638.25 7043556 1548131.75 12380620 1781737.875 4255743 5435043.5 3288055.75 4029267.25 21705786 3567777.75 6726736 7228012.5 17707560 2739844.5 2173846.25 1644794.5 2901215.5 3777586.75 3852129 1428966.25 11145446 922233.0625 3257691.5 15218739 2636374.75 4145827 18910302 3933962.5 1371551.875 929001.6875 1050833.375 10038958 2147028.5 5534595 6891657.5 3744764.75 6286954.5 10730490 3934134.75 2948924.75 3051208.75 11623728 1755658.25 1982764 1949246.375 7176795.5 3563345 1543860.5 5844511 2087925.75 8795906 3174290 8782875 10479473 5127861.5 4469701 3106013 8786578 6948292.5 2572358.75 4280931.5 2052565.125 12725396 10028247 13436524 3521283.25 19257888 18910418 1540497.5 11674322 3041816.5 8674757 5130459 1359642.875 8076242 3610225 3934048.5 9473637 10676509 13448703 2332199 1330471 10291987 4744425.5 4149084.75 2487144 17558762 4428013.5 7981838.5 4003451.75 5231286 14413692 14699989 4380726 2764466.75 3204766.5 7274740.5 19310858 4109320.5 3481399 19156024 5886111.5 14837753 21337626 10476198 3975408 10625051 4803800.5 1937127.875 4775623 7305288.5 6463904 4975028.5 10958773 5555839.5 8347583 8889597 8018302 11879684 902781.5625 17996560 6430940 6263379.5 2230872.5 3635584.5 10608636 8733710 1012254.813 4917526 72507296 1439044.375 737209.625 29014222 4258664 4074708.75 4781937.5 1845745.875 19048798 1636880.875 8333543.5 887563.75 12495246 6754313.5 3900577.75 2587419.5 8073565.5 2908158.5 1172771.75 6109414 3498888.5 2086688.125 4312263.5 3105689.75 13892389 14391730 16698488 2163123.5 13915039 6648427.5 2526153.25 11784234 4875007 5310521.5 3761336.5 2639237.5 3995277.5 1887414.375 4600619.5 17114862
AMP 252901.5156 2090680.375 261918.2031 395714.9063 1799831.375 513267.9688 461141.4688 341400.75 1277885.625 195562.7813 400650.1875 1180288.75 392595.375 307306.6563 250787.8125 398815.4688 849055.5 453463.5938 3048569 379943.1875 406042.4063 133556.7344 236048.7188 373642.5 660726 416340.9688 213157.0781 480015.0313 142982.9688 191284.2344 333656.6875 350651.2188 345624.7188 341532.5313 268821.4375 1449999.25 206541.2031 1916264.25 2943730 327907.2813 340295.9375 279600.75 1406498.5 368505.0313 638576.6875 415448.4688 279553.2813 277139.7188 1151556.5 420676.2188 1778381.375 3776183 1297258.875 1211221.25 1329341.25 791663.8125 1996001 432286.625 1034238.813 764664.6875 793657.5 1089971.75 819567.75 1302827 1922518.625 200290.1094 1735196.75 858753.125 492357.9375 950315.875 617184.9375 282079.3125 475368.4063 1311075.875 459680.6875 11148094 1384073.375 724354.5 484425.0938 2573905.5 526515 1102097 2723220.25 1371184.125 2197028 686613.9375 952525.5625 592069.5625 1886713.75 2086951.875 6560549.5 591528.625 10632841 829573.3125 1735378.625 6939291 528607.75 317390.2188 1004478.063 3310075.5 267270.4375 718495.375 269254.1563 1887354.625 1116501 367133.0313 1440636.125 1463888.75 1220357 246819.3906 673977.75 14983547 954145.3125 5065136 332408.0313 994209.5625 372588.2188 3469688.5 11397688 331302.2188 1331694.875 3149016.5 1014157.688 332769 10936896 7883669 931583.625 450856.9375 738316.5 635329.3125 1584658.375 18345942 1178219.25 676570.6875 275862.6875 4927133 1638778.875 851957.0625 718643.5 1529271.25 1649211.5 2272781.25 1342105.75 615140.25 450985.125 1082287.125 1374862.375 633758.3125 1602993.5 3664066.5 2585606.75 4829058.5 1019733.438 1336594.125 611387.9375 772384.1875 6434374 1984959 687371.875 799775.3125 1594209 1224535.25 649344.75 1181728.5 550148.3125 513057.5938 747860.1875 915185.8125 3528773.25 773498.875 523080.9375 472934.875 7929428.5 447793 1656937.375 596933.3125 846153.9375 1291010.25 425380.8438 1495734.125 986943.625 1035309.5 4202371 1250620.875 808642.375 805230.0625 1202089.875 1184587.625 2590066.25 709900.75 1438142.375 2285921.75 1648809.875 1184208.5 306417.4688 842940.9375 2025081.625 1559076.75 806033.25 1402295.25 1070079 2928043 5379397 1419077.125 739721.625 849055.5 1078083.25 792644.75 1637588.75 1728171.375 3219029.75 496402.8125 1673819.375 978100.25 1815333.125 679770.4375 353898.375 1235916.5 1520035.75 1672085.5 384110.4063 643296.625 567009.875 2176843.5 334260.5625 465179.875 980349.5625 806246.6875 436400.0625 768510.125 449549.125 4537062 184288.5625 1186330 285777.1563 14444954 333566.5 601897.0625 2081986.875 250146.3906 3757181.75 864428.5625 327351.2813 1284060.125 472351.0625 785639.6875 894020.3125 1840845.375 1234699.875 752135.5 276243.1563 497685.5625 283415.6875 312504.5 1597050.75 647161 1687070.625 2195308.5 933304.5 368765.125 67136544 767731.5 2325658.75 688187.6875 4114266.5 2455794.5 707538.875 353725.9688 1423112.625 999368.3125 3443200.5 1543050.75 563268.4375 372458.2813 837169.8125 934413.125 545526.375 1398073 3980996.75 399692.3125 293325.6563 1995347.125 791825.75 1572682 2806619 2084483.25 1800238.25 407823.1563 6322716.5 515154.6563 295023.4375 608902.125 416933.8438 580682.1875 352620.4063 1597476.125 232352.4531 1582270.375 395164.0625 598949
5-methylthioadenosine (MTA) 599304.4375 470945.8125 657600.3125 539032.375 498415.5625 581245.125 554478.625 699023.0625 565450.1875 1536372 666020.75 469214.0625 577535.5625 435024 327902.2188 654254.5 487283.9688 848307.0625 517505.6875 596923.0625 389943.8438 651358.4375 688631.1875 654505.0625 859586 678562.9375 1137766.5 432889.0938 747668.5 666161.875 733504.6875 481009.2188 790233.5 685464 1028737.25 229701.0156 1213303.375 1162119.75 621468.125 775236.8125 538797.9375 628044.375 359236.0938 781847.625 996615.5625 723194.0625 1050095.375 525135.3125 573295.125 641030.3125 4039890.75 466648.4375 725763.875 1832748.625 3653723.5 1784015.625 545368.5625 792292.25 270864.2188 4453062 3169344 1531401.625 4905982 951280.0625 1201128.5 499539.125 3154474 448835.8438 5831484 923958.25 3764155 546569.125 1185157.125 822258.125 3018612 1964321.875 496397.8125 1894413.75 1227375.875 1725454.875 2999458.5 4058250.25 2073316.375 1895991.5 1692925.625 1840551 389783.125 3537866 1622880.25 359418.7813 2192186.25 326218 391225.875 1772817.625 1315611.125 2500625 8338467 1792700.875 2898329.5 191335.9688 786326.5625 1381791.75 2299968.25 1335524.625 1040015.75 1606471.125 1553792.25 376316.125 418936.3438 1028714.375 914103.4375 900692.25 908610.0625 823353 1255405.5 2168720.25 1079465.25 5547126 2396838.5 3223540.25 5411266 3724784 554822.6875 2800825.75 1146589.625 1534798.75 1141688.75 4752708.5 1137568.625 3032131 1115082.875 1618505.875 1208709.75 1321174.125 962145.25 258161.875 1971623.375 899919.8125 1198460.625 3490782.25 1382864.875 1275524.5 8341628 2592400.5 863987.9375 527353.3125 843083 1001780.125 3113135 1167034.375 664928.375 3766168.25 739679.3125 1601881.25 2070916.125 1327093 233115.1719 1590276.25 2219425 669586 964421.6875 882846.8125 2577492.5 895393.3125 3849916 2694587.5 1062663.375 3275496.25 556336.75 1820420.375 1268724.875 986742.1875 1141651.375 890149.1875 632142.6875 709112.8125 2842358 2102688.75 876530 1170818.875 958825.8125 2800524 1100164.5 4415836 7724666.5 813390.6875 2426181.25 672546.25 2871383.5 3238598.75 2133101.75 2729491.25 654673.75 3470231.25 2623081.5 3942095 390283.2813 2529505.75 2969670.5 1098266.125 2249982.5 388747.5938 1157803.875 5424476.5 577932.9375 919205.9375 1482787 1628248.375 4191248 2665347.75 5437963 696523.375 762846.5 2644472.75 1906883.25 1601386.25 764617.9375 4610360 12318781 2115678.25 1218382.25 1188180.75 3832659.75 3624817.5 1353603.625 642955.4375 775352.625 1846916.625 1138637.875 1363576.125 1911992.375 650559.5625 2085730.375 3516450 4823732.5 1901329.5 1861747.5 8176984.5 2324926.5 1203796.375 1536068.75 2667307.5 4075771.75 1396096.75 1201128.5 972278.5625 935433.875 3884625 1455433.375 1792024 318788.4063 1522541 2433750.75 1650508.625 2012037.625 4297718.5 1233510.625 2178019.5 410401.0938 1408141.875 3032046.25 1109106.125 458270.9375 3055176.75 746675.5625 891311.3125 1394280.625 1577109.625 661260.0625 810859.5625 794925.375 881366.25 1027852.813 749626.125 1410492.125 776466.1875 1418385.5 1270509.5 484375.0625 4735135 727185.5 723947.625 746406.1875 1794983.375 2952005.75 2311786.5 5389581 548371.8125 8038074 1245620 723880.5 2217937.75 2005967.125 2203719 924954.375 1060397.375 1491548 931800.3125 2313348.75 1931164
arginine 787246208 476395584 1114317184 563158144 776627776 751799552 957448128 944626240 1143510272 854089216 1175836544 798465152 1361464576 449573056 798418112 671302912 870743616 982043072 771268224 998057536 950228032 855077248 536959168 1052151104 914910784 1232723328 699774592 688581312 673498816 634418496 848869824 898799680 728421376 1218831488 1186477696 803364224 1552222208 925214976 1086549120 340467232 815703296 628347456 830968512 1042556800 1040695040 902490752 757091328 906475008 519252608 898642944 928226112 248107840 793206272 636601536 225295440 249511088 991607744 743424192 518194976 1020300608 295402400 737670336 533249952 524424416 309620672 540194496 967414912 573436096 379635776 530277632 843388928 494004992 572714624 300902976 496184000 545322176 489859328 479250912 438006752 359406272 548910528 749740352 445471840 443292928 497864064 449448576 385712896 534271808 807537280 411751968 660631744 502908640 853635008 514665664 458544768 1009026560 880391744 573276288 265678288 349608160 592216576 602505408 486771872 419179040 517120064 323728192 457286112 565845184 289902592 308799744 490437472 362754880 528261280 490587712 386414176 438178592 399478336 256989264 755340736 595513728 2013190272 612697344 398466176 561276864 441676288 1061288512 249454160 352288640 440238752 392318496 760732544 366053984 569060928 443289824 580976128 429569344 408306912 528490176 297114592 332698304 163344064 813161472 1629569152 459002592 329315840 578857856 718048640 437783360 530249952 470904160 318324064 491537664 421582976 198369472 329649696 456351040 2041135.875 368065920 502418272 529597344 414397696 381915072 759895168 801777024 263547840 1094023296 581567616 727031296 396509984 493205888 771666816 944935872 286934304 529952800 782724288 534688800 602307968 800017152 471149600 353531840 784141824 552299968 311241696 441102368 883066944 412244224 364730944 619913280 1129369344 375800608 401171168 552915520 333883648 546282624 620728192 300883488 235856048 479454464 465761216 256372560 400737632 560146176 239374080 675726080 538888960 652891200 619340416 808121728 282376576 447430400 235557936 585875776 369378144 496832800 482004160 555285504 438856640 369739328 589466560 504232992 639836608 586730944 581729600 754001280 717259328 473921152 386974208 444254688 407360320 887604352 558412224 424443296 790247296 979359936 760902720 345385920 1066080192 831388736 482173216 925364032 544856768 462133472 760887360 505777664 461217984 447326048 172376640 1061959616 530101376 465672384 662303936 443691360 167722496 323019072 947949504 731678336 5335903 303928000 534154400 347940352 565197312 524809536 434142240 522520608 396691232 426035776 506574528 400825568 359624384 465580032 499392832 538013696 530101376 571123264 507885472 238603472 444302336 395768128 792203392 958159232 655623936 430580416 692224704 454153120 167187840 567669504 607534464 497559680 354885056 701238784 645658688 371081184 1242948352 452161728 691795264 424017536 1031005120 412442624 178097600 222622128
argininosuccinate 64683.5195 122860.4219 59127.3555 62922.4258 90962.125 254937.5156 287306.5 109428.5703 73841.3984 59566.1602 406195.7188 147166.7656 225066.2344 308740.4063 241300.3125 351259.8438 556175.25 193059.7188 170558.6406 285825.9688 169965.3594 60948.3984 90914.4688 91196.1719 411670.25 134058.75 708267.1875 82177.8359 280763.9063 45888.582 52442.582 163041 390991.0938 363488.4688 133920.0781 74037.9844 149075.5625 96393.3984 173472.3125 310498.3438 67457.9375 188014.2344 456610.5313 132030.7656 235074.4063 172844.5938 107732.7109 367157.9688 234596.25 80144.4922 111190.375 296402.2188 45536.3906 85835.5234 73433.2188 155505.5156 56628.1211 255084.3906 449419.0625 103949.1797 252174.9219 262859.5625 157423.1719 520037.25 52196.9102 291834.5 86220.9609 122899.2266 203216.0938 395612.0938 80599.2891 91460.4766 158814.9688 107678.6094 84859.8203 71800.0703 342207.125 294567.4063 375537.625 68402.0391 176935.7188 170262 55255.7734 33805.1055 28508.9707 353961.0938 278141.5938 69906.5156 492764.75 468741.8125 77585.2578 139445.5469 587480.9375 364438.9688 355862.0313 566989.1875 221491.7188 363031.125 137307.9063 59437.1523 43959.5859 364952.3438 195448.5781 393718.6875 61025.6289 297736.9063 301172 448494.2813 1239316.5
aspartate 17675864 11583364 16105129 24589068 9367458 12310149 20589282 13274657 11923938 17412884 15776304 24556824 7234281 8149595 7903932.5 13489812 7363022.5 20745822 22136564 13126556 5351397 13685612 8394131 9860392 6069010.5 11245118 9286563 9162372 9369043 6469025 10753480 4941300.5 6191745.5 7741241 9805968 10184012 17174072 19522438 5551826 13842409 8501231 13931389 9993362 12977151 9640679 20007236 13824742 5130566.5 14761015 9818639 27188170 24373288 22477492 9766064 26503506 9823668 16251500 13320346 16465183 13931389 33601856 25807476 26650806 16042861 76223072 13238335 22308482 10195570 10546999 9159154 39040704 13928957 10704871 9054267 9585804 37534756 12531520 9181067 11248163 9728228 15113143 19117294 28394620 12375158 14591420 24705656 10025924 9766789 42729992 13796002 24824450 19036850 120791360 31041094 17639342 47920528 15332973 7797061.5 12145703 17483372 5505107 17750628 6855020.5 18049024 12013213 9785859 13194995 9712181 13937082 10778174 14402343 12019885 16198092 10347073 9410756 9505747 7517764.5 13315578 21075464 11791649 25030396 15509526 9611926 23368386 19285084 21101326 8073082.5 9055810 10815616 21099412 12973816 25542526 10236193 35787492 17247466 19740190 13791056 10184699 11609736 18123596 12688887 23175388 22566386 15222065 8828963 8236777 13724116 13587865 7375053 24486684 10319282 17448798 12753378 10251685 16897400 15169781 20280648 24392020 21243738 19081648 16914752 17573008 19224014 16956054 11473963 21719588 13310178 25025952 24667262 17849410 25078532 14290709 14038037 9901733 13598324 12884113 21320696 13441999 11924430 17323746 18371332 15069492 17232666 11807014 20401616 11545495 10566666 14287633 39370668 9352849 17291454 30926024 10159638 21702846 19498870 11058898 8308316 19053802 36603656 20428704 12271310 20252440 23003018 28907324 16636168 45769264 55698156 26942024 10514908 26116632 16125037 23392542 14670488 8795795 28996762 10717210 8468847 16475439 25414724 10237054 8094694 32783058 11526568 28802102 14579678 16726644 12393172 27876672 2752359.25 7646434.5 14355874 76038432 15579321 33816688 19073294 46575796 17889760 55477948 10645403 13086454 37237176 11285968 24201890 17368968 12751129 12486329 27857848 11442474 18593284 6008607.5 9747673 9466784 7575217.5 7422789 19245124 44107176 8182905.5 10366519 15607819 11661219 25209700 11162287 12951370 33766016 12052657 16434712 19312012 8346453.5 19450650 13361146 10720889 19099554 11282231 187693888 13014458 6778420.5 22536390 13446639 25838678 21687734 25727032 18999068 10239779 11574106 22495210 20988952 15805578 12233697 32702436 18083568 10839309 9389490 10525032 8104765.5 33952284 11029864 20145428 11003479 6842364 6017499.5
beta-alanine 10729641 11103382 7526809.5 6736986 2325117.75 4085247.25 12314478 7782374 12211709 11108627 3785207 6880828.5 13056069 7097289.5 9838229 9032581 8475104 10135703 8691303 10001149 4134062.5 5403735.5 8306289 11604558 9451523 6172591.5 7998593.5 11795254 13766128 7855816.5 14332509 7998141 6920037.5 17926918 7007868.5 6694095.5 15688163 35428784 6441048.5 8016126.5 10972423 8305002 5852914 4886085.5 10177097 9724415 6548048 5268398.5 5702255.5 8614679 9638938 18775032 4714611.5 4949845 11577138 6180038.5 4776748.5 5495584.5 11209025 16391994 10641886 9758947 12099028 4442268 6643880 3913671 12151334 9529426 8358234 6464934.5 14558710 5588905.5 11093830 8305002 11966516 11167003 9460896 8422819 8433753 7889704.5 6907131 20566434 9642009 8670936 8837453 6787918 5372272 8827683 7768370.5 7469183.5 4235295 5115515 25218434 8902493 9542559 9488865 14526897 13895818 10754182 4370964.5 5517385 9706770 4867612 13459941 5308629 6020065 7840579.5 10990493 4206177 6608286 6166039 5434181 12237175 10743695 5167919.5 9865168 6582243 10313602 6958508 4798807 24597256 11449357 5265433.5 10384699 9081907 13057433 5978408 5327204 7362426.5 4627322.5 7948647.5 12682346 7340719.5 13737296 5462255.5 5411601 7142381 8304293 4163988.25 12771284 12663771 8707547 30779664 11766452 6369740.5 4330318.5 9318859 5835519 6717216.5 7436962 7237592 11840124 6189817.5 8835864 11425484 6094508 25513776 14670736 8305711 7029085.5 4741271 8932420 11404929 11521155 7784845 14616093 7348818 7351397 8180479 8911599 6728233 5791216 11109943 5098171.5 8885750 8198055.5 16993922 9478596 7156984 11764036 7091086 23428874 5938688.5 11069954 12296563 4712974 4895057.5 9486603 16783958 7686368.5 10423073 7708579 7525763 16036195 7765674.5 10443532 4743474.5 14267053 11835011 7092585.5 9837140 8161651.5 11581840 13060913 7565348.5 9680919 9784905 12084280 7500214.5 13939379 8463153 13798701 7598055 7019931.5 13303918 17856588 5215938.5 14697373 12543349 13669483 9030371 7826927.5 15240808 13498746 8242046 4858045.5 4541517 8411758 6861493 16208811 15465421 27906188 7679883 37676232 7517550.5 11348325 8018690.5 15926376 6861832 7262207 14330667 5278155 9666294 9483997 5380916 7793962.5 8580258 25345198 12089127 6296730.5 2767891.5 11563750 7245197 8484581 6970714.5 18232512 13485236 7440021 4717736 3999536.5 36597012 7434056.5 6588057.5 15884244 6633809.5 3828932.5 5749155.5 4704680.5 11835426 5679809.5 7253084.5 8803207 17309942 7267644 6678981 5725856.5 13491205 7038327.5 7096490.5 8082589 7067169 4121359.5 7237963 12613937 5827822 11149504 11914175 7563675.5 11746442 8378470.5 7944902.5 6890590 5582478 8955266 7171493.5 5595125 9714345 3399065 13786289 7898456.5
carnosine 77971.8516 62699.75 132862.4063 92633.3516 211292.3906 215712.2969 121233.1094 111925.2109 132846.6563 94909.1719 157304.875 109346.1641 53934.5 293990.0313 50224.8945 167355.4375 61082.9141 56452.2852 174454.4844 51247.4844 122950.2266 139244.8125 79567.0859 125928.2109 214210 95578.5547 114561.5 691688.9375 726477.375 251776.625 154010.8594 3952575.75 338312.4063 298705.5313 125252.0313 570387.875 521136.7813 443058.875 369260.0313 181747.3594 5359094 103560.1016 3793435 326460.25 7029805.5 46580572 184537.6563 176291.8594 111236.7422 389205.5938 232954.5156 113046.1328 259609 654184.75 144597.75 878744.375 503303.0313 334689.5 565126.3125 239171.375 156574.9844 286598.2188 119322.6484 162815.0625 129402120 233242.8125 762645.25 2573331 13292415 151852.6875 421891.375 188322.9531 164095.875 338932.0938 280378.0313 313302.4375 316765.4375 222452.7813 171432.8438 258401.0938 48544.4453 218433.8438 167698.9063 150559.4375 220592.0156 458517.375 295768.5938 209479.7031 229334.9063 77532984 509967.2813 94950.6016 317144.0625 154838.5 1754394.375 175615.8125 198634.9688 188002.3438 479756.1563 200130.375 2174159 208309.25 268469.0938 150753.4375 101746.8984 148008.3125 88151.3984 131182.0938 1526295.25 1606290 60292396 159608.9219 55067.6914 228106.9688 152580.9688 121227.4531 120115.1875 287437.8125 2427695.5 57335.9805 69588.4375 1059028.625 383181.5313 165087.1563 171358.2969 4233157 84151.8281 664268.375 321677.5938 216696.4688 174335.2813 1009311.125 362491.3438 267445.4063 2810783 2101461.75 136215.1875 139410.9219 238923.4219 146254.0469 93738.9922 267626.9375 476391.1563 176518.2656 256199.125 132085.4844 38120364 865925.8125 183066.0938 328988.75 341813.2188 7267315.5 461555.4375 56360.4219 5564973 860588.75 68569.125 1233599 581699.0625 252024.5625 63784.2969 181399.1719 245474 2284021.75 125899.2969 1539677.5 315003.9063 160820.7188 276215.1563 195494 266701.7188 65226.8555 3357975.5 663409.8125 171655.7656 124308.3359 430699.5625 2319078.25 111846.9922 180643.8281 550842.5625 3091625.5 2886902.75 88866888 505291.5625 65255660 86018648 1145005.75 862286.0625 427319 207318.3594 93273.0859 145330.9844 368860.3125 1072322.25 172366.4375 276841.5938 1098011.625 28455020 696954.75 405857.0625 1556684.125 804765.3125 191582.5469 145871.2656 2084831.25 874399.625 221686 430084.9375 1964288640 864077.75 44693960 231010.0781 283385.4063 78621.375 205366.3125 1468479.625 140437.875 70694.1406 230370.875 4757839 105968.9766 4456070 540224.5 91580.2109 66506.5938 200335 185174.75 316955.9688 163871.375 2835633.5 117572.0859 523316.5 1292805.75 385252.9063 174560.3281 23816836 162844.0313 946713.5625 118079.8516 263270.8438 1357904.125 6462004
phosphocholine 2589253.25 4796057.5 4587879.5 4030230.25 5417035.5 5559507.5 8450518 2920872.25 4423807.5 2009819.625 4556931 3626277.5 3189088 2090365.5 5945128.5 4542801.5 4325117 3784537.5 4115727.5 2609636.75 2309662.25 2292046.25 5333203.5 4600302 2516049.5 6779655 3351174.75 4763566.5 4608818 2930793.25 4464397.5 5860086.5 3383936 12151564 5745651.5 4956760.5 7778877.5 6188960.5 3870586.75 4790824 4551949 2667549.5 5201270.5 5872351.5 4668725.5 4210252.5 3509699.75 3173326 3753284.5 2598782.25 7176176.5 5090149.5 2997267.25 3786571.75 623667.75 3071529.5 4835996 1967516.125 3742181.25 5033422.5 3383520.75 3108140.25 17021254 3262265.5 11380000 2536031.25 2865186 5409706.5 2588238.25 3920367 8090028 2346335.75 2564541.25 1754150.75 10087551 4308723 6244572 1203351.25 4321856.5 5940395.5 2872067 11254304 6252342.5 3663041 8381971.5 2062691.375 1650244.25 2263495 3090511 2283512.5 2110765.75 1855922.375 36409116 2062835.625 5885810 5885316.5 6018002.5 5376819 3423790.75 1986163 3064039 6959473 2234321.75 1714793 1982062.5 4979485 1071968.125 4316918 3312928 2150592.75 5145552 7899524.5 1969068.25 5258466.5 4927754.5 4927275.5 3627837.5 18134472 3703837.5 2051250.375 8933792 5292237 2951607.25 3934546.5 3272502.75 4293115.5 3081924.75 1614445.25 6450898.5 2926571.5 5389868.5 5031260 1896300.625 4832009 3485120.25 2692498.25 1685055 4173439.5 3313330.75 11162201 2477764.75 5229900 4371795.5 4195457 4202653 2291969.5 3446290.5 2500213 4750928 6837830 3305088.5 3317148.75 2646110.5 4451042.5 13993385 4120352.25 5355063.5 9966098 3141458.25 1620581.5 2555681.5 4393789.5 8380305 3286532.25 1374207.25 2189917.5 3477136.5 3966567.75 5670701 824631.25 984597.75 2794438.75 7429185 2876450.25 3413185 2531513.75 2165348.25 3846750.75 4852464.5 3448389.25 7018087.5 3571810.5 4673414.5 7848054 3011407.25 3001039.5 4000356.25 2530173.5 24653272 3422770 4936983 3851536.25 2938215.5 7362820 3211596.25 5949750 3223834.25 4492125 10433346 2003975.125 7167488 8099072.5 6121321 2696999.25 3263102.5 2966005 3378307 7522562 4250065.5 3456307 2351129.75 3242405.25 2677171.5 4167245.75 3759498.5 3077502.25 2818767.5 17067850 2637747 9379552 1863844.5 4153899.75 3513955.25 10360627 2276288.25 2068771.5 1989292.125 2538761.25 1760328.625 1786506.375 3780429.75 2609074.75 966265.4375 9913122 4504064 2251617.5 1964792.375 2724452.75 6052038 4112081.75 9121818 3949211.25 6104899 2743003.75 2463647 2403018.75 2747181.25 1322241.875 1619318.875 2737214.75 1584429.125 4993916.5 2848706.5 3539188.75 4563327 13880748 11376341 4224075 2733658.25 2021761.875 21041680 1914946 5152581 28908214 2954457.75 1564137.375 3526572 3024834 13008499 2232863.25 2494834.5 7690250.5 3459789.25 3526572 1943475.75 3020283 3093971.75 2961063.5 4974437.5 1220880 4572923 3851901.5 1858095.75 1914263.5 7547091.5 6217256 5822304.5 1845547.125 1954472.25 4035025 1527306.625 2047191 1432401.25 3043483.25 1945830 3336534.25 1715092 3427000.75 3895342.75 4086544.5
creatinine 619260608 496411328 766964352 592735744 499411232 1047053184 447955808 810942848 963607680 1120979328 870826112 607182208 976335424 547001280 663882944 742603840 693053504 516882848 672515648 878694208 725521728 764381632 1038035968 770383552 864342976 588108928 683602240 662424768 807152192 851222144 636829824 558777984 908863488 1223878400 1009361856 548584576 689042432 981194944 733354944 607152320 763473728 848949952 728760256 797202560 963568256 883673984 718753920 616319488 516516544 672296960 2263311616 1698150912 1117555072 1123171072 1415516928 1991946112 764434560 701507584 541080256 2593102080 1282920960 804485760 1832331904 677816768 2925788160 366132992 1555968512 633158272 900154496 803008576 1812642944 750268544 992013952 516959104 3120993792 1385489536 843425792 795188224 1381899264 1405619584 2328447232 1239816704 1811200128 1542441216 397778048 721955968 538320576 1416400128 493549664 518489664 500490432 442719872 1595007232 1592178560 1278969728 1153334656 2730315008 2031203712 2030478976 490819392 909984000 792363264 1226720384 802154752 485903680 1543075840 897259136 695364864 678526848 575528320 1061507264 1289654528 1233558400 963568256 785353344 1039843968 658925888 2358068736 814062720 826990848 2109497088 2832695808 636954944 1842965888 1343232128 797908672 783308160 1032473664 1922976128 2140349056 620235136 2710246144 965358656 1924946688 687930624 393545888 1229373184 831360192 569137984 2808549376 1032347648 563964096 1366048256 1273559680 637183552 587522816 694705856 803085824 2367151360 839832896 1299098496 1194844672 555979456 1162769536 2510635776 1061963520 487434464 998090944 1383241728 719481472 669935936 1030820864 1367224448 740879936 2785970688 1265066368 1515186432 961777792 1217911168 837326656 635778112 876201216 2968637440 898012672 925871424 904694272 1131532672 666576832 629920256 1176861184 494276192 3473514496 622212928 3037168384 1623624576 1009926592 1711355648 1041437248 1871848576 1907001728 1403408896 2464273664 603214272 1742503040 1143007616 3507503616 739177664 2325287168 3126862848 770626752 4482167808 474288064 980484288 1254565504 602071360 852236608 690954624 425398016 2214654976 1638697984 1071973312 750848384 621558592 1959869696 2244481536 778444672 627976320 3307676160 1076215424 1495034112 1043348032 717692480 3971482624 1948994176 707519552 893016256 710838784 1881207040 1588033536 1261722880 1442760960 1208568704 509318784 3017136640 2463598080 491374720 1175374208 2782569472 2693424896 810175616 1573337600 1670502400 762595136 1583653632 1097327488 823616128 1413504896 2031244416 1357719680 2934759424 537754368 1611264256 4378637824 2989553664 651675840 2386338304 1216008576 3441955072 471989312 739139968 1959436672 872236928 739575040 2334003712 1703405184 385502912 847615680 1492299904 1846250368 765776768 1297501952 812524736 2460911360 477828288 666202304 417007776 2263931392 724649024 818546304 915829504 889928896 501997792 1215338752 2691780608 1914467072 1886257920 1864649472 681824000 1544512256 1341616512 961805760 1840092672 935977920 3045880576 527653056 856405120 1121076224 567316928 3983181056 1889177088
cysteinylglycine 2532537.75 1570043.25 1841757 3302161 1021951.813 2949373 2031018.875 3058314.75 1909822.875 1840545.25 2354704 2971875.25 1977344.25 2743338.5 3261650 3971519.5 1940172.5 2814511.25 1820532.625 3616659.25 1899976 2082576.5 3686155.25 1790747.125 2416624.5 830970.5 1834219.125 689276 1191816.125 1204432.125 2169038.25 992620.6875 2020745.875 3563063.25 2650527.75 3312362 1736559.125 4360317.5 2228109.75 1333042.25 2101221 1813775.375 852202 2045210.5 955559.125 2725163 3266417.5 1365757 1792380.5 1439449.875 1337763.875 2474982.75 1772936.75 912051.0625 18177868 2441458.5 900218.875 282876.2188 1559374.125 9707626 7642809 2758312 1281047.25 739157.8125 26249720 450775.75 16406771 629902 1715758.375 12159460 11079352 303275.0938 388270.5 355284.0938 5417911 3596050.5 1201703.25 3506359.5 2670310.5 5849025 1744317.875 9432347 3369422.5 2724346.75 604849.375 417178.6875 1051769.5 4066636.75 4366882 403438.4063 1126582.25 315369.3438 19951420 1614238.5 1214723.25 4042017.5 8849219 2045210.5 7219564 855479.9375 866215.0625 3605453.75 1337646.625 4193935.5 837027.6875 1811099.25 778199.0625 1213591.125 1349449.625 592212.9375 262084.25 3340629.25 2158895.75 1315777.25 657698.5 2308174.25 446303.5313 651864.625 989535.8125 1583545.5 6205155 12050007 952440.25 3273403.25 1809402.75 1925407.125 458517.6875 2091675.25 1074938 5976620 1502468.125 5048024.5 750810 2265694.5 707663.3125 653600.6875 803949.5625 692627.3125 1386944.375 2085705.5 2781609.75 2702261.25 3148000.75 1626717.375 1098095.875 567264.8125 764005 867665.25 1296986.75 2065527.25 2351893.5 2637907.5 979094.1875 2127495.25 11461416 839284.0625 295490 7008786 2546905.75 3591680.75 1155170 702431.6875 7543520.5 390107.3438 16510093 339830.3438 244125.4063 1753593.5 2574231.5 1099461.375 2970832 1550454.125 32131634 1869394.125 1147040.875 1132230.75 4304058 1687029.875 1142988.125 3628835.5 1556451.25 2024893.75 2005947 1091653.25 1232810.125 1637370.125 1765201.375 646138 10887993 4926854 1627155.625 7457941.5 3648682.5 2832679.5 6811237.5 6836022 633851.125 16564874 8927986 6388811.5 9534517 1091974.375 6414184 3634748.75 1177445.375 2254160.75 1706019.125 478986.8125 2165396.25 6706063.5 4649207.5 2762111.75 2542748 2454257.5 1792727.5 119148.875 953887.125 15649129 1004160.25 854634.3125 1179123.625 3648705.25 8766792 599320.5 2070586 1573372.25 6335705 7324691 2493626 793971.5625 10524244 1452437.875 19162768 11876810 17621764 3311610 2951385 652313 1558478.625 774767.625 2689842 1767046.375 1274500.5 3196231.75 4142031.25 6700373.5 3198694.25 4946396.5 4884141.5 833165.25 4904695 11333847 1800889.25 12737415 8638482 3135892.5 838730.875 3008822.75 21377874 1440717.625 1544580.25 15981052 2074428.75 1119647 2549572 592923.8125 5836996.5 552843.1875 1136889.5 3890124.25 5167241 3765437.75 2275200.75 337981.7813 3112693.5 2014108.875 2602344 1966219.375 2610462 442698.9063 370088.0313 4099429.75 6858948 8531311 18458500 1665539.25 5847965.5 3853476.75 1639957.375 1138995 8084784 3362936.75 5866984.5 2068639.25 1258046.125 224716.3125 12110488 5905449
cystine 4321956.5 5331302.5 5834253 5343506 3122321.25 6648465 4710733.5 4803171 14507872 10145569 9538435 12990322 5559064 2820971.25 3794604 12468033 5663954.5 7020808.5 8264194.5 12048956 6411656 10281906 3897143.75 11623018 12336566 6181655.5 10675347 6195458 8259523 8162678 4152887.75 4451617 11754692 6674916 8007285 9160638 8705612 17242566 6163054.5 4705102.5 5340354.5 5800177.5 3913600.75 5565429.5 19495080 12289959 8262509.5 6619901 4785194.5 7824215 11386711 2474523.25 3725715.5 33768728 16190189 11146693 6518781.5 10101551 3411408.5 4655521.5 6202859 6764866 20911326 5651665.5 32291340 12051312 2926442.75 5273542.5 6330890.5 1644766.625 9784704 8274662 10094624 4518723.5 8900105 9824861 6898389 3606335 3364088.5 9609147 12485805 11586003 21643774 6835730 5079637 7541649.5 5001472 8762890 2191398.25 4648010 5976197 1809674.625 4122834.25 8274890 6985527.5 18512720 5496905.5 14344015 5679759.5 4474403 4842783 8569365 7102284.5 2751274.25 5101018.5 4757051.5 4300666.5 5459317 6224445 5435075.5 10828052 11018722 7090821 8107332 5406910.5 4398278.5 4655963.5 43019552 11458713 11693262 36379848 20628174 4338684.5 24746120 13168830 15179739 5424935 4842440 11657138 12553711 15819732 6955171.5 6320196 6674420.5 5499959 2751879 12738127 6810457 5656967 27081464 3132568 6442356.5 25887110 3067215.5 4946123.5 4847627 6532378.5 7403159 15576944 6662205.5 4758274 12673790 5194420.5 4393201 22246988 5678514 1967699.5 4901862 7644146.5 4026407.75 2866049 4953341 4151335.75 6248562.5 2769543.75 10598278 10864778 4224311 2844182.5 8895274 1445346.125 10355408 2507945.5 19816426 8039579.5 10807038 21856106 7042438 6327732 8173993.5 23561120 19430050 6835730 18687410 20855734 6461255 9039676 4868438.5 8026800.5 9461422 6332290.5 10421641 1673008.25 10116512 1874314.5 9124166 2933725 7829267.5 17751688 5780287 4778635.5 7164971 12421718 7568721.5 5124006 5344197.5 1916950.25 6506355.5 6988673 2631935.75 6924400.5 2627361 7518571.5 7245124.5 11667456 6256349 12221227 9532336 14733340 7282697 6931315.5 28854528 7020608 8750499 6149567.5 6686405.5 5453618.5 4019037.75 21784820 7100597 4927710.5 7723680.5 32151544 13410878 3475550.25 23096968 61774348 33713844 3679409.25 10743074 14867535 891367.3125 7971097.5 9196252 4607963.5 5296909.5 18896312 5080612 5983401 5768679.5 2774962.5 3559658.25 9376297 13211831 14187737 7201632 12975631 5348141 2538384 10512367 6835730 2034157.625 12800980 5862830 6027123.5 13247639 8651614 10524715 5327331 11744185 5474761.5 38425996 1689910.5 5497506 4676046 4864869.5 8708367 13885950 5722892.5 22966726 2570408.25 5677681.5 7136036 4155064.75 9390194 17385256 12262405 3634461.25 8385089 14859886 15987760 4736824.5 10042407 1380566 3417251 11162851 3621552.75 4239492 6361171
cystathionine 1441841.625 186824.5313 699450.625 779559.875 828066.9375 639534.0625 654643.4375 2740040 1635647 407369.5625 369936.3438 673842.875 519182.0625 83096.0625 1089346 502317.8438 1219293.25 85778.8516 540564.125 420057.375 328813.125 1791645.375 808069.5 2272834.25 228442.8281 86835.375 112595.7188 354361.9063 335823.9688 250063.1875 1230514.125 685711.125 257892.8594 1093855.25 597185.6875 320963.5938 1042889.688 233361.9063 29590522 12986787 2345049.25 1782946.75 11320221 7356402.5 366013.6875 954284.6875 401134.5 162413664 37251596 906011.375 24221022 17410980 2775064.75 9300194 409285.8438 8610562 1278824.5 12123394 2340253.5 3052071 11192643 161092704 140683360 1360503.5 4886374 1912071.125 9595575 11550743 208707360 29964982 5479097.5 1657637.125 7558498.5 1713871.625 16972794 4596153 235347.4219 12130058 849619.3125 46010480 30125188 25694522 8875821 57662824 23995898 659607552 86620.6328 1609884.75 7408805.5 40903992 6813503 3823759.75 6010580.5 5556181.5 1400086.625 5315850 1634955.875 10814481 8963081 874978.5 5081911.5 8361327 7591918 27247860 2517531.25 20842274 14927077 250634960 294401.4063 225957664 21741500 3696873.5 3169906.5 11718680 2485039.75 53912688 15400475 41434708 1610629 19861636 6837956.5 6123128.5 2477922 13352391 399328.7813 11412376 5538772 3723765.25 52714320 14777400 608572.5625 3996118.5 2453029 17551896 4794706 4161787.5 15493785 10313856 194483824 7194720.5 14128852 8255852 15825901 1307627.25 1660646.75 822893.75 13180109 3568687.75 501745600 4477902.5 2527008.25 9759241 2075816.875 11150754 13844598 2947147 14146501 1279934.625 894670 3951732 55682872 24631818 1638580 3863836.75 1990801.25 71299736 1188271.5 100592808 21800314 1446867.625 11805762 4813984 7105841.5 22539262 18507010 314295296 2264052.5 16226762 2246077 32613708 357203.0625 33989556 383260384 54193924 10945381 15560764 1437460 3991700.75 25909930 2190249 8153746 9806791 16431769 3089618.5 128172.0469 45842040 9114408 2591049 1470650.875 97449000 12499175 9820606 3293578.5 3101930 270114048 23238868 2982799.5 600280.625 994924.5625 7744107 1106072.5 3976322.25 6911320.5 5621435.5 2756455 26505768 6050609 5234006.5 10358899 16662873 48798124 320452.375 7099102.5 4544067.5 3203287.5 5562386.5 1312564.25 977264.4375 9395805 14090542 10737228 3691698.25 1502313.875 2093949.875 11481128 4190916.25 6022543.5 384500128 4227264 7354370 234042.1563 1598017.75 13060803 5372820 4510985 5099844 6472052 4067991.5 4321721.5 6057909 2985595 51400404 2689040.75 8937210 1588056.625 109463.4141 2507699.5 3931491.5 774221.0625 15680224 860043.5 3472578.25 4100350.25 4961599 2477348.75 12563939 706404.6875 21269796 14464915 673362.5 4186143.25 3997436 11124461 3217095.75 15707204 4076065.25 1113819.875 6837169 8354149.5
gamma-glutamylglutamate 4114141.75 1374312.75 1254669 1422343.75 472513.8125 1157069.625 1513695.75 1744193 637301.625 559890.4375 1073952.25 1026722.563 545231.1875 878605.8125 879913.5 1789771.75 871179.8125 1202733.375 1132473.5 887568 391811.9063 603088.375 721843.4375 756872.4375 98893.0313 723607.625 847400.125 594738 511870.4688 634485.375 780797.375 438262.2813 523739.4688 668085.1875 589363.875 1407056.875 1298100.75 1184622.75 459088.7813 686967.3125 340876.5625 711745.375 663131.4375 880247.4375 339749.875 1455964.5 1820152 433886.5 2441548.25 683912.375 1721258.25 3567095.75 2138658.25 398194.625 1430031 1299562.125 623480.625 1781338.375 8663034 266676.125 580393.375 1212371.875 559859.6875 551249 916017.5 137968.7969 82319.0781 1432637.25 581352.5625 418278.375 3979169.75 302755.5313 337509.875 276484.875 291744.6875 478281.5938 125450.4063 1675796.375 1379178.625 884452.5 668375.625 399766.7188 548577.25 423291.875 211870.875 323310.7188 640246.9375 574296.625 318693.8125 1322758.25 919330.8125 335806.5625 487646.5313 338902.5938 448992.75 70792.7266 857339.4375 1837219.625 142337.6875 191371.0469 105469.1406 196630.5156 1229374 807619.5 1533452.5 476014.9063 773865.9375 446878.1563 510174.625 161442.6875 1620498.375 3961297 112391.4219 452828.2813 1718952.125 305703.9375 524295.5625 178883.1719 210410.4219 586663 739249.75 439259.6875 7584719 1546784.875 959035.1875 952846.875 399688.8125 495527.9688 477904.3438 1032497.313 818655.375 92632.6016 773391.5 508255.8125 727919.8125 768329.625 1018409.625 204999.2969 493423.125 1675438 2658468.5 142604.3281 530950.875 1152690.375 124758.6172 1824905.625 529834.8125 109057.6328 1922914 1150924.25 299690.2188 541885.0625 765305.1875 668404.0625 911360.0625 160465.2344 188327.5 738665.1875 593937 163539 617427.3125 1310932 590934.4375 1235728.5 472925.0313 800321.125 930390.5 260578.4531 474490.0625 841814.75 1378681.25 671478.3125 245368.2656 355690.875 1004226 609141.6875 921203.8125 312149.4688 949923 400388.2188 1075572.75 723117.4375 1136237.75 159069.1875 164662.75 184595.8438 1723708.375 663123 197049.625 459096.375 1392068.625 3101140.5 863842.3125 261516.7188 411716.2813 117934.8438 324556.9688 821531.6875 321958.1875 224361.5938 835956.125 209293.4063 366543.5 2614494.5 306717.4375 293234.25 930062.625 182303.3125 310785.75 227323.2656 621091.3125 563437.5625 410313.6563 6207699 32171.709 488175.375 1596006.625 189331.6094 5355927.5 304196 330173.5938 169146.875 310385.6563 751309.875 1074749.5 1611404.875 3976438.5 683680.625 104609.2969 460448.375 1875534.25 571056.0625 242650.8594 734606.8125 150266.8438 203730.5938 904370.1875 173016.2031 2471839.75 3114502.25 201908.4531 254092.3125 656383.25 365883
glycine 110664216 104130112 108568032 139825776 89594464 168007584 132135504 99865680 161008608 125069304 117905976 145491888 154562944 233972368 122923904 154472832 127651712 119596920 121460216 136816368 114996144 126853312 134360640 222028416 207055904 148653584 125270112 88493072 120011984 95311088 113437360 137224672 137620064 159829776 208048016 118476920 139219456 207919584 133428304 124946264 201964688 111897232 233951984 111458352 133168200 103058160 138324608 231991168 94772056 109678656 80909408 191250384 83060664 78362008 101995600 60293652 127427808 77064456 63048720 67869968 148617984 104484480 95171408 56603564 86402264 64245332 102473920 82827968 68470536 67491728 163839424 56119904 72888384 46928308 86606896 112059536 100473176 90262160 73506768 77315240 57820456 263429936 89093608 72773208 72853648 82546944 65804788 71231480 94263456 53659400 87638904 59156500 191710592 78510808 95856744 161950400 101466192 120818728 69888112 41893056 65442220 151577328 53525188 68198248 83556096 67631488 60724144 73127544 51370504 69392616 141670896 81472544 82148792 81761696 49237104 108188464 69741064 65902408 80966440 74733848 551581312 81667360 70083952 164655488 84215048 223809360 51594280 43850620 59707912 78624432 145761120 83548032 69216640 84754984 77110328 77531008 64103732 54561404 58145156 75368336 64368592 86396096 331366528 87929600 51052836 97406824 74259224 122631088 62939776 60349612 47027496 78027728 62185052 77803840 144597280 53155484 148483488 155231984 76146664 74143528 75838432 56646392 97505560 81331672 62640716 88176152 82609728 64052424 102203280 78475576 103812864 151803472 106502096 72699528 90627304 76401568 115229280 106694696 52330308 74160304 127059088 76983736 119578384 55145940 107148080 87303184 54267272 86402264 158487536 58076724 51529628 81948520 43118256 111850368 57453140 50879284 38635844 107151592 80397368 55404780 45559956 92124536 150480720 102703864 86685648 74186008 65345560 115225392 51137020 101137568 50002952 96148584 63447528 44579312 78432128 56847116 80436720 103849552 129791824 60639312 87194568 86408424 63322600 69528744 80384632 119799424 65583200 50660684 69395896 187198592 66164636 313381056 90413816 172558320 109437056 57287544 115576984 144477424 49411860 118793760 68137712 89349544 122267392 54553024 101764592 65173384 49453492 240418752 94319128 66109884 78986000 92517288 34314388 85245880 104653480 130404344 82440544 52939056 83635632 60182432 96659424 51941176 61926720 93282104 75701888 76295880 86198472 46194828 106047592 81319624 109379096 72694384 69367624 63791212 72563376 61099528 67716408 52091380 115852528 122980808 126839144 79568888 94084296 84391552 89215960 85200216 124559960 73456384 245451392 115217944 87977360 92265504 334617056 97005152 91657864 89688600 125105528 67587120 80622432 111392216
guanidinoacetate 12643411 8424777 17651736 3638484.25 9018900 9680701 7725055.5 18368432 5298115.5 6178819 12073521 3664748.25 8649555 8581576 14412238 3497200.75 11505970 3181387.75 8560245 9698924 7794254.5 6883194.5 7596469 7690496.5 13449606 5818974.5 9227724 9852178 5647974 5939761.5 5986999.5 7284985.5 6670562 6889745 7401493 3775620 4204783.5 3762641.5 6937811.5 8681520 7125780 3906664.5 13328892 9949841 5069826 7102678.5 6333356 5238526 3529131.5 9211415 6241029 31983036 6266681 598986.5625 2370567.75 2267934.75 3142214 691773.0625 5721981.5 7921877.5 1697914.375 2507079.75 4934969.5 1514778.625 16523024 1222692.625 3234105.5 4211316.5 1509789.625 3973741.75 4101640 3097672.25 2548371.5 4203225 4117212 2100829 2484977.75 1881515.75 8683654 1083116.25 4223118.5 2572039.75 2595742 2469153 3795657 2690365.5 4588624 4196867.5 2683974.5 1493086.25 9221523 4633773.5 7396114 3316304.25 2677325.5 7045211.5 9793277 6595710.5 11119781 3440539 2660521.5 7215453.5 2150002.5 2270781.5 3647557.25 4449259.5 3707425.5 3359602.5 3222763.75 1919017.625 2541619.75 2734393.75 1768844.625 1684361.75 1041538.188 2128226 1835507.375 5716410 2988653.25 2173579.75 12510750 1934719.875 3225715.5 2383813.25 2647851.75 13004150 1616854.375 55678440 2909325.5 3317297.75 3018167.25 1978226.875 5275084 4940885 2613701.75 1848244.125 4489169.5 1828601.25 937015.875 14319629 1319444.75 4676300.5 10426330 4708180 2858081.75 3079730.25 2176707.25 4102525.5 5835995.5 1708563.375 2321571.25 5333573 1630177.625 3485386 7888642 1886434.625 2453420.75 4260589.5 2575414.5 2717276.25 3265251.75 2443429.75 3711694 2131559.5 3078047.5 6772218 2077533 4310237.5 5587655 1402768.125 3149976.25 7033694 10422750 1503880.5 3426243.25 1733112.75 1102418.625 2454823.5 3207113.75 1513632.5 2280821 9412728 1039866.813 2383706.25 1188096.5 3034012.75 3781736.25 2517443 6488037 2785347.25 2656430.5 2800578 2521502.5 4895774 1726618.5 3377467 926550.3125 3342125 11876160 1499161.25 3970271 2793147 6127346 2564763.75 3410360.75 4034680.25 4213279.5 2435730.75 3359796 9048705 7205854 1411029.25 2017464.5 991966.4375 2121908 2634747.75 2628239.75 36529292 2409331.25 2567893.75 3526168.25 3482073.25 5308933.5 5634909.5 4562296.5 3275364.5 2879118.75 3359796 2869498.25 11842511 5996384 4873518 4738941.5 3728265.25 4944694 3015491.75 6437938.5 2574775.25 2068063.125 3100457.75 3296386 2190444.5 2840638.5 3345066 1714021.75 2208269.5 4909290.5 10495946 3083133.75 3187294.75 7821583 6783692 2319884.5 2731738.75 3156646.5 4663070.5 605304.8125 3809393.75 2807484.5 1731291 3339596 3529793.75 3478664.5 1893510.125 4864155 4194112.5 1585765.625 1711208 23331226 1600410.625 1557785.625 1948884.625 2588873.75 1733787.875 4471023 1889327.875 1700459.5 1990731.25 2377337 7008461.5 7112770 1531175.875 2837654.25 6504152 2083542 2564110 4110652.75 1905132.75 2312300.5 3678863.75 3233247.75 2776685.5 13444258 1877904.375 6479093.5 1819116.375 12391769 2609213.5 5014823 3326088.5
hypotaurine 645109.875 600103.9375 323179.5938 318110 581728.4375 997195.375 209152.875 633156 461768.875 275941.7813 174376.3906 364457.5625 613268.75 300635.0938 376171.7813 458444.4375 282316.625 207111.9531 676017.25 990762.4375 676930.375 866739.6875 805100.375 480446.5313 212819.3906 675325.0625 491892.9688 158680.4688 529528.5 617120.4375 540326.125 152858.9063 1580817.5 618869.3125 923832.5 444813.4063 1172844 858852 596000.8125 376384.1563 475808.1563 322291.9063 475187.5625 465894.625 379514.5313 768894.3125 342848.25 675940.25 316832.875 1498560.25 131212.1094 648279.75 2487759 1319174.5 354697.0313 891125.8125 565448.875 365745.1875 534190.75 977773 1064560.125 1313068.375 938478.875 3358912.75 122117.7266 5072640.5 327781.2188 110755.2109 1011543.063 1736867 558245.9375 235010.3594 367428.125 1074348.625 191196.5469 477447.6875 2068836 2787609.5 362780.8125 206685.5156 4982659 1626984.5 1364711.75 1065366.375 105520.6328 272301.9375 2777637.5 1532382.25 1027359.813 1277590.375 8890484 1717373 1723656.5 1539910.875 4421873.5 5368429 189330.9844 472450.7188 1208284.375 309107.9375 3090714.25 948767.4375 317761.3438 577632.0625 698359.5 202704.3281 661377.0625 2263575.75 712657.25 3174756 328251.2813 973839.5 767831.5 1010202.438 1447526 1531261.625 707980.9375 1288088.625 1531657 1411432.875 475362.1875 486101.0938 858852 732761.375 220701.1406 123740.5 110836.1406 1511892.125 962377.3125 279865.1875 304047.8125 184737.75 1229948.625 369796.9063 993148.1875 3838852.5 715532.9375 572206.9375 619864.5 2294337 1006192.813 428229.1563 696025 848501.5625 94551.4609 1128419.625 833523.4375 513716.8438 405669.5938 1696980.125 3022392.5 718401.8125 1199942.5 911447.625 868246.1875 855914.25 653794.6875 1626112.25 1268898.75 144364.1406 716020.75 203991.1406 452262.0313 561725.8125 130976.1484 563936.8125 402855.625 881261.8125 752823.125 989063.5 762843.125 1116166.625 1251018.875 708748.125 1838988.5 1216226.125 4415687 1853571.375 1043951.063 321428.6563 1284638.5 1089578.375 453326.7813 5701227 1361238.125 1271040 753350.1875 692431.375 512388.2188 619411.3125 841889.4375 419755.3438 2836907 2104864.75 2108224.75 1267419.375 1271744.625 254423.7813 758953.125 655319.9375 811525.6875 464417.0625 1307757.25 991926.8125 1339955 289273.3125 1115925 1103669.75 858852 396254.9688 217909.2813 646618.5625 947246.5 1089168 2653605.75 961612.75 436290.6875 1839639.5 564333.0625 1291331.125 1240894.375 1646907 1720113.25 1668255.125 693387.375 561672.875 1110883 2777958.25 2625253.5 1263105.125 1625084.125 1375388.875 692147.9375 785295.9375 705279.375 1412923.125 3273743.75 487458.25 903021.625 2218765.75 2204523 655549 1019628.875 1603897.25 238962.5 3263271.75 1748386 770907.6875 2359838.5 2484387.25 1921366.75 1250882 783681.8125 1141106.875 7266966.5 1216093.125 960056.5 5036483 2106227 50876.5977 1294743.75 129361.0703 2548568.25 1144445.875 725361.375 1253531.375 2098674.25 911320.5 343265.8438 957855.375 1056332.5 1314456.875 1157255.25 506463.5625 1705724.125 103170.5234 719984.625 2661718.25 3786227.5 3634062.75 2341655.75 2458885.5 857118.1875 397148.5 948233.0625 1973554.125 1107312.5 1835461.75 1060750 2904111.5 505855.9375 1602540.5 3539110.25
inosine 5'-monophosphate (IMP) 31904 74639 57300 93920 206337 23935 42147 200890 75767 246607 49554.0039 69122 46925.0039 92913 98149 23420 87456 34705.0039 57392 334961 70197.0469 151449.7969 66347.4297 467861.9063 56363.1055 64068.1953 116181.9219 72508.3281 71895.4219 31874 91702.3203 34396.2695 859173.0625 41966.5313 68046.9609 66348.5781 46001.8711
isoleucine 1712104064 1518271488 1375013504 1632610304 1345235200 1799259008 1875299200 1614754048 1659671296 1319137152 1760151168 1194464896 1738083840 1155929088 1638498560 1717787520 1088258688 2119537152 904630592 1693968640 855668928 1578449664 1072735296 2106648832 1426554496 1817989120 1256406016 1324341888 1263172608 1418051840 1152282880 923773888 1077163776 1498363776 2003961472 1554282496 1999090432 2134339840 1190106496 1182532864 1107982848 1461861120 1005264000 1531005184 1947972480 1318485248 1082852736 1095604608 1569847296 1479572864 1747606144 756506560 1499596928 1388307328 512353728 420244096 1343765632 1899799296 1589350016 1277367168 1075867520 1590366592 1245937536 1074999680 623748160 1881993600 1274130304 1205305088 1482344320 602347072 1084568832 1390184448 1388071808 1204496896 1246433792 1714005632 1419345664 885640448 789215104 607930176 1358109312 1926747136 1625404416 974017024 761000000 1347931776 1179448192 1058117184 1977949568 1399821696 1064423168 1320633984 1428663808 1954461056 1364869760 1372918400 712013312 1705520512 435341760 1220008704 938985728 1258138624 1450616832 1652126848 1248600704 1101041280 1578763904 1394854272 975375296 1051660672 1621696512 1434357888 1521588736 1476283520 859052736 906487744 1393484288 834045376 1738563968 1917502464 1385648128 757005376 1008655424 2027496832 1107109248 1078688384 1000452160 745569600 1070903168 1493278464 1478007936 1534530432 1421647488 1222143360 1969568000 1416971264 1021019392 2140491136 502993984 553422080 528460000 1879190912 1274315264 923002688 1100963072 861234944 2284479232 1235400576 1389423872 1507405184 1000211328 854306176 1758951680 278858688 1477880704 1387334144 2202514176 920650944 881119104 1250049536 744877504 1376164736 1108910848 1936354688 767460160 1557390080 1640812160 2018015104 1030147840 1243001088 2007305472 843066688 618955584 1508574848 1568014592 1182663040 1258612352 1538702208 2241819392 988239872 1422698240 921630656 882351168 1802107136 2389972992 1535033216 909273280 1880095488 1592928128 1021095040 1897182976 1521240064 963020160 1247151744 810032448 1170091904 576390528 1195358208 774634432 667866304 951697600 1044943040 1216494208 2064753280 1284904448 848681344 1578591744 2187357696 529044800 1424691584 399787008 1427137664 1636485248 1248600704 1439769088 1327781760 1315275008 1169832832 1254111232 1273233664 991487808 2043236096 2004280704 1349958912 2261456640 989482560 825968896 1068317376 392530272 873333184 1121047808 1086077952 1662933248 1804544640 736785408 487755712 2039522304 2159451392 1523393536 1299744384 1360861696 1159051008 1294123392 1155940608 877310272 780185536 695486400 1133050112 1431161984 430643712 1041942656 706212608 490654464 693373184 2088546304 2349403904 389980864 621193152 1404883968 815250240 943037056 1042967744 1204196480 815053504 743560512 1012408832 1230073984 1448927488 885940928 1174438912 1723923456 2263413248 1204643840 1037253632 831921792 970019968 1484518528 1177883904 1442734848 1052414016 1121228032 1110755840 957460544 1346600960 791868672 953986112 917051136 853032896 422732640 1309347584 1302180608 621534528 784010880 1106652544 944954304 1180743808 998664000 1535024512 859400768 387345952
2-aminoadipate 591939.4375 637399.0625 985059.9375 920797.875 287499.4688 1260470.125 784768.1875 786293.25 892103.1875 1302384.375 1261637.5 1015133.5 801202.875 225815.8438 409519.125 1256794.75 403607.8438 1398747 1095589.125 729863.3125 282927.2188 697582.25 739142.375 1044686.938 561290.25 688415.5625 1031343.063 570342.5 704914.875 494050.9375 414980.2813 598368.5625 693503.8125 988065.4375 1021708.313 650459 1080989.75 1700217.75 635058.625 306187.0938 405401.1563 395673.625 487968.9688 391267.3125 1053966.5 867849.0625 299400.5313 387067.8125 458316 488122.0313 664149.3125 1365996.25 301671.7188 456878.6563 2524698.25 727434.75 475888.9063 1535206.625 311945.5313 570311.8125 2130352.5 1126388.75 1046007.125 344553.9063 720845 589254.6875 628304.875 369969.8438 537117 202619.5938 1390271.625 432051.0938 1133029.75 302243.9688 523046.2813 1021941.625 458882.9375 549094.25 585413.1875 759651.25 637240.5625 2795586.75 561284.0625 538861.25 258131.9219 978744.4375 251399.75 403760.625 484076.8125 439859.4063 842857.125 605411.3125 971879.375 719627.4375 538746.4375 1563544.375 1295416 1201657.25 332846.1563 509825.8438 204664.6719 634228.4375 387175.0625 816059.4375 394277.375 253266.4063 462662.75 465890.2813 368330.9063 580136.8125 1060699.5 234757.2656 763516.4375 533269.75 303715.875 673594.625 439165.7188 1052902.5 761792.125 1290486.875 1493808.75 402649.375 480408 3595817.75 753950.5625 353161.25 611912.875 627671.875 529444.375 805544.5625 7699159 621401.875 507555.9688 425555.0313 542530.375 364202.75 492706.0625 739771.25 241652.5781 588206.4375 576626.625 746565.125 3185022.75 373196.5 468946.25 487712.7188 268836.9375 600817.8125 426566.7188 1594329 317691.5 376167.5938 441384.625 414112.0313 1838491.5 482308.9688 21130310 777386.875 1358675.875 588921.375 312391.4375 496057.75 477980.875 970720 406686 1314849.625 388255.8438 616878 638588 480209.4375 574113.4375 348661.125 841879.125 1025325.938 663049.4375 1037073.375 957494.125 956373.25 1251472.125 1085517.5 671889.875 304936.6875 517239.2813 532282.25 1526816.125 1194808.75 589625.25 1588515.75 1105452.375 397585.1875 772852.5 1421209.75 543054.4375 1471219.5 533414.1875 241974.75 144320.7656 1160031.75 502239.3438 481387.7188 947239.375 614257.75 1666570.5 1227586.625 822050.25 300857.2813 639212.625 4258306.5 238519.8438 1415832.25 426490.5938 882192.1875 986710.375 277910.8125 2120938.75 476339.2188 475710.3438 1614647.75 646533.625 616878 549152.1875 624406.625 2205764.75 683466.375 483697.9375 611404.1875 441236.4063 1020942.313 313226.6563 512917.6563 1854314.25 507852.7188 742702.625 3444155.25 426779.6875 808217.5 2155326.75 1908996.5 921798.125 813328.875 1761672.625 613756.5625 230015.4063 624080.625 414621.9688 288085.5 936266.3125 1822031.375 570688.625 545973 371790.9688 251733.0781 761084.0625 429888.6563 3226851.75 11936285 435476.6563 531380.875 617872 400520.9688 1293776 956631 818547.3125 2501700.5 521092.3125 769885.1875 818975.625 539904.1875 2238401.25 388646.5625 900316.5625 2170339 721041.375 428643.9375 899690.3125 227574.3438 429729.0313 1218198.625 904006.375 358352.2813 1080462.25 345388.0625 365336.8438 661886.8125 616878 624169.125 573607.6875 338545.8125 591363.375 698761.875 719428.125 576373.0625 223885.5938 686273.0625 289679.7188 491075.4375 755647.1875 239304.8594 528084.3125
citrulline 240545440 112984368 284555040 128545984 198261344 188944576 231941744 155612624 244403344 250024512 190619088 216118576 255431056 120722064 203763904 90715552 205552688 150262640 149396288 311759104 161947776 180090512 336109504 309411200 434290400 160906208 343602432 242086992 147155824 180193984 250310352 230462496 304289696 215308864 278488032 259812768 263969984 363200864 235512208 146087792 138364384 184527168 144021952 228447536 163615568 220584304 283492480 206023248 158494240 265976816 101042560 149362768 144340432 213264432 72974440 84591312 145622320 40786264 86933712 181070096 81234192 38755316 60321260 86948000 136144752 48663760 87554224 78385024 74067448 65961372 91048160 108406288 76142256 21405026 152609600 85688864 91537848 50274960 43568196 124803248 120345128 59615336 59512360 53377152 89361176 40796388 87181648 141876080 47001236 97584992 81832256 76991392 66437284 53042044 146719936 109931608 132830792 359856480 104172744 56948500 85129848 75839448 87573832 50015148 87396344 286182880 75674192 38596336 81528848 23743396 118576040 99541128 131258800 113133280 56633820 67899688 95708184 91002256 48200204 42992448 275039104 134223600 82251936 62918604 50825784 262008288 37660860 46307164 131618560 71739504 58674092 355960448 85595232 94447640 57324588 61512064 54046564 110061376 53054512 171835728 80481776 52253704 240210336 74340768 100695184 106727912 25247510 101174200 175021632 63388276 113629840 68348648 67319016 73970456 214757232 61210616 77553232 60654640 52706052 72024072 78613400 82323632 49731260 104950336 120219448 50057940 90666392 57750040 57057256 66190732 61197104 280753216 115160472 87618120 224722704 103898704 59303132 75206888 100273312 47298348 40638652 265257488 69556392 228873600 100822576 124153328 72490696 71420144 145297408 132674472 140093728 222693760 64313400 100063912 63282376 137920768 42548612 139817504 200934512 42123748 305884736 105507696 100646776 56290140 121235840 69059504 46905892 24378096 106117808 65407988 55241076 56705340 55537696 119871288 113328448 205828512 84771512 161534240 46095756 74799008 253793360 59965440 159781664 119081992 105502384 118711184 108290456 81849344 93471208 194408576 115141928 153623824 99662032 134142568 132249648 86294288 157891104 171604528 162419744 128581904 147470432 119163504 58405272 173901168 42785924 68867376 80174216 303588576 185366112 201853120 106117808 158127232 196818000 217397792 109603600 113205152 88821992 315134592 128777872 57877476 125078688 59458572 94154216 52205040 95810016 102628072 118906440 148392096 138796544 103812072 33056160 89480488 36707908 35273332 47381224 36867072 134709104 100271024 154053792 219749392 174322080 64916684 121089832 174848384 67130880 155342400 200238192 80822320 129535064 119014488 122468352 203434832 235239568 231948384 134950336 78476864 301668352 71474224 275942752 211942576
saccharopine 237969.8906 3851717 72338672 669367.125 582204.6875 31025404 3761364 9914510 2681203.25 4018058.75 32895636 7658316 4760944.5 2326764.25 22614934 922665.0625 2404406.75 3842181 2643692 3943715.75 2146816.75 2852050 11120054 13889835 5663225.5 10952952 1240904.375 6300389 176129.2188 3181291.75 4255252 13721394 4463238.5 2259337.75 6447479 38431680 4118207.5 6738578.5 966613.4375 1168754 4621408.5 2630995.75 779048.75 2509652.25 794461.3125 465907.1875 837040.5625 11262370 2193723.75 3276470.75 10279587 5951279 28494792 1483116.625 1125578.625 2856607.25 15404575 2689200.25 1268307.625 5136944 1109492.75 2569080.25 1956671.5 8348124.5 993174.5 2287114.5 32687988 1845249.875 175732.8438 3322561 1569224.375 389153.3125 5093503.5 4566641 8132988.5 27979134 9569432 1584709.25 247176.9375 1147097.625 6932713.5 4831442.5 1848340.5 1865338.75 2989073.5 2161567.25 642331.375 12104590 3612720 1083038 299678.6875 388146.1875 2479185.5 15197493 8731886 448879.25 220134.8125 1400542.875 3309088.25 918212.125 3329428.75 13529427 3038926.75 5039463 5205107.5 14430915 3400053.5 10074577 13686046 1050257.625 928098.125 2852050 868422.6875 19569660 5399990 6682880 990975.75 731290.4375 29518348 6182934.5 1733158.75 3152879.25 11780814 2852050 211544.5 2469064 229237.8281 1970163 80882216 701159.125 4541943.5 5199108.5 404153.9688 3319346.75 8411423 5596143 399753.25 1132277.125 2283878.25 26902758 2542764.25 1461617 4147113.5 4372850.5 832279.875 28295736 979433.5625 2229202.75 1019396.625 7043685 3344646 316363424 811214 6030433.5 1205835.125 66145688 185270.0469 10234533 5641354.5 1518674.875 923042.625 432110.6563 1393924.375 1500843 1160516.75 2155729.75 82640624 2989115 278820.4375 1607033.375 2011619.5 1092276.5 669503 1771512.625 3067283.5
leucine 2003025024 1829352320 1917597952 1975888384 1521602560 2298029824 2220339968 2165118464 2176759296 1742362240 2066818560 1731406208 1976690304 1527374464 1859206528 2321408512 1248611712 2776238336 1180802688 1954041472 1233711616 2074007424 1277152640 2111460992 1662243840 1762745600 1531973376 1516665600 1509973248 1826577280 1172894080 1138307968 1290710272 1750285440 2288330496 1610474752 2310725376 2619158528 1397396224 1454324352 1118920832 1656947072 1208319104 1488169728 2132055040 1511037568 1448658688 1171837824 1806737792 1682012800 1750486400 751691584 1528662784 1422811008 671310592 527811520 1449913856 2378797568 1875122176 1347223552 1489226752 1400114048 1300954624 1135066112 827936832 2077042304 1380046208 1377085568 1525754880 821312384 1052046016 1578233088 1329741184 1366790016 1322242944 1972400384 1690409600 1107679104 911669120 1651079808 1981496192 2018280320 1201036928 1019757120 671420992 1278259456 1332560384 1326901632 2068893568 1542189056 1101861504 1385709440 1659853440 2343829504 1491009792 1548583296 640369472 1722928384 549125696 1289298944 1116835968 1348994944 1446983936 2131827712 1295970688 1101404800 1395604224 1865682816 1279343104 1200647680 2024531200 1399984896 1694045568 1546012928 924556416 1135889792 1543934848 1034024832 2061163008 2040739584 2087636224 1054249472 1380684544 1734060800 1050415680 1046483584 962692736 978414848 1198379648 1694995200 1698796672 1456044928 1384183552 1266494848 1842941824 1499730688 966798080 2080299008 705498496 638570496 865069824 1865288320 1604994176 732007296 1525506304 1098930688 2480822528 1378736896 1167308416 1461757824 878593024 928123328 1929516416 668625728 1222721536 1452055168 2222352384 890961984 1141127040 1253039872 1430346240 1611668352 1091457664 2450384896 723355392 1357108224 1464449408 1729228672 1110130560 1392005888 2144620032 747582208 970438976 1834208896 1603029120 1490743680 1484184960 1547256704 2376961536 1221271296 1417301248 1040808320 1092117504 1867225472 2307031808 1640681856 861243904 1658762880 1985107328 1241981056 1701766784 1532917376 1403642368 1473245440 963970880 991587712 717551168 1181250944 668919488 1066697472 920889728 1068763840 1159539328 2202020864 1418737536 1035482240 1379300096 2197240832 611606528 1141983872 371121952 1482548608 1943609216 1395604224 1440626816 1210122496 1361483648 946682304 1330633600 1138390912 1010445568 1542523648 2005125632 1712366336 2445265920 1373757824 1299022848 1290761856 865812480 939201024 1312904832 1277339776 1614386304 2397729536 1001234624 729953984 1927850368 2418860032 1617592832 1723486592 1393812352 1335491840 1374088832 1366344320 1319594496 1200641920 940858112 1639172608 1469626496 751881088 1335322624 1046261632 1152933504 737065600 2207673600 2054859520 834510912 656267904 1465116032 873473728 1352820096 1497544192 1676590080 1186051584 1008080768 1095234432 1615620736 1923407360 1122012544 1404151040 2308124160 2441091328 1314560896 1279839232 1107513088 1941883648 1828622720 1582780544 1662126720 1187750912 1823903744 1307614464 1194653056 1599211136 1394685312 1470787072 1196844800 1134994176 1146594176 1699178880 1743710976 768963968 1099605632 1329278976 1131100544 1285317248 1318309632 1468377216 885410112 638315456
lysine 1017304256 852912512 1308995968 1035446208 738518592 1300064128 947455872 1021805952 1284048128 706613696 1010709952 1221207424 1187051264 675106176 872543040 1123932288 793640256 1041794496 1006111488 1246006784 769904064 1148864128 1032042304 1061742464 744385472 1234216704 1217257856 775843328 839134400 1026898624 905916480 843241600 1094721664 1259963520 1470737792 922719040 1440144640 1609266816 1275148032 846346560 813020736 952737088 927018880 926899328 1297932288 967408384 1035059712 891940480 826083200 1010947904 1031027520 1282148608 790565760 820817344 573279168 392937824 871261248 973078912 606645440 1170518400 457794528 908075712 718628800 588403008 607120832 639161920 1045010624 690502272 460752576 618123712 1211965568 491944160 524129728 438540384 598570880 683825152 576599616 805911232 553321728 953532416 667233920 1043535296 586437760 738923584 605953024 783164160 527453280 698462976 881765696 588376832 788419904 579296960 1830713856 652747776 724525248 1388037760 1264400384 972632704 529934688 359301120 452326432 934755136 470289664 619147904 614110464 586392384 587512960 676157952 492343744 498481760 569779904 506660800 641266816 854391808 402506880 566103744 518918880 1155711872 890854656 686537920 2325135104 837616704 569177472 808061120 609187136 1288239616 320845472 598109248 476000192 731665792 987920000 455304096 757280832 912216896 645444096 613072384 456134944 615645056 705636416 525486240 222035648 891326592 3891863552 657815808 480556992 661468992 691008384 623483776 590511360 592460352 430611520 599342208 402929376 389156032 990697984 504365632 1257969536 1023239232 560968512 669495552 452058048 440669184 965169216 868545088 627213056 869284864 788361792 867812160 773465152 624597312 869153088 888548160 797112000 710519104 756611840 584752448 1132273536 890865152 556204736 492447936 1014178176 560395008 542155072 606595392 832347520 459917888 569867200 608536000 1569998080 830121536 464827008 592338240 376820576 1141893120 613660544 408284096 424608000 1189414656 787176064 418098976 379784736 573458944 1229709568 914942336 736534848 610328128 629844160 1282960512 385162720 593900736 684496320 729510848 566826304 491358528 470243040 635044160 579847040 1002962240 915707520 469667232 550739392 723478272 678572608 1512521984 817606848 695098880 599163520 534224256 540784000 866057088 709537408 2003857152 1082228864 1774736384 1175525120 641010752 1166723072 988471296 470235232 951657344 593777344 716998656 1081468544 638146368 625507328 687953408 445946048 2432019968 858868992 545554560 645586560 888252096 301339552 422178400 1023526272 863929024 800500096 380050720 735596864 560393728 1528575616 1032642624 544703296 758279360 812931136 669740736 718944128 477163456 903466176 565388160 661542144 700810752 634163008 783297152 551665088 505118528 612562944 505970624 868779200 1573364608 1026574336 434966080 540811328 600120768 314145312 716998656 893609088 546561344 732621824 990554752 572917632 389819776 1537381120 572949952 897010048 541849024 1172574208 491104768 448221088 416268448
methionine 393564608 381900256 474209888 366966464 245326304 554567424 373195456 516362496 576688576 445379840 399085472 340188224 586947200 220148080 324782912 489222112 263889504 567013376 356031008 472525120 316754368 544982848 361250944 659578752 511456512 408096128 486503776 325432832 406526496 350488352 323930400 357131808 402522272 500205216 659176960 408536224 630495744 685365056 448121376 370752608 420485888 339711872 326699136 437395488 587253376 400818048 470261952 356409792 392892256 386980480 589554624 1042574336 450942080 538222208 525052832 189589104 382143296 600238016 277363552 1032014720 628004800 946441216 680102848 372410496 437417376 485629120 684270464 397814656 338982816 359314528 2000731264 366379904 358466560 285540736 809122112 639964416 464116128 541185280 417515008 302238752 372423936 2156186624 514616672 446736416 399572224 483668384 329028832 487536128 683537792 269506016 799253440 318282464 1099148032 472475520 446016704 989095936 2027803520 631346432 444310976 202743472 344400736 1017995264 283524288 424258784 551512512 388384128 433935456 455816416 202444976 467729952 352373760 494565888 516956992 381122240 397649632 500001184 313989728 469992672 593875584 799662976 4082506752 511429600 360408704 1622293888 327258368 1785356288 298775264 263686896 298915840 506795808 809378752 365035392 434333472 896169664 404990816 447178656 396153440 523694272 216205344 469540704 245626016 628980480 5240272384 846669312 266311184 218255264 554961280 443581024 487673312 447726944 275942560 487083776 323463008 274845120 1246076928 343437888 1623699968 1546348672 394580000 367076864 270692992 330010464 710342976 484119296 917386048 873766016 607828480 468746048 669110144 341459008 539099776 695115840 500599904 382190496 350622816 377838720 866570368 801318272 365437984 413908000 567871104 478264896 286249280 615801280 1073060032 247495824 281184928 542486080 792617536 480569504 344411680 626733120 274737408 979481344 512465280 345433760 204618880 1035055232 793553536 257185408 296407264 401102784 973303808 965059776 394830304 684189952 555847616 1052850560 234474880 586152704 323951392 479072448 355321856 435435104 445379840 263946736 454035776 1284583808 1171081088 477513568 353614624 632102272 524969472 531784704 480530560 428394912 270653440 370754368 245775760 689342080 360609952 738725248 585028096 1669779840 855036672 342228576 885675584 815207424 344451520 629749568 305105728 597834496 640824896 357168864 335834432 405116864 268687712 2103189632 430262912 219694064 312523392 530663488 171549152 312701024 710941376 608269568 135327568 206292240 401729568 301229056 834949504 394344352 277271008 706497536 312987680 434419680 514352704 282418400 551457536 302982464 407286880 472811200 628695168 526453760 551966336 271520000 416872800 359032672 583301760 2976755456 370279424 251249632 288284704 274521440 219164208 519240960 752045056 427059840 549513600 827811392 444549888 157188800 1231402624 318302080 675584896 329384224 827324160 336067072 294023200 289129984
nicotinamide 2758079.75 1793516 1427645.5 1348371.375 1165669.625 2085420 1684459 2022938.25 1233083.125 1588927.25 1897857.5 2572456.75 1464928.375 1318432.75 441308.5625 1364119.375 923446.5625 932745.9375 4907796.5 1298256.375 1102197.25 1181413.25 1216292 1386462.25 1278711.875 2597336.75 1220617.125 1224337.875 1403023.5 1693198.5 1186616.5 885072.6875 1448054.5 2080484.75 1176494.5 2614840.75 701204.125 1546631.125 736355.5625 2336250.5 987231.875 2517843 683454.5625 1187564 2332955.25 1761217.625 1947276.25 3360144 2372935.75 3145697.5 1517149.625 1838205 786920.9375 2388759.25 1609302.75 1739220.625 1439752.125 2257628.25 1369245.25 2385183 5088043 2585458.25 1443664.875 2029929.625 3929222.25 888034.3125 1537617.375 2121653 788522 2595755.25 11229489 2058793.25 1802843.25 2044220.125 1354366.875 1786517.75 214716.1563 2149594 4068189 2955605 1218308.25 411032.625 2835178 3351349 1628737.375 2804503 2689079.75 4022724.25 4518114 381936.8438 2797369.75 3195584.25 705543.875 1347147.625 757140.6875 858121.0625 854882.4375 731674.9375 1845617.25 2203871 1610262.875 1394105.625 537629.1875 2188827.5 11686142 3008224.75 2923201 1369131.25 3085528 2282917.5 3229623.5 7508144 1173725.25 903117.9375 1977880.625 3632602.75 1845869.375 1941130.875 1069898.5 2162186.75 2241146.25 6641474.5 3800677.25 2165932 1568212.5 1309813 1999933.875 2981929.25 2788394.25 308641.375 1313958.125 709833.875 5768918.5 2054646.25 1068695.5 656544.8125 1231432.125 1081608.375 4805640.5 1800185.125 733429.0625 1602360.75 1017855.688 2748423.25 4559517 1096262.5 6733001 580465.5 2901880.25 2256881 1564859.25 703798.75 2051847 4730929.5 1101838 1494276.25 3636811.5 3512729.25 1291668.875 373772.1875 1976350.5 2398254.75 2253495.5 1945796.875 1818398.125 3915890.5 1308946.625 895460.9375 1867611 3380878.25 5230391.5 1507205.25 2964382 3141350.25 1193320.75 6000547.5 2070869.5 1253837.75 1951618.625 5890224 2853537 1401400.875 1220632.25 1033677.75 4744533 1366731.125 1684459 4340452.5 900921.625 3061540.5 2525412.25 2631178.75 1043825.625 1154401.25 1684459 1472726.5 1347766.375 3424793 550449.5625 4952630.5 813324.75 2578168 1559783.75 3529124.5 1279578.125 2016562.875 1558559.125 2797193.75 1439625.25 2128276.5 1286951.625 1954328.625 1488170.125 624631.25 541203.5 472268.0625 1470898.625 687284.1875 2962458.75 3907979.75 3856030 215724.9375 3081567 4401704.5 2288504.75 564824.4375 4284632.5 1120869.75 1496406.5 2011349.125 676321.5 1365874.5 859391.4375 3472216 2002189.625 1338607.5 1514547.5 1283706.125 3642699 898660 1725857.75 148293.6563 2656177 1696611 898432.6875 4601557.5 767393 1776822.625 2498867.5 2745775.5 1654490 3126938.5 1226337 1038737.688 1627139 1933834.375 411340.4375 754859 2002525.75 3430940.5 2748107.25 4598434.5 1892866.625 1265225.375 702240.875 4178888.75 737046.875 350983.4688 125826.8906 675194.0625 58009.793 1035716.125 448477.2813 728533.6875 1846365.75 309281.4063 852983.5 1230381.5 2279293 5886290 831271.8125
ornithine 652524800 357018144 708751936 591915712 345794752 612991488 557689856 430136768 687886080 547051840 536825152 270000064 460720224 281240192 489301824 510172224 402972960 545821056 332976512 758742912 354721888 658865088 429585600 665559104 412541760 461236192 569213696 320091072 305576064 279420960 676194944 382804768 341504448 491096128 655798272 501291808 481922528 805140480 375125696 481631616 322397920 415627264 397810752 338174016 305930912 478235136 592709632 444524768 254770128 417226624 631379904 299723968 297207616 525403168 335957856 219309248 374137088 523423296 450276704 346749280 260447792 301163904 296263712 234127424 326504256 359116160 175254912 244424736 486021504 114548736 636827776 252484880 266880336 165589504 452670976 543753792 315693472 218393872 95975008 153089536 282079360 481100256 272900288 158042544 225192240 392712736 307639936 192805056 425628768 285389920 273694272 363870016 602265792 357886816 287500992 413122912 331235520 702353088 126888288 240099488 121660696 403881280 298476000 376190656 258940320 328721536 403565760 243142848 212343648 227327824 304402720 255202752 276628864 214334128 130701472 229149664 240180384 305179616 314033600 382415040 1017045120 238238832 243221136 665695168 328076736 428822112 205925200 150048944 252353200 467259584 453404384 585042048 264363248 349788128 231438704 240122656 131787608 299150208 114715632 166458560 126672528 236694016 1424366080 220362752 188129872 266406128 234048480 364303872 303989504 222892912 172971392 154965520 240832912 91071848 836371776 179332256 879352896 299014560 179730336 298155232 92786920 201412848 243416720 424011904 259122256 312328416 315693472 338422496 294040768 332557120 332529248 438808864 233438960 163890448 470267456 210744720 368356544 347315584 419180416 185238464 224846464 383066464 425407296 497562720 706515200 265787488 326089856 334070560 394033344 256216832 464291680 523113088 172295856 333017056 127149024 332802112 76242032 455449856 382818304 137091600 172288688 342749280 447172352 346407552 515029088 204855328 308482560 452171264 140779024 365776512 155940592 374991808 200616608 349633888 320715680 479971296 248693952 378717920 206511872 153514976 354781280 312656960 444237760 202962672 407030816 395969920 273868320 293068192 82222648 427518432 447481664 356240576 431551392 1080617856 352167616 307811872 337327552 727684480 250108144 387040000 290901664 441180768 279593024 281780832 234308336 233610112 128566152 716853376 426377632 238372864 258918736 175513280 132874032 227645952 719959872 907662592 85097208 110363864 385937888 155194544 405926752 305591840 276027712 194616768 335291424 224525856 394194656 323899584 209436832 252379504 206283792 411311136 244322064 105207088 191412800 139501520 490046080 292474272 478402816 392048512 518838944 288237440 278925888 257891616 212824976 186386720 249274480 207024528 188565408 447150784 270093184 274547104 477561184 422570912 336156480 103934088 318729952 227044480 261553936 207861120
phenylalanine 1122778880 961502464 1176024320 1263234560 1148482432 1328571648 1321132288 1398165760 1327062528 1261107840 1260397440 1091442816 1553490560 949763520 1178496768 1383874304 1049190656 1536181888 1243928064 1290599808 1013069312 1381657856 1087553408 1432540288 1136941824 1264147200 1552099712 895351360 1241858432 1148436608 1230970624 963603776 1236561792 1376063872 1492814976 1189777536 1478558848 1467422720 1110294528 1066617024 1079929856 941874176 939423232 1328026368 1710479616 1174630784 1252848128 1011498880 1118699904 1064740032 3347295488 3142776576 2292212736 2086694144 2583194112 2489792000 1534099840 2125790976 1314850176 3016663808 2452737792 4544090112 3623082496 1855426176 2371631616 2024730112 2562348032 1717225088 2338704896 1739913856 6110040064 1748847488 3363177216 1906609920 2789598976 2403537664 2312700416 2266502656 2180336896 1650571136 2382774528 5201685504 4817247232 1693489920 1388469376 3103329792 1357074688 1644046720 2877350912 1735368576 2076341248 1560230912 4510580736 2686875392 1808686592 4728836608 5317043712 4090910976 2853612544 2076781568 3489746432 3977925120 2005306624 1637465472 1878722432 3255866880 2798160384 2053712896 1947084160 1727580672 2318803456 3974505728 2062378624 1687564288 2049826560 1458222592 1581458048 1500786432 2999503104 2512446720 3999105792 1663872896 1707375616 5956787200 5174741504 4140380160 1992057344 1741075584 2658262784 1727510784 3093926656 1789709952 2140814208 3592604160 3627978752 1915514496 2440921088 2994521088 1206874112 5975388672 1846079104 2423333632 5906408960 5773555200 3926877440 1467892096 2136873344 2459769344 4692127744 2104449920 1525940864 1444536960 1795209216 3005211648 6606516224 1443871104 3775893760 4698206208 2792022528 1715576320 1961005440 2864196352 3147692032 3308590848 1478271872 4032818176 2625335296 4955379200 4225887488 1428258432 1896305792 3264801536 1673988736 1927254784 1795779456 1992080128 1884055296 3291454976 2753937920 2402091776 2452958208 3013983744 1939466112 1694873984 3476286976 1700496128 1655206656 2229734144 2576711936 2192010240 4241303808 2708687872 1907935104 5136010240 1411504640 3417456640 1091565056 2831212032 6867835904 2615089920 3257836288 2569244672 3084173568 1918046080 2137849984 4229248256 3341821440 3560486656 1080551680 6172765184 2892566528 1910385152 1659825664 3894818048 2964327936 2265419520 1633640832 4510318592 2651831552 3583551744 1528942720 5531320832 1754759936 1634229120 2646682112 1692300672 1540840192 4058361600 942157312 2023182720 2057095808 1979671296 3421222144 3869022464 2564338432 1440966784 3721916928 2254362624 1631530112 2117234688 1410964992 2466398976 2742227456 1620433536 1104223744 2000158208 1305323776 2996272640 1975575168 1249896832 1112872320 2725203968 3732097024 1228232064 3865038592 6490578432 1044323648 1802586624 1992034688 1593997824 1684520704 3939969280 2813854208 3701329664 1545588480 1932760832 2017394688 1700752896 3232237056 1224253440 1944879488 2400654592 2869093888 1992057344 1596863488 1340533760 2506931712 1583210112 2014700928 2035050880 1498939136 1616999040 1837419008 1343337216 3131030272 1862168192 1991354752 2666699008 2814223616 2308625920 1937430912 1063627392 2687471872 1870911488 2247969280 1073151680 2530874624 1552408448 2269259776 1301660032
phosphate 106102304 180992048 179823968 172113408 146086512 162140816 197679376 166172496 135653760 127248936 159415616 221174128 150116144 188582752 170643152 165281920 204936176 166720672 195558160 106245344 142600160 173687136 165704336 129097632 159841280 207721136 189664688 165454944 182442208 154391968 179671440 203577232 192520864 156187408 167322592 186478240 224077136 234586416 163349056 221418400 136972096 162780064 212242848 213143808 214426640 172092976 180015408 153497072 223077520 137855152 260834000 340392992 65438268 186375232 198284368 101541816 166153104 190938144 155111968 267783040 159722336 132961544 433849344 173321968 413580896 109998376 262091424 171300736 260083520 125321128 199225248 130708392 101826888 76240008 365543872 184267520 204277920 183575456 156621392 322131680 136611376 285947712 255318256 311794464 164648848 180870144 97051096 190146208 159375536 157585072 110790192 95528984 471937888 248924208 229487504 364937760 299817824 259159776 140995232 156119344 85221320 204801856 243712528 125098400 139879072 264248320 106176200 152829728 192853360 125461680 151622096 241503584 117498448 129231760 231202928 199722368 222996320 550371264 121928896 149396464 375175232 304551072 166737536 232518496 173211376 148067808 93753432 235532912 204805040 130767768 217979472 153767952 162892496 126030544 96783520 104019280 91738448 197776208 240604528 325245728 162847296 132980224 309553952 210967936 191320720 109642288 102824624 176016496 292256160 250020144 98870568 171983712 79113032 145766912 387700320 150681120 131949888 218707520 132627424 124089360 49492288 126215848 259815904 152066224 205402656 82827096 178497872 152362960 245819136 161258512 38843944 151808784 439417216 187660672 138454192 98231088 144969600 103573168 174796992 149297632 181205888 215380352 147680368 356295840 249095152 126815416 308838304 151933312 557448448 261165120 150635152 184543296 54919320 224051120 141420160 322046368 143819184 349086048 245633840 58381276 269474048 136555984 293435648 265956064 150167296 137633808 115493440 125202288 240183600 310547488 87805152 131428560 29895654 236175328 126772528 164693552 167850048 417978560 127880288 236996288 143923488 127779488 475782592 473111616 146456112 123518912 122071504 74945584 125918536 171723808 246686096 197645328 96158896 322158336 315903808 207294576 172662784 291096000 355138656 187894080 199777712 261914176 291493280 153270016 175881200 107072344 181662320 389514176 162608560 212069264 165036480 273275168 141954224 232683968 181662048 334530080 251235536 149828608 116502008 138014128 554762240 107741080 151635824 278075744 243586848 91159288 224566928 193929536 341311360 184214928 187835840 151991488 172113408 70732208 152864832 177786864 140684032 102214944 112556248 142621568 223924528 152154288 178789024 97497752 225729536 252297936 278448160 109421856 284625696 138885792 89983712 138917936 175233344 244059152 43202144 172748720 159537200 172243120 299749792 224672960
proline 2111375104 1339559168 1465116416 1505025792 801927872 1697364096 1465990528 1352821888 1800776320 2353827072 1649772928 1202280192 1495903360 1068962240 1440420480 1619354368 1260564608 1919174912 1137924224 1520940416 1174977024 1500827648 1516616960 2917113600 2291479040 1170188416 1527722752 1191885312 1995315968 1334345472 1679148800 2652272896 1522015872 1934561280 2210660352 1701686912 1957209984 2621654272 1298547072 1460408192 1558049152 1213170176 1872675840 1046881920 1668827136 1532253696 1261633152 1756973056 1432619776 2090708480 1047614784 4703920640 2390587904 1492471168 2712097280 772628672 1436139520 1396909952 857332352 2315270656 2229427200 1282280960 1297106944 801290752 1888804736 810631872 1372755072 1094168192 1188111872 1223129472 4038182912 1150383232 986087424 1065437632 2156911872 2163992576 949163072 1891276672 508835200 3131929600 908551296 4531272704 960870208 1177597056 1368461184 869663360 1030793152 1553234688 1026759296 722940032 1747087360 911857088 2426582272 924014336 1057688320 2722949632 3466456832 2329139456 1099074176 671067328 786511168 3092449536 715333952 861550720 1152430720 1708849408 612428160 637882880 629326208 1154791168 1362336000 951060160 4506570752 1664001280 673588864 1605435392 877449280 1824908032 710048832 1636083072 7852001792 1606461568 1267681792 3377600768 607869632 3506949632 497268160 822202240 728372288 1568524160 3175225600 2326860032 1125025664 1642380800 927032960 784771648 749655424 1357220992 704756096 1329435392 1730643200 1273427072 7384143360 1566417024 801921216 1099236096 1199934720 1519137536 2792895232 751917440 650484288 1438242432 658623552 1255564800 6380934656 654599744 3107245824 2244657152 732710336 842965632 644076864 778706560 1234505472 1183088000 1688977792 1266162304 1365341952 902136064 1418677376 952568704 1555993472 1634984960 4074628096 1095223296 2052391424 1244932224 2798712064 1731361792 996900736 1347534848 900452288 1937095552 1067080832 1740702976 3195889664 2293820672 809309120 1381115392 2125325056 2403419904 1124244864 2907884032 598496960 2284614144 1054627328 1118915072 667943936 2559271168 1664724096 641235264 2519030016 2152107264 4732056576 2820581120 1036290432 1970490624 873277504 1387224064 1202472576 2563379456 799054592 970515712 583465920 1246130560 1404558848 1490014720 1202425472 3115266560 2569745408 871261952 1219784960 1294431488 1881629568 1128648960 1452100352 1607220224 684017856 1123002240 1643900672 1567790080 866165376 6674693120 1805672192 4718425600 2520964352 917931456 1698100992 3235477760 975018624 1108767488 1382053248 1714898304 1276861952 889228224 964145472 854578304 1083827200 6584727040 2026272512 1545315712 801962560 2575726848 1470182144 1300649216 1380177536 1736690560 1189991040 829030720 1235336832 720682688 2756494080 903569664 820871168 1381115392 773783872 1585192064 1689816320 901778688 2939595776 865615360 2112544384 966768192 1447806976 827860544 1679876224 877444672 1161686784 786823360 1537288064 2238387968 1775255680 1051914816 942002816 860816064 1143966720 2073716480 3061472512 875744384 4649478144 2100199296 1205576704 1556879104 4342043648 1367288064 1591562880 1061549632 2354868480 1750868608 1719335424 1554281856
serine 167724032 158502528 200386048 182895360 92006808 145414576 166658592 184744528 231911792 126081752 140175360 176754080 172389440 139884176 143008576 201978816 152658416 166222144 138112048 154312800 178360480 193190224 131033128 279069312 159121184 261326096 180489008 138356224 165620880 120587272 148011776 161560144 184042176 176586512 241614640 110338016 183474688 244048720 169935520 174217648 217175520 136033632 163965344 146486928 157795440 158538160 112575864 181611776 173124928 149172448 87682264 96173648 119004592 95440776 53491784 48737060 162752336 171732512 149406080 97648624 125909680 172085888 113691264 80726456 59893356 126823976 68921136 107360152 58065532 65285704 158073280 133634560 137771120 91483048 78468240 107734912 144537904 71074352 61417660 45049816 95023120 204577888 83151152 47276996 84216648 103150176 114721840 65592044 151271552 94966200 99628208 124938760 119999648 116326512 75914728 130570976 131837120 149062688 32794566 96244160 81003664 149434752 60759016 110270448 150346128 75522552 75205880 151659328 121286336 118984496 134943856 88957216 136937952 114479360 77414496 106759960 97539704 40864928 119515824 102769056 271297152 41019152 109941736 166738832 65033284 180513616 79214736 32177734 74767280 79679160 156748864 80227104 121138520 94394512 151633216 155819424 73864328 125837760 47299692 60532680 78604664 177394240 277385184 64830172 98271728 123949696 129854416 156604768 87427040 91779568 63244812 75546328 119930792 45933596 101158912 84730464 176942416 115526856 84820544 111397048 75358752 114513840 109051976 144088912 66973040 126398960 129526376 112799568 95253824 101983560 142202240 158632976 67650424 88660744 112074304 121264024 108300280 143088640 128205584 89578528 130123288 93568792 86312216 81030856 167896336 126633264 55979000 161379424 108929640 44840100 101299040 119356200 100827720 86494064 64156908 63969964 43810060 91768448 74392264 87555624 70692832 151639024 82532992 130874568 139085872 135400816 107792216 186059392 32298700 110270448 28699254 132402560 82600248 68359152 94092416 101542656 120204640 65956376 109053728 88476608 90365672 147246256 87946016 46716440 128086248 187265184 112622976 81374232 37242396 126906712 104256184 151479760 112751232 156154864 69733888 51419280 171217872 153099216 78139240 166922176 92865464 109168208 110202880 83313384 98561792 109101472 34757280 154894720 103203048 47447472 105867664 56253800 72924192 85100152 175563904 183390656 24941024 41916592 131095656 56643644 124726096 111549600 124094096 93006304 52200580 88805760 130998344 72065264 68781168 93177600 111762016 170388320 75212216 88487680 72057064 96289016 94011952 74812016 167336784 115886592 216339520 135576800 101940896 99567192 65203852 66367528 66029536 106275080 106414208 126001160 143091264 67301344 191971136 105757840 169790224 99646816 114600656 88817640 87595392 59685632
serotonin 73147.3125 77676.6094 524336.9375 36556.9961 42150.9023 97117.8359 423230.7813 45850.1719 183408.0781 707409.4375 111873.2344 106488.0938 177853.0156 57603.9727 318555.6875 249958.7813 56956.0273 130011.5313 754175.5 308237.0625 39722.1133 40314.1289 227336.5625 262448.125 175929.2344 76140.1172 52472.1055 134608.3594 272538.7813 348576.5313 144589.2813 221586.2813 691065.0625 36425.3906 268647.9375 563548.3125 285621.1875 65955.5234 247396.2969 66976.2813 107465.0234 123652.0391 71741.2266 249335.125 397270.875 193632.5 145729.7656 68117.9609 139989.5781 136761.7188 269055.2813 120449.6094 163847.1406 50179.2305 99513.5625 495543.0938 199617.5781 3496798.75 124227.6406 210513.8594 146982.75 87640.4297 227859.5156 237781.6094 198153.6406 267494.9063 131868.5156 149659.375 472412.7188 48509.0977 164355.9844 423825.4063 175650.1094 145064.4531 84511.6875 125163.5313 98082.7266 201127.4063 60783.5547 157693.8594 313069.7813 1193275.5 121619.0547 153799.5469 49216.1563 149432 99127.4609 148822.0469 83452.2031 59501.8516 61969.6563 724137.25 1734247.25 239873.0938 75155.6563 107530.2344 130744.9609 587605.5625 181428.3438 70252.6563 94965.9375 45089.3672 563908.0625 104195.3594 401238 276401.875 404339.7188 261066.7344 162856.3125 106790.9609 196064.1406 521256.5313 188189.5625 133755.6875 102520.2109 70989.25 182595.2344 310836.25 149204.625
taurine 34919044 48788768 55569424 42246476 57917368 117153832 53782552 34072416 69611048 84550608 50877088 52672068 86429608 40070176 41644204 42226796 52801252 43937524 118849624 69310880 59029060 62107084 61657888 65205184 56467176 66131388 67598624 47795224 55457844 118458136 44972024 82469104 45488804 99261552 102285280 47933440 81213088 119780768 134044560 52739260 70629184 55374296 58482644 47712212 60331924 76274688 57871944 58858880 54715512 56254464 75534896 29184784 46080556 37350152 23625090 48555016 62791364 41312208 34029236 78731832 64907108 32846558 111463360 64660532 149663136 22210240 209143632 67504096 30704072 60530936 151214176 58425212 48788152 19711646 78192184 25434922 53470056 44479744 85499984 22553656 52723276 354552128 80389856 27704090 74080000 4721773 42295964 217115232 31810308 23351874 59528288 56479888 331502016 61954488 50049712 55111104 646328384 142591616 24506424 26250666 28053984 56110496 14177866 26093478 25619852 96573464 44047264 22581862 31202150 46371160 152728992 48473944 32640408 85213800 34944808 31733982 49410208 200812160 39246756 66039188 68028024 176237744 79056984 107692696 16899024 75335184 44846712 19231240 87642808 7384159 16370357 163174048 45088444 31058956 14765496 29887500 43554388 35624668 20009580 945225920 54250036 28300746 42291260 131443112 43247372 39359348 51164156 52707732 70913768 42094416 57851336 17157988 56281660 250696784 327128544 37556840 25306598 44671100 55889164 49067052 33443056 47507412 38294156 43016652 32809380 55720256 18830744 78746192 117862048 30057328 7411669 52433640 44907984 45380800 39834124 56539508 33209184 33418784 44356328 64027016 33251050 243626784 69257496 423339584 28825446 59795832 26133374 39021068 356186112 46077340 63990888 75499208 35239584 56965196 67526200 168610928 31936420 86830792 187957808 47098140 307285376 69215696 14541848 42250988 55681000 48153360 14904359 34781108 133809528 83154376 22726018 40148728 36451788 165270720 89041848 29469322 15224014 426976096 84176296 170724864 171085680 38798480 50039628 72666384 32884620 55252212 60506372 87762472 74410704 76238760 42830588 211131728 30301226 169678320 126847000 118288168 75679232 56481280 71045536 64313940 112523376 55569424 59035796 47800760 38583840 93161008 79975496 38152164 46852112 101550408 34752436 180574592 120084080 312488960 110080200 76220232 38667900 256133008 36145984 23413742 474164512 71165080 79982496 433516224 57553908 17157690 69910224 108913632 183221904 22329490 70166408 53298136 116679304 44263104 53886380 54196936 90714672 48353932 84536832 45394516 61894148 47618412 73962456 92648048 97446360 190558912 182527712 48075876 145757632 74774344 39724868 62010180 76042792 198854704 45777696 54073292 34737304 46700952 107470648 39676036
urea 195643008 393634048 415215904 353579712 233963184 560806336 298021248 352724832 517873024 1613926912 373801056 504357248 497441504 393704928 331885152 393018848 432970304 329170752 391558208 412745440 593563008 661291584 661927040 411931808 773389312 299917408 415351872 340901536 524390272 392064128 231162256 421702848 729084992 618464064 512045152 201838032 625410048 961859584 545529984 316454208 337716064 778783680 468340416 374059200 484851232 471102304 478079584 258112688 479920288 478630464 3884810496 1335455232 385553920 1537443840 1622079360 2290614016 266013376 754038400 261602384 2866386432 2059249792 684939968 4705702912 494061952 5167406080 302080768 2461302272 326766720 2826372352 435446816 2262003200 305303008 493378112 341992896 3597697280 1824243328 498817504 1070329216 2025056640 1321118336 2835455232 2557379072 2531902464 2834701312 137933344 1433081984 321702976 3401980416 297568672 258404848 494014688 187415248 1244871936 3619092224 927661696 1966811392 3940998656 2509015808 2710775040 295648544 963690944 756505920 1881407616 695256064 189241040 1868289152 973792000 265547952 441828736 275069024 748499648 1764844160 482831392 825363712 283645600 743785920 767553856 2728406272 1392355968 1143662464 1691021952 6223178240 426026656 3020077568 2620842752 900806464 646133696 1585070080 2518613760 3690853632 682729152 2166458624 865183680 2488118272 370795456 171992832 1572456064 491279264 573496512 5575817216 842780608 564798976 1896261376 1656718464 401820128 291210912 482685792 486557504 3896234496 696272192 942420288 1718209792 360220704 1432464896 3910846464 998841728 299087392 525398336 1209147392 452602016 471382720 784178048 1744960640 611149568 3986009600 1351808384 1278683264 629192064 868603840 1162447488 459806784 608848384 3466212608 717549632 438732544 554189312 1236406656 675947264 342960224 686854656 583129920 4835144704 1190610432 3932267776 3731297024 398069472 2491533312 485101888 1576523776 2698537984 1210647936 2032867584 403288576 935180544 1020846016 3080429568 801465280 2736238848 3453920512 315262720 6040427520 220969744 698355520 1289389184 298127712 377537920 447340832 219553600 3408236288 1139607936 1066184896 386692928 421189696 1294713344 1504719616 602021632 565525440 3018168064 1863417216 1215389056 1520860160 332813760 7001675776 1738285568 615547520 433876768 356009280 2161251328 637906048 1206609792 1466470144 827807552 470445760 2043718144 1955975424 1376239360 1558525952 4613136896 5367476224 431981056 1962425344 2502294272 1458593792 1326486912 832050112 524140608 1492533760 1581808512 1292629760 2185295872 261231360 1212221824 7589129728 1734518784 1121705728 3946031872 1760745856 2788365312 267367280 498200128 1370163200 695927360 360875424 3681704960 1657337984 539486784 1153089152 1618278016 725823104 603919360 3085042432 586435712 3201567488 332899360 470337472 359422784 1185687552 912268096 408674528 683135744 429259840 138288192 1033304448 778783680 1582333440 1631952128 2363928320 566876672 1791496192 1525404416 389738208 1834266368 1025509888 1583613440 287308608 1961277952 1232698240 274789728 3227720704 2627198464
trans-urocanate 1763496.25 2553803 3015582.5 3963611.75 1504106.625 1260792.25 1543968.875 1730411.125 1925561.25 1003934.188 3202786.75 2753376 2380221.75 2138018.25 925352.75 3166340.25 1025933.375 3399367.5 5848171 1441107.625 1134990.875 1903384.625 1512942.25 1303143.375 2576601 1092554.75 1748132.5 1154719.625 1789818.875 1253286 1996536.75 1288806.125 2834827 2436730.75 2599635.5 1693885.125 3581896.5 8001685.5 3768936.5 805843.0625 696555.5625 760048.75 3411915.5 1174835.125 3090061.75 6718630.5 2820094.25 1469107.25 241567.6563 2060947.375 9343398 754941.875 1193735.375 2266079.5 11796695 1203271.625 1428672.625 1561764.875 1589120 54925468 2234292.5 2088496.125 9789092 626533.875 136193584 2986504 4145895.25 1191096.125 2780804 1121668.375 6064133 1613723.375 1035966.438 1697888.375 6624158.5 5158619.5 665553.375 1188159 8793101 2756363.75 1952580.125 6953704.5 4793284 3285121.5 2169970 1468994.125 788150.75 1749445.25 4891064.5 749228.75 1214680.125 960376.5625 30227322 5075467.5 767149.25 2082764.75 440982944 846241.0625 7986421.5 1453872.625 1978692.5 878289.25 2809419 1194765.125 1188031.875 1919363.25 1460712.125 1552188.625 2312896.25 1516378.75 1293712.875 733686.3125 1487219.75 2349808.5 715870.375 2010460.375 1380519.5 3019247.25 5699053.5 3315969.25 12554371 8395649 1512697 9744673 17434960 3661476 1472862.75 3916366.25 2050202.875 5914132 7198003 1420213.125 2648791.75 45630164 1108975.875 1509996.375 17650164 736955.0625 2206695.5 7942435.5 1581778.625 6968868.5 7694974.5 8860965 2657284.75 1714953.375 1209948 917998.4375 1662121 1087443 1521897.625 2467964.5 1331027 694581248 19759782 1960848.125 426307.25 920611.625 897446.4375 8020833.5 1275405.5 1930609.5 8198319.5 1804342 15092870 2760960.5 823364.25 12139708 5076243 1323182.125 1520025.5 3166815.5 88708896 1284659 2019994.875 1745560.5 1117820 2449936 1013959.25 2023120.875 11715878 4056359.75 1011448.688 5675548 1405855.75 1893677.5 1196309.75 1030021 2047355.5 2988299.75 1048946.75 1810266 2671373.5 14558008 5846461.5 20049296 1625769.125 1945133.625 44701988 1942079.625 17627862 1169037.375 2798627.5 1034921.75 726770.3125 2403171.5 1194604.875 19295302 1138204.625 66494488 9892393 661023.4375 6140939.5 2899046 1978692.5 756355.5 1440816.375 20983680 7556288 940221.5625 884513.5 988132.3125 14713478 2804128.25 24955480 1495577.75 2151496 2138413 1358807.125 2982667.5 1986656.75 2647258.75 21648066 9747426 3991085 1533114 3652223.75 1740254.25 2296290.25 514436.1563 2072042.875 1204823.625 5184159 3748176 1278633.875 2393943.75 776673.125 2132322.75 1034505.438 1406837.125 597203.1875 11887150 5144397 2950540.25 2389545 51363292 629735.75 3655709.75 1746193.5 2125984.75 4722678.5 908123 1479365.5 13386640 523186.25 10116508 482333.5 862099 607281.75 1132017.875 5167010 1719659.125 3214006.25 1030833.25 1182507.375 2044554.25 991685.25 5442769.5 2861581.25 471194.9063 2575526.75 1007235.625 1283101.5 2192552.25 1163160.125 4528637 6664574.5 2356613.5 8290284 884127 1382835.25 1102417.75 4052365.25 1643108.5 1089949.125 490469.4063 1763878.5 425795.1875 2469278 791697.375
glutamate 1007278592 516063552 488431168 720474176 287470944 434687232 728650624 610570688 276879296 442364128 621410240 688444736 216226960 274330752 255239248 518818432 228381376 630431616 432936608 338042368 130637408 271815936 228134288 333472672 194947376 239812592 403104288 247628112 275649888 193309712 248115840 127432184 153360096 211560224 194753040 330990144 538118464 339183392 180454192 324474944 204501552 399851968 273633600 455852864 314071296 557717696 507872096 178489648 1124415360 354507104 772507520 582694976 1786171392 128944568 256755584 220271152 645006784 527188960 456256608 661280832 1684487296 315120832 390199808 1162184448 596174592 358970752 614338752 227026992 283793408 160499280 291739072 683325376 465932512 164373280 269905888 1126745856 346223936 183598432 138285216 284592864 343595168 169031920 418977728 259688752 352262656 235386048 486775104 218088848 305947488 986745408 774191488 990265792 339725152 578412480 413719616 259704544 305316672 185525968 358826400 327998080 108642856 234671104 322321280 581741696 249988208 613286656 607688576 202078112 459496032 425785472 538231168 223317568 292243840 320586656 326147744 379870144 228574656 81551472 220253552 141814800 249203696 582506816 165321104 650036992 236596448 138985312 288758656 235713920 181502032 328460224 241622416 690941568 404864768 448971392 350900704 458280896 347785696 452536896 305106592 243377312 614370176 152215056 686086080 205364656 200305424 243218592 235880160 535314240 310515200 604876544 211549056 211242816 128509672 327633184 399236448 373822976 268822080 373295552 546115392 415487712 495494592 672476096 380480608 625424256 875362048 186582272 192045072 722772544 447555168 913766848 405854560 280221728 179648288 227331584 289789536 774265536 915266304 195101376 490876160 541466560 213006320 1236522112 269951456 249646128 539552512 383172096 310834496 242963936 248744800 192226944 531003296 463236736 177209568 419717984 1037348928 185514016 207676240 602766016 336901376 376040096 377979840 404857152 292303584 636808640 421080128 815809920 939320192 221486416 588778624 642503616 278687936 633090880 142401952 444891680 646248512 336296896 309659744 397488416 733253056 228386336 582515136 251382064 830832768 430914496 880495744 366487136 459276672 140199040 87285144 173550192 334578272 615536448 404827136 406568384 300808480 415893376 282035136 518801504 149441808 721666752 1001715136 384300672 353808704 342472096 566383808 299211712 367998624 174274672 446316640 154753024 348240288 630712640 107526920 137071264 481433952 134733376 220461488 131582400 227259968 379563168 470034560 128343616 257724048 1320798080 188519504 544582272 980724608 344356832 1031082624 235891056 122693920 184800464 90702960 257576128 252219616 143084192 394677152 338042368 568408192 578465600 1864046976 383848448 118903624 196510080 632141632 212867248 112186816 181168144 423392480 253154752 282491104 405501728 122988848 727314240 1124072576 159840192 166442656 304906688 184993696 100922360
glutamine 1794274048 1992858496 2371359744 1898456704 1479796736 2353329664 2176124416 2092331392 2783561728 2098978048 1934170880 1809372800 2332361984 2080825856 2091088640 2862526208 2068260736 1733733888 2196523008 2475554048 2385551360 2916096256 2389226240 3208320512 2894993152 3279363072 3458279424 2502281216 2794675200 2127377536 2585235712 2340877312 2946387200 2921063168 3554742272 3590665728 2786743552 3146811392 2687120640 2231815424 2030988928 1753178240 2276081920 1925668352 2332886016 2381594880 2444880128 2911707392 1464345216 3323050496 1215891456 2816159232 582722944 2628201728 1921755520 1194901120 1777551872 1795369728 1250363648 1785812224 3431091712 1615602944 1354131584 577363072 1726953472 1292184192 2069052032 1237426816 1728628992 1481554176 4333267456 1238064128 1399290624 1078158464 2461647360 1656891776 1555010944 1893485312 1014890432 2533036800 1197933824 5491887616 1121972480 1532611200 1385777920 913409344 955498560 1445476096 1211313536 1202401280 1384917504 806531968 2970506752 1031209088 1784663552 2794629888 2546685696 3485096704 896182464 943018560 1041175360 1609742464 1426967424 1358236160 1299678464 1206809856 900147136 1297170432 998014080 1422687744 2293296640 1650014848 1616185344 1470792192 1619492352 2574149120 1887660160 1336725120 1570929536 1615104640 10121555968 2019251328 1175470848 3406701056 1299629184 3062384384 853597376 878984064 1569646208 1459844224 2283797760 1403907840 1407558656 1670335232 1142204160 1355490816 869086720 1321987840 1278733824 1092688256 2027550208 1919544960 7642928128 1137394944 1651425280 1477149312 1764764544 1479398784 1581400192 850400064 1277254528 1618036224 1355412352 1569792896 4731667456 1076617856 3527880192 3740526336 1227538304 1675941376 1083762816 686748800 1602271104 1610724864 1162818432 1694888448 2062578816 675582080 2017085056 602986816 2656718336 2611570688 3346445312 2695215872 2277163776 1689789184 3805382912 2916992000 1321725696 1647032576 1775170432 1349851392 1616435072 2258476288 2549959424 1757296128 1017447488 1550805632 4162971136 1927883904 1131496576 1830496768 1231826176 2669843968 724352128 1017344256 1227043840 2245459968 1810517376 885786496 1576936320 2107206400 3029053696 2580623616 1297214080 1085985920 756799872 2391971328 1292652416 1311119872 324916704 1620935168 1390788992 1320416640 1402815232 1127956480 1717424896 2226660352 1183007360 1163674752 1463466368 1264595456 1197874432 1325413888 953039680 1791488128 1714134528 1212657792 2286476032 2661672960 999134720 6932515840 1136532608 4272863232 3809355520 714376896 3283673088 2931439616 1797439744 2530024192 709143168 2233545472 2320227584 1375210496 1943905280 2220097280 1643327744 5835023360 1787338624 1421327104 1388212992 2666706176 1244276992 1494367104 1666622208 3006034944 1491280896 1529814400 1804681728 1323432192 3829458944 1433774720 1619841792 1124314240 1044596672 1615840512 1502704512 1411587584 2275678720 1772557952 2420315904 1904115840 2194377472 1010624320 1920925312 1373532288 1687526912 899121216 1881511936 1694888448 1931078912 1873423360 1885759872 1806003072 1631641856 2135031936 2571245056 1652294528 4525212672 2212120832 1381099136 1894844160 8018779648 1389465472 1543322368 1691328128 3735707136 1587484288 1698448768 2554157056
threonine 548609856 428066080 567577856 406167808 222490032 528619808 395413280 406722816 780584576 482818912 399848576 326109120 656647040 283538080 359822304 502197568 354626784 545306688 356813952 584129984 410857792 604971520 338504576 680859392 683275456 615274880 609304960 369827552 450958432 310868096 485309088 472602912 446907424 536365536 680672768 563455872 798360832 816850240 514032704 460907040 455985792 346819232 374120608 338345408 602390464 479266208 694379392 581792320 358596480 408168544 420955808 481014240 368289632 273899968 295011168 146119936 329704768 344415712 251458672 420120288 317899936 449487712 443010464 171363024 279639520 250052768 394760000 208122944 207427920 224443680 557048768 204954336 243375152 178890736 217912736 358226400 256720112 290610720 234144544 300982624 255057936 760131520 318501056 251885664 200588624 311246304 179162048 281929600 394136224 152754048 354098912 220843840 561177152 349761152 273049824 589104384 437789696 531390496 169122032 147064640 209755904 449880576 200002336 275004960 268919456 210056976 251968352 285010880 123309248 266781056 321586560 294197248 286290240 178813104 153229904 363614272 247409472 302535328 408781856 341756672 2400886272 261696576 232717984 596126208 244731728 993694912 131018104 187248880 176694640 441433152 471117824 334993888 275641408 336151616 279119872 312198976 234331744 260015104 222343008 288254624 140136800 420417088 1903090176 315249216 188287840 222225680 326520480 348971008 297188928 246256896 166445648 382804288 243787920 207754720 440639968 224679024 839503808 505852096 271599680 259933808 195461584 193948256 395891840 360463904 240083504 477029568 419683072 275799648 376092512 376145440 419396640 467315680 365285728 289520864 299996160 255375968 440976896 485321632 236032608 272166368 415534272 286601088 248092256 265053568 546350528 194584336 279272064 276794176 551149696 306559904 193026912 346912512 200981744 399642080 255519040 147974464 98296144 548434496 308661440 194581136 131439544 273541056 482007776 538494144 333531136 337478368 305147616 582973696 157896176 272800576 143054384 340438496 270727488 203356880 250007712 255428272 312950624 282957024 510603296 282966016 275060832 376859904 332678208 329434336 354907648 423311552 239731520 247303040 143599408 420393664 233393712 619159936 442891904 853733184 452540928 228770976 595105792 744699840 249181552 464644000 230970848 395115040 466319264 286298240 262673264 273466784 213319024 1389085952 341485632 192554352 217513616 259167120 106037256 254902912 503813344 489700032 134363984 177154832 287246080 164852352 515487232 264523776 268179392 355021408 242431568 314099936 469452544 159515232 245857328 219215376 372108736 364040288 314099936 286419552 251553536 199623600 236447152 258512880 413376288 634852736 403297408 207756960 244486416 253622592 144074736 345663968 373554848 275154208 380783136 497183744 334545664 183304816 1101411328 203305824 416568160 220523680 587126208 196254992 153581056 328976928
tryptophan 579043072 562411904 782476928 852449984 655983296 776011840 852421824 772645248 659297024 578780992 719477568 602191424 887732544 472527648 833999616 901554560 715997248 827228224 703128320 758778176 545757568 833634432 663528192 947208576 631954048 761442112 1008824128 626713280 594678912 748025664 862147648 554118336 684601280 812357056 1034637504 664004096 846926336 972229120 820846272 438657504 470796384 420637920 473594528 676052800 705564096 538876992 857876864 684085504 390279552 764661632 134159048 145037856 317954720 237386064 183853552 262617136 634748224 698624768 549257408 173047904 293945088 307616416 338890048 387846912 48035592 223878320 125827168 449762112 61049548 191241488 206650848 371599488 527907840 78780824 189094864 137657488 364854720 84164336 166887808 64496192 248892224 232724112 135379680 99996976 194166944 200389968 520576992 147026224 225406480 192476464 157996464 466634048 243811008 293556608 268171248 382047552 132453936 738751232 47666092 386560384 273402272 386102752 208093856 319406144 303243552 315106208 145199392 547116416 282630048 232274896 375146368 375953248 407885280 181292912 111842328 102970304 316108032 74720080 465814112 230969536 81208744 107884808 462918208 182349392 118933232 177000096 220965056 44807300 232631184 202034688 530201696 289889088 261056592 122988872 231214480 383772544 314091168 229603520 57134828 286801888 62372816 252574736 230977520 97182640 348462560 805605952 366975168 599834816 476660864 440875968 299652640 101213992 496731168 165325184 144454432 138910912 461355104 163285920 271260128 379385472 465641088 402494976 171445008 512436128 86248008 300946144 378614976 201992784 248324560 202259584 126672576 252063552 39262216 354276896 631685824 527319008 113008232 296343840 555549120 409225440 270381120 227133200 528935264 112392888 256489152 708576640 111162808 206942608 415157120 110037816 208256128 413100896 312794816 186969376 137482880 200630560 65298760 219506512 167895152 236705728 45933620 468582688 116327104 241547456 606893120 288605856 199208800 330069472 40355724 130975512 111301928 208518224 292483008 189696880 274068128 389864480 284525856 129016800 264367072 253762608 289745248 267028336 133694448 95298896 433418112 457125984 338768512 560518272 149188192 616228736 416270368 222327200 611551104 223049568 133028312 225907680 650856576 273640640 275886016 966587648 676181056 401167936 345476480 238492800 136673632 523363360 112079928 398179008 153735952 85948512 274889056 241810912 125780624 177431296 539839040 548133312 110724664 290769376 830705280 186031520 188250944 467384896 694700032 468134752 172189984 347092800 793969792 313708576 122462192 309031488 317432928 791299008 293556608 114103392 88124448 449008000 493406464 570270272 688813184 200343344 853258432 191945024 202097872 226255424 76110072 148390752 176041616 640841024 204148496 512112832 769876864 112659272 363088832 333445440 507153824 213770768 582978240 175883408 236347680 202426928
valine 2829022464 2248956416 2559589376 2856434688 2125133312 2691240192 3037501952 2527979520 2858703360 2409063680 2831307264 2249491712 2744813568 2149246208 2975763712 3083561984 1941926144 3580772864 1865148032 2825015296 1805616640 2632243200 1990161152 2688932608 2471960320 2235560192 2503686400 2182097920 2496321536 2502584576 2216005632 1753256832 1911211648 2270808064 3006657024 2401810688 3024170240 3438235392 1846429952 1937134592 1523071872 2194768640 1739788544 2273329920 2820964864 2479498240 1770030592 1919081088 2297960192 2690658816 2247431168 1323656704 2065357312 1950496768 904646976 1291137024 1775264768 2661038336 2113137408 1554965632 1748496000 1664465280 1715117184 1515077376 1000226112 2397817088 1398793600 1543771264 1974857472 817966464 1559908992 2153611520 1624864896 1538297856 1599577984 2608508416 2009896320 1288378624 824378816 2332337408 2795804416 2784255232 1815276288 1389226112 961877952 1604173696 1800770176 1627663232 2173119488 2013235456 1141413760 2124969728 2066601472 2539203072 1582032000 2096511872 883781696 2475235840 871376320 1578597888 1527301504 1687938304 1783981568 2373103616 1429035008 1646345856 1656798720 2034332032 1793118592 1455795712 2627171840 1828139392 1921571456 1522786432 1189761664 1246997888 1719839616 1226739200 2791037440 2302427136 2358958848 1129267840 1643400960 2768202496 1859240832 1371352704 1264534912 1209057408 1601391104 2319151104 1858038272 1591562624 1810704256 1507588096 2605421568 1777447296 1351539328 2565562112 958306496 1262142720 1119063424 2065305728 2063003776 1253547392 2075442688 1624406400 2731032832 1725003008 1555110016 1657834112 1087336832 1251195392 2255686144 913892992 1986527104 1688185472 2457445120 1073254528 1228615424 1566300928 1856223488 2216928256 1445562880 3704411904 795325760 1775264768 1739045888 2331205888 1358126208 1796863360 2619210240 1228980096 1173382400 2222920192 2342265088 2152290816 1540129408 2033861376 2913811712 1707893376 1501526784 1454443136 1537726080 1935662592 3135361280 2079756928 1220613376 1702090368 1767270784 1644289152 2246804992 1773082112 1833008768 2023966208 1071448896 1406124160 1018220736 1486346368 1062550144 1233456384 1082118400 1394089600 1576248960 2433801984 1557459200 1508871808 1871163008 2286090752 890922432 1787028992 682405632 1921570816 2717214464 1668062720 1649150592 1626493056 1576158464 1308962432 1378390272 1662879488 1376725760 2170469632 2607574016 1909032576 2816736512 1645718272 1699722368 1775746816 984873472 1369390720 1749910784 1405863168 2054246656 2676166144 1203916288 898675456 2476654848 3037694208 1750841600 2176802048 1951770624 2018587520 1532056704 1714943872 1579589120 1275181824 1039110272 1599506176 1623003520 1046769984 1515754752 1415962496 1847596288 785634944 2992287744 2999163648 1163814656 1101220224 2042745856 1145467776 1688134656 2080895488 2398819072 1527739264 1332730624 1520452096 1812476800 2179048448 1365818880 1832896128 2666945280 3056550400 1527405312 1409984384 1274223744 2716000256 2086341888 2208135680 2079008128 1154318720 2487586048 1642559872 1449357312 1694501888 2240375808 1565896960 1309253504 1418076928 1873821440 1946295168 2243072256 1449887616 1382493312 1539301760 1495553920 1261789824 1806181760 1568955776 1320550784 742237056
adenosine 32731.998 55101.3789 599189 510935.9375 88315.1719 83604.5703 670091.1875 475351.2813 198263.2813 86919.4688 709310.125 759635.25 81260.3594 395493.75 436005.4688 136548.0625 261054.7656 83956.8203 175778.5469 371639.0313 54569.0078 164487.8281 196777.9531 316559.8438 236050.1406 291916.375 488407.7188 323054.7813 112240.8516 246568.9375 68780.6719 547726.375 119969.1172 115740.3047 399780.2188 629111.8125 291264.2188 156350.5156 291610.25 212995.7656 452363.5 107249.8672 246876.8281 307393.2813 126333.6172 157700.9688 177997.6563 54558.3555 69133.8125 189911.25 78322.5469 332066.9688 161911.1406 104654.5469 221802.1094 321156 157303.4688 227864.0313 323725.5938 939787.25 60999.168 298272.875 340630.1563 227905.75 86254.8906 433483.8125 503630.0313 132595.2031 515105.7188 75254.9219 37462.0664 83030.5469 58486.6875 88484.5156 661760.4375 85308.3125 107249.75 334364.25 354027.9063 36996.5078 374648.25 149687.9844 653897 296831.7188 403489.3125 99237.2656 616854.5 194133.4063 85627.875 82086.1641 274440.0313 532228.1875 256862.0313 98638.9766 295552.4688 184561.9063 205406.8281 304852.375 127734.2891 268709.4063 51980.1094 360106.7188 198108 416843.4688 305716.125 136542.7188 680251 338831.9375 107596.8828 183918.7031 223914.7969 94768.5234 329235.9688 55113.4336 159120.625 348400.375 419695 229757.7344 138202.9063 153563.0313 103007.2266 565094.875 451714.0938 302653.25 35334.3867 416683.4063 353880.5625 77486.7422 86482.4141 794465.75 363292.0938 190702.625 41646.9805 119465.5313 494730.4063 833371.4375 89849.5391 92624.7266 56103.1211 124228.0938 159865.9219 73222.1953 412087.25 198108 118985.6875 276915.8438 161767.9688 320671.0625 205645.7344 107973.6563 94777.7109 119989.5234 221814.5313 163060.5 59447.4102 232197.8438 211585.6875 560221 76504.8203 103294.3438 198108 272325.9688 78944.5391 82683.5703 305238.0625 318128.9375 196860.3438 93170.9453 296104.5 68190.625 133552.5781 192311.3594 248485.4688 225781.5781 121634.5469 94811.3984 308985.2188
betaine 657178624 486248544 683550080 410452608 554440192 590697664 792905600 468135648 761211968 662604928 632016192 701532288 762612416 335432192 571199488 573067840 660947584 679026560 843321600 718365760 926748288 722887936 583193152 936144384 592090560 783902656 1308307968 762593536 973465856 580428736 1148380288 1001872960 638044736 798700672 795802176 585382848 728621312 609463296 1061244736 1362362368 680664640 534365440 658672448 894296128 1546143872 614514688 491089184 460063968 449812576 528557568 590375936 2019171840 747937088 956412224 709018112 297283840 824517696 789104768 648434304 554590912 595244736 673754944 1231333504 774283776 1038151872 1320668416 814635008 724202752 365165408 793098112 521452800 548946816 742942272 869801792 518093984 868756288 919166144 877428544 652834496 707577152 466120928 1137275264 440324160 378948480 2241124096 505709376 854059072 1004382400 1068246976 901694592 1157737344 609653440 605373056 464271872 1134138752 776862528 3884214528 960004544 628930624 763963264 626627072 880415616 264091008 594171136 785480320 493485728 726280576 792311872 784203904 1193774976 805523136 355354976 650157760 1082123392 800783872 693084352 1042862464 865582528 817111552 781041280 2318323968 291959232 723983296 678874752 190037264 1009743040 1109986560 466517632 769970368 790695360 932432576 675722944 697773952 682791296 637361984 2929869568 1067718976 911045888 393466080 793422528 583600512 783797440 2575263488 1066169920 728628224 912250112 609413056 672987776 238178048 722513216 521417440 609992768 587149888 1561489536 921919232 542913728 1566650624 1245394048 513610144 927884928 220549776 905808640 727613568 816542720 616078848 616126144 899129152 2547929856 600843584 398614816 467601824 839293248 950118912 774761472 774775104 1054916608 679993408 475279552 925150144 650377792 760815680 702717440 703909248 494599648 2453712640 358966368 579185280 725011328 890942464 778195904 1110737664 273462624 1099671424 666891392 698620544 1291379200 370357152 437884864 582385600 998600896 345255648 589900800 2723133952 1129405952 659102080 868473536 450728512 921917120 724330944 1333259648 1312478336 586669184 1014606720 985810496 506410272 903529472 790088320 980231168 1107458432 564155328 1413398144 1071049600 271822144 635264256 1526562816 495497760 642099456 233236336 525660928 899844672 1119829632 2909315328 786230528 1227702400 480241632 567842176 373545472 476382304 711171328 932612224 940966848 768946560 1042532288 518425376 589026752 764230976 434138880 641116544 1156256128 511686976 408518432 1416818432 292865312 537092800 549519040 228123280 480918624 806049664 725892352 633096128 2060537088 211710224 860818624 1577220992 846362624 799189184 804191936 818343296 1958587264 515333216 391592928 814733120 724202752 790285376 518897216 482816384 932437632 464906368 797442240 1087295360 948766528 554694976 609011648 1334131328 534312448 605691072 700228928 523911840 2693457408 697207424 599162368 578216896 1075950976 727162560 786345856 576407360 562212288 547755584 491391104 623343424
cysteine 5109574.5 4632948.5 4252959.5 6431991 5228960 6433973.5 5185487 5998126.5 4939319.5 6910269 5494007 8211573 8295879.5 5189305 6690058.5 9304066 7433945.5 9586676 5397108.5 9432481 6396691.5 9033887 4076824.5 6989391.5 5100887.5 4789130 4833067.5 3838322.25 6894259.5 4760720.5 6444757 5563655.5 7399825.5 8416210 7465064 6424864 10406861 8087391.5 5722377.5 4995369.5 7777543.5 5934641 4020496.25 7002915 5980702.5 8119799.5 6915514.5 5843385 7471035 5663206.5 11151111 9344146 6310155.5 6658436 18549514 8288048.5 4401318.5 6204682 3995170.5 16214095 13777332 8060775.5 16214028 3631711.75 17846706 3058256.75 15414002 2821646.5 11017867 6614418.5 12138741 3426334.5 3238337.25 3650215.25 15199752 8446362 3555781.75 5685372.5 6451767.5 16224676 14517598 10680429 12197068 12606777 3804943.75 4241543.5 3085231.25 14378156 7059724 2984010.5 9272756 5171449.5 11109544 13794328 10223310 20596070 18771306 16111696 15252425 2967319.75 7471035 26841812 7783252.5 7150797.5 3986489.75 10752669 5047481.5 4670771 4459567 6668868 4738921.5 10414870 5591527 4187662.75 3767231 5531812.5 2707521 16483592 8039961 11016083 13578334 21723870 3350301.5 18345620 8680546 13382082 5120762 6118802.5 7781584 32577800 17104658 14791835 4504577 9092402 8674317 2308835.75 6341145.5 4976313 4201680.5 20378276 7328994 10005673 25825502 4477833 3574939.75 4901023.5 3813143.75 4058333.25 12030380 5084077 4890054.5 13562524 4676487.5 6017666.5 19189144 4045086.5 4912574 7745654 8784910 4524255.5 3651045.5 4069405.75 11522988 5687336.5 15621741 4977104 5266235.5 6002865.5 7274011 10201262 2469092 7280710 26165798 19927132 6758286 5882027.5 16825086 9102444 7434167 10029337 5290680 13898596 6171380 11000015 12831067 8693274 11408603 3205253 29139640 19656638 8513152 15674280 6764554.5 16640701 6208569 15678676 3082772.25 25295672 19400192 5057388.5 16701895 4885453.5 17987470 15696540 4559405.5 22123910 9738494 1978899.75 12873865 13659138 9961195 7631881.5 10579295 7127768 6415437.5 3651513 4764773.5 21345528 8030949 10468079 7590780 3051891.75 20893156 16786994 6697136 7652441 7118071.5 7555409.5 10211681 6423858 4645193.5 14514014 9273247 45501552 15323806 12750090 11151942 31580078 7618136.5 7477005.5 7545852 12439185 4293746.5 6474276.5 8694067 9176585 12884694 19952174 20112260 11723349 2811514.25 10051074 11971757 10506311 4913432 22348046 18729894 14737741 5527226.5 7879467.5 27973086 7803887 4004884.5 17616036 6668707.5 4899118 14007025 6389797 17621724 3169781.25 7128082 10493911 23210546 3531409.25 7394396.5 3053290 6333548.5 10927516 5075244 7558453.5 7750491 2321786.75 5736725 14169952 19029192 14954581 20162524 9495591 7268558.5 9559551 5301448.5 6359703.5 7294472.5 13620503 5730471 6317382.5 10211280 2842641.25 16032997 14724647
dimethylglycine 34617388 15996749 25871494 15515546 15180423 24619808 24670958 38020956 24104792 27227744 22384146 25582248 30049308 13192439 19180224 15213600 20026306 34548956 27653448 18265830 19023112 25379978 26796996 25397672 25717462 20134522 30279136 23207070 28541260 20624786 26000748 26773316 27555090 33307770 22455968 23837284 34692292 31952122 41182568 13583656 22255226 22966768 16059624 22784132 35422840 19729160 21446358 15215279 26727622 19997868 51162092 38604904 28199950 52719268 58895404 18143174 124786648 62461248 15059360 77415888 41732100 17598280 232118736 19781986 53146508 25660960 44576412 22961372 19979654 31520838 35500504 26055528 65668860 38994908 15666267 117326432 18917046 34664272 53029596 50964212 21859156 85141776 37310812 23349496 31904936 29431110 22937424 32280658 15502620 13344479 19897574 13534654 9180142 38875312 60961892 71153776 44013396 63000196 41555868 22836082 24054308 26795030 45745076 27655804 30981492 36026004 14461182 11983247 21145204 32268978 112393976 19982362 39980816 47001088 24151196 26853998 67225392 204818784 209576768 21610704 89450344 32129534 18301914 41922032 11774172 17945286 40164984 33307588 25837762 131009272 26278006 68675896 23064250 28611960 39672772 17634040 65703432 24395732 9842545 70127288 16606074 10580650 11957075 185075040 24866418 30612570 10205709 18256050 31478360 43900092 29450136 54412352 11838674 42652452 72072776 29412086 6763924 17789642 14915037 16664986 13645265 45261968 29667380 17917510 47040432 25960654 133916944 66778848 19871828 32071276 12457474 45217280 44819116 20051324 18641060 25896114 62199552 37159308 19800518 29629906 20788796 52141832 50261304 73845264 63988484 27097370 57303112 30827538 26992456 38441092 31194144 16369163 21697140 27342034 70371760 62714996 20041942 39221160 40389764 30464576 28281084 17049798 57418856 34877368 30360656 26703844 17576960 37840280 37788380 38629004 49270084 34614636 33828416 132537880 31275206 43982884 24232474 28398800 95733680 50091852 41192564 46520156 38409552 34008224 17757578 13060538 17142644 13990850 24580390 33122022 65472044 40375192 13878123 74299672 36729884 43612648 26004940 44799768 23417476 27053672 223320864 22220688 110569936 29621308 17488090 16150316 37408660 72298424 20564346 28824560 12946192 31664804 21368720 45158868 17227440 18782550 40661172 40090580 18419252 56467952 46968844 10651651 20539564 105818768 31004184 18881370 54182024 28724488 47114424 35407956 12246638 21890740 37925396 17027720 29431110 16915062 38224092 23919628 22090102 71305320 36920148 21581958 30163178 32317080 24581380 40241640 60382976 26351344 187170928 31217132 20566258 37986036 45519584 46456232 34894692 33803980 14650503 9057893 39218608 36612824
alanine 1150235776 815683264 734255360 980794240 473597248 761573376 930100672 780178432 1045223488 971721536 818484928 899565248 904761856 639597120 870172480 1452059520 844739968 1147482112 801244416 1099352576 616132736 836019072 834262080 1363012608 1352963456 734644672 1043037888 728930752 1345186176 958563968 988964544 1011183424 794834688 923523520 1340722048 1082838016 1176312832 1187149184 999394496 729012928 806590912 655494400 780776832 636247168 1096856576 841074176 525605728 1049781760 801062144 1148036864 687658240 1454427776 668061184 308651392 650746368 470797056 580956672 512710944 371477184 1040672640 1226213248 1075550720 601090496 456257664 797837056 342492576 937589440 475809760 332420288 714144896 1517817600 307200064 401979648 185808288 826142080 621086272 516808160 514297344 345887136 1602285696 342579648 1988484736 555384640 413205952 394858720 506692288 423128704 465625568 695137472 341759616 596705024 491490144 1611977856 418463424 460995200 1429882624 1163309056 815790656 404794976 285396224 474883424 1091257984 260742672 455817472 455184032 602770560 400868480 554496320 275400512 328190720 334762656 392294016 509910400 514492000 337114464 846304448 306149824 367285376 667162368 411942208 4080224512 565268160 363038784 1111581056 437874720 1887778944 282586592 312146432 289492736 463598752 1145911296 529562752 539257344 762528320 398328896 346981664 486669120 433468064 448981728 566841280 721852992 616340928 3951222016 521621856 475727680 432556416 539222144 448316128 570720256 493576800 395846112 581936768 392063200 348594912 1422885504 354089824 1609724416 1445249280 814672000 624591808 278163296 391466848 1186076160 615179712 445904544 681728512 500328928 426605824 1171936000 333841440 411766944 657118656 1279382272 464640288 824282368 518384352 984342976 653153536 402722592 786622912 646422272 640878592 430493472 271390208 581108992 372384960 408955456 397800928 1770066432 532191040 284268416 557922176 401674112 1146644992 625644288 296699904 492101376 1355588352 955466688 388947392 461673504 629747200 1397081856 926424768 428399616 794134720 387939648 558396416 464204704 338768064 336497408 731531200 212713712 367770880 594253440 427817888 501870752 994191488 1030580800 554582848 626899904 553577728 346942816 715009152 382747616 630793792 322134688 466213824 827322624 723255936 373631904 3160258560 593994688 2089218176 759088896 585252224 918118592 689002624 275242816 944251200 594958208 514592544 825908864 396031808 831333504 722425920 517202496 3312714752 475904256 589623488 426705568 1087475328 207726080 527873120 900893888 639709568 563610816 507891232 572629696 543857344 1042488960 519731104 331198592 746846400 462616224 316864608 649822784 279674432 1026845312 422153504 495879872 893052672 589623488 521331360 525053120 268979808 600695360 365206240 829497344 863775680 971058048 274776800 437125696 561413888 458995744 1042950400 1124887808 799596864 1337916800 924496448 506395264 482815840 1452825344 416084960 768969152 490229728 1109794304 405266784 424404864 518788992
tyrosine 284043584 284183168 351282848 371046176 245969712 487233600 402341248 347353632 362904576 382013120 355826048 288777728 407966656 221020896 340065184 451475392 256848528 504831808 311957216 372481664 239299232 448875744 249040384 421693248 299672352 425889728 485695168 251483520 300651840 242859632 331359712 312237856 326817216 437715456 488682720 460709984 443877696 456894720 399446880 385241088 283033024 308494016 245048128 381406496 490256896 340261600 508118464 369438240 265008288 296061536 410040160 814602112 355846400 370502784 376553792 262125424 399655968 559104384 273886976 432451680 398693280 469932608 371985952 237028416 285224864 216143232 263305488 310175680 286556416 288338720 413075232 217474288 339184352 147050064 392045984 239628992 312887232 325446368 300522688 259146832 243834368 496377184 235826272 296232992 216087264 308267744 172056208 229138720 356222048 266258496 474305376 304689120 473098432 261682784 246311376 739787648 405124352 674543360 359700928 233347968 292283648 415195840 225687936 237027584 378812960 407238400 306705312 285454176 178602672 343296608 199896160 304184160 258742976 247535888 224412112 392046720 315765184 222139664 455368832 308390720 1502527360 217004736 224927872 383354112 250288720 962653248 185321840 326420064 214505808 334947040 598963712 246382240 274691968 439604032 308037120 284617824 242877760 255024416 155764640 315399616 143761616 357785408 1198001152 347647424 255334896 302404608 284148416 498416864 400987296 353824032 264930128 231517744 263034896 241186720 664933376 225000944 485384256 442662496 227229296 269121280 190146720 218837872 324027584 395519136 170887584 508494112 582767360 302974464 355134048 297846176 274455936 730236544 636576896 366929280 393397248 337969728 330785088 362775584 321156416 213067440 514941856 308111904 416486560 240382272 405671968 300180608 212091008 285960320 562238336 351055072 237517264 219599760 207027696 414242240 212293824 210387552 140895792 414480640 339117440 214788048 153612752 316130720 793041792 338813408 459815744 339721088 236190432 592069824 244871104 315765184 228031504 283617312 261319968 297540032 208630880 532242368 312407712 508102240 514160672 292013344 322151936 345486976 375524640 342111808 472892160 378718560 360270080 244304704 242164560 601429056 335840256 521954592 610348352 848599104 452814944 223998000 599764608 303212704 181958256 677134080 248287344 389068992 440927008 267794944 336044320 272500096 263454272 692303232 200670160 125384896 212108640 368801888 108492536 206974720 447125664 308740672 236222400 162397312 463308224 238485584 380708384 327497856 232740832 397204832 267153680 344229824 410112800 252273584 245985296 249243712 259906112 369600192 481757664 260916464 281140224 260680064 353205120 301628832 431831488 480340544 543938432 183232192 268174864 227418960 289863648 336223680 382914208 379244224 431743840 479863360 329676480 198251792 585436800 194284048 384293568 182986864 591379008 244071600 153639696 559008960
cytidine 35586.8672 114994.2813 46209.418 50409.8438 79283.9922 25089.3066 54491.5352 66611.6094 329366.9688 81586.1406 34943.9531 56394.5 55202.4141 34767.4023 59717.6641 77463.0547 56531.9883 104556.875 119886.0703 126968.2813 86713.8438 200609.9531 49995.1523 96207.9688 49637.1953 302173.5938 94195.3672 44984.7656 73372.4063 61513.2461 79890.6641 64150.9609 187514.3125 118057.2891 80846.8438 56855.8477 136707.1406 57242.7734 54332.7422 87090.1094 43092.9688 130752.7422 66388.4844 98160.6094 61350.6328 186036 157650.0938 96836.4297 615818 341234.7188 502150.9688 113481.1328 57366.2969 44715.793 303327.75 276087.8438 98073.8281 551231.25 132860.7656 113632.6797 203081.4531 219112.9219 407676.8125 84454.6563 555028.5625 140578.8594 146733.8125 104485.0078 44593.9258 299441.375 114077.9531 465788.375 354724.2188 117087.0781 528522.1875 309585.8125 237906.6563 215483.5313 341795.625 255308.3438 114676.3359 388264.375 123280.3125 146989.2656 376892.7188 34110.4297 432566.9375 237491.0781 187560.8906 154874.5469 419045.4375 352786.125 102889.8359 258322.1406 321802.75 694986.375 444127.6875 203772.0156 268007.25 296261.9375 69951.1797 172411.3594 199780.9531 240668.1406 462705.8125 322401.1563 556264.4375 457425.8125 146357.2813 257373.7656 111664.875 87478.6172 250325.9375 200666.0156 246764.5156 166850.1094 595580.625 290186.6563 124694.2578 499980.0313 428760.2188 528401.125 87648.9141 79928.4688 174699.4531 415671.4063 506123.5 139967.8438 255388.4844 291714.625 67789.7031 612108.3125 131726.3125 565026.4375 117870.3906 612820 329832.6563 106046.0703 70256.3516 63562.8086 189878.5313 213500.75 263915.125 350560.5938 518359.5938 87905.1797 538532.0625 263342.8125 217400.3125 101886.7578 182295.8906 403727.75 244713.0156 109673.1953 104507.5859 111251.8125 141614.0469 189106.6563 162976.7188 525462.8125 155811.0313 364072.2813 185780.4688 151847.0781 62025.375 124487.9063 187042.2969 320417.9688 325559.2813 159926 214649.6094 281457.3125 237386.9688 171047.0625 1461840.125 183219.8438 274643.375 207547.5469 71679.75 540624.9375 231763.0781 291362.9688 43218.1914 163564.7344 261293.2344 524376.25 160988.2656 85329.7656 210043.6406 90603.0859 90138.4766 69714.6641 83792.3359 445255.4063 208191.5313 199661.1719 105758.1328 299490.4063 367790.25 164697.75 378807.8125 71884.3047 207215.7031 327861.2188 186291.5313 104158.0703 290565.75 433386.7188 209419.0625 218515.375 170229.7813 293845.4688 192585.9375 120149.0859 77293.5391 123424.8281 217384.9375 122443.6641 478559.1875 394701.375 103682.9063 172410.8281 228150.2344 220139.3906 388545.5938 228984.9375 382545.7813 346785.875 657368.6875 401244.875 146280.9688 120070.9453 90521.7813 106414.5391 623027.5625 535929.375 276933.8438 129714.7656 228318.6406 208652.9688 302298.2188 265516.9688 63472 226163.4844 105926.75 75046.0547 270110.625 52168.2617 191179.3125 152884.0781 331445.7188 204756.2969 139489.1094 116572.6484 227077.9219 59992.7109 74172.2969 209204.0938 118751.1797 209545.3438 382509.7188 48815.4492 321804.3438 105384.1484 201818.2656 268001.8125 440242.0625 163816.7656 55546.9141 145328.4688 175891.5469 394402.9375 237612.1563 57536.5938 313678.4375 181786.3594 257045.2344 316535.3125 529915.6875 82807.1484 122260.9453 230016.5781 133190.8906
cotinine 10811220 26237170 1369407.875 5306892 25576866 5669262 64907.1914 12574972 15862666 13853925 2292496.75 3214643.75 86686.3672 234454.25 2840503.75 525874.5625 302301.3438 676165.9375 17466308 1356990.75 10207575 87594.2188 1601651.5 100891.1953 73544.9219 6671167.5 6831502 1168846.125 62383.4297 1046448 416616.2188 12890754 1027296 2024858.5 62816.8203 1349862.625 881939.6875 355214.0313 2042230 2175490.75 6171831 10589684 1395203.75 1472864.125 8206908 486479.5625 1778261.625 650836.0625 400320.7188 44483.375 361343.625 729663 2724213 287903.25 6704213 240652.8906 53952.8906 1278816 820782.8125 8331597 32809.6992 464644.625 3608997.5 251401.5313 116254.5391 325378.8438 81312.0859 48573.4609 1848248.375 5326405.5 137350.7188 5128214.5 574679.875 1171646.625 18037422 10481635 2426701.25 5676646 30818670 7227575.5 11963492 4292256 13723726 275003.6875 6508142 7056041 8118786 1243182.75 3327341.25 10435981 1947374.25 1813255 1478850.375 21958244 5646059 1250655.25 30940.0684 1584361.5 12376946 8554807 2511552.5 5263400 10846919
caffeine 149627056 125345024 2929772.75 118930568 5284631 27617040 255900768 14984927 2004297.75 149077728 92190720 28951944 114237760 3685949.75 7311735 53715412 11838155 51084004 39888668 60629412 107362296 3221537.25 174027056 163327968 215587936 64859276 75247728 39368516 2475758.75 133286168 39800332 400731968 38427232 1657856.375 80444304 38817416 152167520 150595296 135902304 435796320 53295132 6679309.5 162745376 38701468 16434020 9053417 15468074 1276860.25 2331295 13916325 2530297 3665601.5 13886094 6494703.5 1344435.625 1208010.25 5959129.5 33893524 15394392 957770 40585604 41448164 12482826 54019872 3812305 2113765.5 35371540 989158.3125 3858885.5 2382030.75 1042126.563 40864412 3682310 12369203 2808900.75 2921601 121844616 2456621.25 3451386.5 33738740 68746432 45040628 5076387.5 5923828.5 6029868.5 2464768.5 1994387.25 34134596 12479046 1815976.625 77070784 4706414 5910664 1904542.375 2571736.25 287540992 1229143.625 2165758 33877264 2797504.25 21341362 42513276 1966222.75 8584438 1900782.25 3115429.5 2279303.25 11666993 809454.0625 183654256 55460344 3609254.5 51079840 124188464 6684695 7933432.5 30906316 1063635.5 34185820 2611129.75 1487751.5 11175404 1504937.875 4315788 714756.4375 3889310.75 1513370.75 36796988 3224308.25 2049588.625 321728.0625 949920.8125 908499.0625 2876848.5 3857835 2457334 43851312 10313323 1265299.375 1508799.25 3387978.75 4856915 19655038 53238376 2563490.25 684520.0625 10487511 2081154.875 32277454 7607902 3228270.75 41868756 1672680.125 38160028 5440209 685429760 3375442 10886005 3586487.25 18168162 2161001.25 1362764.625 8717846 59980944 14433206 3908941 1340671.5 4540093.5 3143501.75 2224506.75 8637888 196102352 206408032 2253930.5 721705.625 6423212 7841374 23072244 6903219 57671264 3526679.5 630537664 28325466 4351542 1284591 836571.9375 21137200 2351588.75 5239645.5 2770653 68258128 6903219 55523592 3566950.25 142963888 445873088 1172154 1078926.75 62558304 1008252.938 944136.375 16265743 2125888.5 1183637 3951211 873841.4375 14141338 1409451.25
thiamin (Vitamin B1) 72056744 4956054.5 40376312 996178.75 750924.1875 135636208 119581.8281 224410.2031 171638.1563 2014529.5 2718443.75 213775.7344 178268.1875 21810.418 1106252.75 382328 20160.6055 37592528 162146.4531 24277.8691 316054.2188 677231.5 249338.5156 38148628 1164576.125 515317.5 43979.668 55328.0469 125264.3281 448601.7813 224252.5 147240.8906 3999072.25
adenine 286252.0313 263431.5 346191.7188 309505.875 266008 296808.125 210276.7188 285957.375 295749.6563 379381.2188 303507.0313 254543.1563 304768.5938 253803.2656 198523.5781 283073.4063 292801.2188 230698.375 335864.2188 305472.6563 273373.5313 244429.9063 435832.0313 286511.0625 365247.3438 419971.25 853693.5625 306579.7813 259008.9219 257673.6875 407900.125 281414.875 402479.875 288664.4375 696640.4375 222867.9844 357049.7813 417831.6563 387524.5938 260158.7031 225428.625 287554.3125 230983.7969 246962.625 295603.875 437411.625 347022.9063 276911.625 240784.1875 242945.8906 403501.5313 290200 303606.5938 589307.5 524221.9375 304905.5938 334605.0313 235258.8281 506004.0625 494683.375 530775.125 469290.3125 1859669 410409.0938 334838.4063 792796.125 362174 143597.5156 357025.7813 525484.375 126044.6563 635706.8125 282899 378910.5 372102.5 140020.6875 730189.9375 511932 716543.625 496506.4688 878690.375 169988.5313 298070.5 819616.4375 498672.7813 347553.625 703995.625 278333.7813 1165836 104282.5781 406507.3438 378256.625 156122.4219 244492.8281 183031.9219 261688.0781 444337.6875 698992.375 306410.875 485996.5938 345925.7188 443943.4688 613148.3125 503514.375 341018.8125 527966.0625 498621.8125 321786.25 403160.6875 648265.1875 741720.0625 401723.0625 1319846.25 375285.0625 342169.6875 600502.3125 471429.5938 192824.2031 163114.4063 301481.6875 706369.6875 388347.3438 385065.5313 188587.4063 536546.8125 328512.3125 629778.75 403781.8125 411780.5938 264590.0313 725098.5625 513554.8125 282935.0938 317754.5938 535336.8125 447700.9063 410113.25 407309.5313 687668.375 379047.8125 230461.125 584272.8125 479451.1875 277156.375 167085.7656 668535 356254.625 370733.0625 298132.875 476882.9688 303407.1563 663211.375 258870.7813 589683.8125 253455.4063 683378.8125 342047.375 303626.6563 100913.5625 341338.375 386758.125 352751.0625 519254.2188 299229.125 469117.5 282677.7188 313304.2188 437069.5938 310405.0625 1327971.625 415597.8438 409152.625 261466.0156 307168.0938 384542.75 501332 266660.6563 528367.625 681734.5 308463.125 211756.3594 335396.4688 358135.6563 354733.25 272233.7188 77304.5234 855453.9375 302934.9063 269728.9375 528970.8125 449803.4063 561602.1875 419506.0313 1330782.25 383430.4063 162816.75 288782.75 378910.5 465284.125 312965.2188 331354 1467492 520440.25 310472.875 442911.5 255638.6563 548797.1875 367331.7813 336267.2188 492944.75 605519.9375 420219.7188 556296.4375 409234.375 3148409 444668.4688 554882 531143.25 563769.6875 1489024.75 521261.7188 624681.4375 470297.75 618084.5 408702.2188 344409.3125 413478.9375 1554637.375 515316.125 369154.8438 331560.8125 325233.9688 552504.125 139461.8281 156277.5156 476779.5938 327473.5625 389037.9375 1587613.375 366517.4375 294990.1563 2587178.25 1266335.375 848460.5 435900.9688 386270.4375 1140744 378773.1875 634014.3125 378552.5625 1730489.25 594474.0625 355841.625 335185.625 407666.4375 550036.6875 233043.9219 1034551.5 320179.0313 413163.2188 376690 531434.5625 625144.375 436055.4375 408764.4688 200215.2188 924108.4375 1705712.125 264647.6563 644469.3125 646312.25 140859.125 772739.5625 112491.7188 319459.8438 351521.5313 222424.4375 608650.5625
cytosine 488141.3125 75106.8594 145739.3906 180996.5469 330038.5625 270410.8125 65828.375 1088501.875 128604.3359 80335.8125 99639.6641 173238.0938 142242.0781 112969.2344 113302.8984 183931.5625 96176.3516 88833.4297 398027.2813 471378.5313 667695 59105.918 641197.75 48011.6133 112896.0547 219755.9063 252036.0156 270261.6563 101567.6953 172071.75 357015.8438 600655.1875 250605.1875 307705.3438 181295.125 181330.6563 114704.8906 205193.625 97041.0703 193894.0469 564952.6875 837041.875 365587.7188 663902.6875 144768.5 415782.5313 472952.625 162879.8281 159991.1563 140564.5 1388622.75 104163.4375 244811.3594 96449.7734 407040.8438 1023690.688 604501.25 133992.3906 1649454.5 107252.9219 306319.0625 809449.75 324547.7813 78174.7188 53590.9336 142900.1406 450214.0313 399127.125 667270.1875 361711.9688 453118.1563 186338.2656 278624.1875 188169.5625 145654.4219 146008.9375 546665.375 409288.4375 284320.4063 250476.6875 2744875.25 547932.8125 798961 60711.4141 1207342.625 283102.4063 298975.375 291750.625 601583.25 266036.0938 163839.8906 154637.0781 285853.5625 107500.0781 361104.125 246188.5 184978.1094 174560.375 507267.5 56454.8789 101834.7422 1293228.625 715571.25 93449.1172 1940855.375 1464617 360344.0625 108139.6094 653695.0625 528313.0625 1115723.25 2952904.75 149406.4375 614075.5625 121024.8672 63552.0156 102248.4063 875921.8125 261711.9844 336996.0625 760349 29933.041 149276.5313 64724.4688 580263.3125 157657.6563 283257.4375 444357.3125 142780.7813 526006.125 1427846.5 272329.5625 74241.5391 137359.7969 273055.375 73834.6172 984900 57863.6719 905011.9375 602186.4375 285087 221560.7656 227191.125 983254 112587.9141 374162.4375 1599469.375 362044.9688 285087 186036 351365.0938 68536.0234 156779.375 58662.4883 1245829.25 1955363.25 311903.1563 171866.6875 306852.5625 209926.9375 990176 143120.0781 716495.75 348251.4063 420166.3125 1394564.625 352130.5938 1048494.938 3432682.75 1255403.25 171176.3125 202411.7344 143418.5469 111830.5234 517104.6875 225645.0313 119836.3047 2874090.5 502038.2188 533051.625 288383.1875 1914195.25 293279.1563 123532.3125 228968.0469 1097451.375 469205.4375 114685.875 125073.0625 72303.1563 338559.375 672836.6875 521170.9375 1963372.75 801431.375 223786.4844 264299.5313 417240.5313 329838.75 418391.5 258862.3438 164988.3906 464091.2188 931975.5 62234.5313 294444.0938 769751.25 1181770.375 153746.25 675079.75 2495722.5 38109.0898 115550.1875 447101.8125 715920.3125 299859.75 1431582 100817.5313 194848.75 757353.5 144155.6719 126738.8828 766130.5 125339.5313 219645.1875 100907.125 657679.6875 1221440.75 690177.1875 438598.3438 141312.9219 1801687.25 524762.5 92226.4531 1600236 42586.1992 618807.25 89713.2266 363804.6875 950162.25
asparagine 158520320 140480864 195719552 181716752 137682080 209992224 179126688 179763408 238527728 189874880 154441056 168571344 258645344 135288528 166047536 226553984 151940144 236856896 189849680 204326720 165249024 248167952 152675856 222084864 199407216 260628368 200688752 135887424 257040992 149682656 194651536 182704208 194658752 193311408 332168256 164841808 241083712 262234160 180201696 170222944 174900752 137279968 148622976 169226368 185789936 174826896 208227168 177241424 148818464 195550960 211923008 374770752 145487824 182160304 168633520 74757792 174669456 185982608 115876472 204446400 290117728 313021152 240508080 116534600 113363728 142571088 238460256 115193072 121380392 145664560 556613248 138462848 168898000 110005960 197170464 192351856 150299088 162137808 135475856 212757184 141099376 662871424 178270304 121633200 147944288 177547808 110112896 157649408 208787920 103416128 189290512 107695416 275934464 171927488 169071216 336442208 385405248 284781696 111356600 84641072 129362448 304522112 117477128 138790528 167827536 143781264 148870080 172592032 112719352 139420144 152355024 197608432 164326544 133630448 109182856 230068256 130755160 168423024 239837216 190725968 1366821120 156781264 134089376 399115456 158762256 606116608 93663400 94082184 110530680 187139872 335458976 119489616 150716384 240569696 134362304 159944592 124104320 164994736 93658000 170637488 128091184 225741792 830091712 178392432 113383568 104198128 182118064 168442432 174487568 112457248 103017528 162299888 147305856 110520712 398829664 119834064 376942208 409914336 173633120 134186736 99565584 137487424 231565904 202409376 122220624 236975664 209001696 145173584 218724912 116089976 178609344 221378784 227423008 141563088 147837296 122286592 253853744 248938720 142500224 152037296 209004048 153824448 131396824 157949472 267048352 111308992 119454568 168423024 373280928 132684952 118564968 174731120 120597616 284314016 130695760 103689424 74805184 295755872 174129376 105120120 120024400 186391296 278142976 245655808 131700584 177456432 168853088 285584672 84235880 179301328 66631120 161910208 136027328 122292216 154950560 134971216 184397856 269052064 242193952 149640384 141025936 233494032 174305056 126889368 200257408 173090368 111436640 127473560 96293368 222538576 109033624 409282784 193466080 424094784 267215904 81103224 283778784 243001776 121377064 196473040 147197056 260758128 252120896 114327224 141520096 168403616 80484272 664537216 173685504 97656928 118146000 210283952 89810648 106518296 259212880 276124832 79517904 91795984 170269600 84593688 221536496 164758560 113977184 241354944 117638808 176937488 197844944 105813344 291612416 121386072 196216096 212074016 186551136 40964308 156735792 110510944 135519360 115459640 218100480 261554368 148753824 120146912 132578352 123635632 144002928 185933456 242594288 153958112 334743200 267028448 150929280 94156696 666909632 118783112 223730144 130391896 251152576 125504656 119148608 161705984
hydroxyproline 102585408 106139448 104948080 55721572 35583076 161294256 86385016 102538440 201089600 335765376 168887264 75885600 114494696 155035376 85267656 90794256 155549392 244198448 122114312 117775880 114642544 102495064 304626880 445124288 677925248 70411736 145566160 137897280 168917088 66387796 54136240 239169152 122725376 178231232 346321728 44545324 385400192 352621952 147389424 128041608 144361952 181295312 457871872 44533380 75885600 125088840 108373304 69071712 60475820 99907264 37061444 144044832 60456276 40784040 170980048 55531104 80048968 65994440 30964974 82563112 114664512 109109888 68686504 22852654 106284208 25937100 50416656 29018106 45774168 45947960 210157568 33711428 84395184 57935556 64307068 96984336 37550764 100989344 105962272 99504928 49121024 338944864 49374276 66358628 54703012 36225060 22450142 135095024 33225264 37398576 75160264 26461552 76406784 60794168 71843696 141413456 70848352 64008300 133197664 24050196 19162480 192023104 77095264 36711996 53927824 36582588 40713604 28656146 27072096 32339320 89523400 37200732 127439856 38098892 38500536 259718832 38312228 92379808 25644258 91329776 512865248 62365996 44093020 225184432 60038540 212586624 23436828 127544328 41562128 108244928 164987728 295529472 49791824 91448680 51485432 36764624 82295880 75504032 88901056 162238272 137505056 44880168 149168672 208174064 38145836 49416116 38772564 45251360 72994104 57068348 28210250 112448184 30350660 60545468 151449632 48276144 96069016 163506224 37357544 25593080 18345534 56860660 30393660 32505734 113771792 46751924 96704040 49681976 106416512 35002060 45819044 103172816 143209568 51682068 67522096 53003188 122246728 131263424 54850240 52921604 61598812 90976392 42340328 144094896 226119264 105053544 78384416 56469736 90713848 146020384 53465980 91562744 14672937 238795808 170953120 42061468 78434008 104647696 315350336 31204794 221769104 74663816 171582480 136110784 33189318 97298024 60276764 94885248 41180112 165169520 32062162 31898656 15030746 19948532 94195600 98901544 32918418 110699392 169468112 48938244 76578816 77237224 131056792 49895416 50271320 45922984 18182948 31831650 64159356 163729712 79699384 484195680 75105200 215589168 167399744 50518220 61860820 327847232 42873716 41218712 50788124 59180916 44934896 57969524 93128048 26098292 74560680 317433248 197117872 105686864 41329660 137382992 134207056 87065312 55585556 235925856 76267160 47737208 36116036 26115844 83623256 32945854 19009406 150573024 57121044 54671500 77609272 23289188 95900488 72950664 182333328 22229072 38341100 27339416 78759008 20795756 114883112 24122940 36479736 143484576 48925072 33302954 51339736 59859616 107001016 77528616 111932136 54934144 394375776 113580224 58259096 220453712 168983088 100065776 32631342 38417672 131027336 33847420 85365896 80908232
picolinate 173784.5938 1726616 723172.3125 567132.875 1173656.625 729083 1811746.75 721392.125 585716.25 627800.375 348328.9063 394884.5938 832394.375 568757 525563.625 371131.5625 441469.25 613457.6875 1077917.5 434301.6563 342876.125 988461.875 565249.9375 935826 390520.375 1626510.375 931152.9375 1128308.375 599061.5 855053.625 687325.875 876977.125 974197.875 819035.125 440369.4063 988863.6875 902307 885741.625 400342.0313 308299.625 353245.8438 433150.8438 711173.875 793284.125 323459.6563 5705891 34467636 352363.125 1449446.25 1369532.625 1303266.625 1315175.875 4663485.5 860375.125 4092433.25 3644768.5 4557510 16908076 1326814 4347279.5 1073514.125 6602183.5 1220685.25 2826690.5 784975.25 5817205.5 1250751.625 9547874 2007537.875 1822494.375 2375768.75 1864040.25 1447440.75 4999446.5 5427594.5 6422192 3898353.5 5130606.5 7922763.5 4524393 8397311 1088939.875 4650739 1618851.75 1630611.5 2330338.25 850835.75 2412431 10208867 2497775.75 6709791 73527848 5749594.5 6621117.5 1901364 10662212 2973357 1767342.25 1936560 2641349 1973118.375 6679968 2448808 3933129.5 1395351 1093630 4988025 2643661.75 1228954.625 1909462.375 1454295.375 2388093.75 7591341.5 9704544 5737854 9542711 2053545.75 1136146 2597028.5 16165242 8463350 7402575.5 16102126 1317464.5 16888112 7832153.5 879387.4375 9971447 7677454 2037539.125 2160487.5 7974545.5 7922428.5 1262393.25 8860521 3486638.25 2638823 17251796 7147660 2118846.5 1006644.563 2041536.375 2610008.5 4250950.5 7733512 3143464 5103971.5 1721720.75 2422926.25 3216105.25 638411.75 8640927 3722812.5 3966973.5 406531 306677.7188 2958004.5 5870700.5 5337487.5 1349205.75 8418819 4937109.5 14109488 3039774.25 1936560 1638094.75 4120676.5 1783495.875 1751366.375 1177665 1300611 1017922.938 2476732.5 3624637.75 1090881.5 5148242.5 2735914.5 1395729.75 1850570.625 4413191 724380.9375 5431236.5 1831188.25 648411.25 2611458.25 3305181.75 1406540.125 4402678.5 7489835 1168199.25 2207845.75 1076853.375 1617643.375 7537743.5 723134.5 750864.625 908065.75 16492419 4420327.5 1017637 4913994 3188364 5156568 509550.6563 10700523 7730265 1504510.375 2222489.25 18315052 663264.125 3553741 2869817 1603935.875 5815373 4402653 629086.8125 7641752 11134124 6790543.5 4842415 755551.6875 285991.4688 756736.625 656591.3125 1132947.125 2910280 2342295.75 2740213.5 1499741.75 2041931.875 1361803.125 8787824 2693316.25 1062150.625 811133.125 1047623.25 3111027.25 1700843.875 1101402.625 691265.1875 14253807 925098.3125 480318.1563 234607.2188 6837150 1066353.5 819641.5625 4765201 24664750 392940.6875 3254362.25 1694301.125 8603958 3346551.5 1383943.25 9082573 1469047.25 5103237.5 2185452 1025704.375 2468961.25 3052150.5 5537657 3544188 688196.4375 781439.25 1478890.875 759522.8125 5529572.5 1297112 16531819 863065.5 1019909.563 2447271.75 520120.2188 2737329 1959085.125 3973625 1101686.375 2195802.5 2531085.75 1140810.125 441271.1563 3281546.25 359504.375 672675.6875 3428911.75 1297108.375 881845.625 1071648.625
sarcosine 7306461 24215906 6985474.5 5530517.5 4495425.5 12527815 6781155 4494624.5 11048020 5876241 5184394 27394654 7953736 4005853.25 6182241 5302693.5 5607429.5 9956240 6231986 5651383.5 5343770 6463507 15185304 7865619.5 8221556.5 9712948 7692480.5 6244663.5 8529782 4724678 8387028 8498530 9098486 10165864 9084400 13000436 14089029 9887789 9404306 9071226 8501857 8610066 8766634 38837800 16464462 9308307 8293110.5 7409357 14186974 5338355 37908736 42638960 37154328 46298004 51967160 39277060 45605516 48394776 30561214 27709924 44715644 48392788 52186300 37236272 33845756 42708080 47270836 35139412 31971286 35998132 38770160 38508732 42093436 31492580 27211958 47736772 45461560 40838244 33860856 35989672 33850476 54317272 50866360 44730584 32456784 32187818 32734968 33451168 32891548 41338948 30521414 34017448 50157736 30508178 37503172 46695880 40860816 32433208 29834204 25864632 38737532 41770324 26303106 36357232 33949228 27094588 33500824 37076912 41869112 35045316 38908712 35615432 43559504 38258388 30957272 37278988 27796508 60677320 51853072 43761928 78913536 37710628 33048894 50758956 56738784 63648524 42278128 34036936 35676816 46417952 47961192 35680124 50293188 51149204 47928128 44638044 48915240 52748064 49492192 62447936 45918764 46755300 70237456 55862412 50135596 61032936 33430042 45159360 31864824 28958006 36078772 41608020 34981080 28176608 40727120 27568334 33760408 35958488 31475046 37188580 37356264 46032204 39825740 43433212 44417348 57153320 41301276 43667872 47594856 36359516 20360966 37977004 51054060 39978104 42124596 54820572 58332388 39342052 42914872 39716360 49947580 38077372 33950972 36080172 51086676 24607880 25114098 35989672 27430540 20937832 18262084 22331628 21767020 29535724 24261622 16215808 23348444 26213058 44554144 18239608 19380428 23421754 110610480 37214400 23162648 35778796 26560456 45293568 26819084 39274200 53253960 49486768 37745456 48433640 29922662 36784356 35364264 29196924 51088100 51665808 19632374 59453452 41887188 27023664 33904916 37262644 37902408 29088164 34526384 37906132 42063800 60914216 32458278 69659376 46757552 46535588 43807952 51152124 38015704 62576900 22300490 33078426 21505784 42670740 38222436 27846814 17591028 71853096 31755406 31201976 26832440 44711600 27472774 32861642 35941748 51542488 36486704 19765632 36020852 54244720 75319240 24362442 40566764 45028956 31671038 33017052 39152500 31783052 42141484 34793456 31833006 28243736 33884324 29056336 37656592 27968096 49736044 43645432 47776056 39108316 58592524 31520200 29787500 35825636 43521196 65492996 40009728 38927752 41891024 36012196 45134720 33348936 34257776 41774448 43586676 40908504 50432264 41608056 29566346 35532708
pipecolate 50357676 93310120 46162692 39016852 64573656 63193756 66941780 45638480 46348032 162963264 23037620 43963544 43082996 21292064 53529400 60037684 54694344 35006084 50432476 76012584 30960298 272866592 167853040 70277728 94955240 41567808 54290248 43739340 45987008 57260080 78315056 41440920 52535528 44707524 60325676 51195432 71604352 90570272 112132504 78079080 54839512 64615836 51116280 42622272 69971768 62115004 85763424 147122864 94279752 77116408 96507144 422517056 48190516 73409480 191644768 21843388 47515440 109558800 35097132 101966952 310617408 230455952 299957632 58835260 126262472 78147256 183966448 85903000 267928384 71249600 302573248 39309992 19495134 294526496 57086044 111885456 38963152 296022976 451063968 372364480 193873536 292287328 144953712 338897600 211233360 260508832 115873608 604019840 132060816 68233792 142007312 23255176 135691744 198434656 99956528 255035040 364047008 39613080 62037200 33098330 102073280 256072176 59729608 112518232 159141168 75348144 98470040 56142084 33987224 153226352 59820580 18106376 157057712 287442432 76013512 123473744 25949588 659042688 165898368 211807248 350147616 209485120 70946504 190791056 17730556 540867200 122978528 128146712 26437588 297011360 173736656 68234776 66954976 324208736 113386304 133459744 247635088 177591264 300496128 197667008 233823280 262987840 559473280 253224000 129680584 89528520 77174920 59818712 48179492 93787760 30286426 284642112 11319600 108643792 76022176 62348728 106948280 213645680 41507968 25185806 44704724 72909840 94771744 82517128 119993288 98660456 140274320 149810304 137922352 272197280 297541216 138975552 253502976 115290376 44310692 75741080 407716064 142141760 62233008 136739040 61010380 129105648 36428440 130174376 635247808 49966924 101698224 173781504 92165768 117607368 113840920 35214764 49310428 262972016 273909824 90913920 223773376 249747040 171273296 90593536 72314840 49384956 280771968 766495744 42482808 131891744 93124832 454899008 192250720 728961024 540089344 23571726 274030432 75283768 56097348 107806176 144290240 286361152 347000480 104137360 55545512 221006240 224353120 210995296 84173424 38781052 29372052 19651398 118489160 33714492 118517088 2159273728 199563488 179519424 177512368 52781572 89341120 428785568 44164796 49618636 60714964 40020760 130691264 51652820 45756612 36042196 55655760 442474720 459570912 46522500 23582416 152185696 16961284 27146094 149994832 177594512 265445392 64322024 21232328 82441832 253410928 72011800 31043534 394774464 94279752 262014816 76546808 8524291 370477408 57834940 423488928 26775498 127799640 348358304 96679576 38219628 54433840 143131040 35594932 560549504 40116936 7253838.5 16319094 38141080 21155916 203276864 255699312 38519696 469826144 143140688 57944848 80747776 281328256 103108648 104405480 127008584 255869856 37713140 30222220 53587024
phosphoethanolamine (PE) 1002192.688 2490734.25 2759998.25 2183393.5 2139085.75 3440327 2712885.75 1598699.5 1897016.75 715074.75 1790211.75 2020784.25 1572880.125 1552079.25 1968246.625 2216838.25 1732877.875 1792734.5 3185274.5 1659154.25 1301302.875 1219784.375 2178992.75 1172260.5 1804738.375 2197108.25 1684952.125 1849376.125 2347942.75 1482351 1351427.5 3066346.5 1916590.5 3879912.25 3074533.75 3073243.25 3380277 3883155.25 2135034.75 2603652.5 2006556.125 1472995.875 2716501 1762603.375 3044520.5 1457137 1974894 1719044.5 1828158.375 1249888.375 6806258 5919705.5 1673729 2336924.75 1766211.125 2022944.625 3176082.25 1986443.375 2081167.375 2608689.5 3198810 1247535.75 4605492.5 2398226 7487627 1240536.5 2221654.5 3604757.75 1937194.25 2603783.75 8349853 1403896.125 1689716.5 1824697.625 10064478 2583371.5 4557206 1377091.75 2361991.25 5192501.5 1922633.125 6670991.5 3144287 2861732.25 10417467 1297061.125 1754966.625 1759796.375 2323665 1274591 3165258.25 1607933.25 18773148 2053081.75 3965028.5 8878055 4165872.25 4024127.75 2145527.75 1635895.75 1700063 4515428 1987168.25 1814543.125 1738977.25 2375023.5 988856.6875 2824903 2386759.25 1035889.313 4074945.25 2713308.25 1619611.125 3819072.75 3407603.5 3631401.5 3979630.5 16434267 2886994.5 1749406.375 15376935 1677962.5 2086916.125 4469305 3024165.75 5093458.5 2692126.75 1534713.5 3886318.25 954836.5625 6769903 831929.0625 1710153.5 4944769 1175188.625 1927736 1234118.5 2535825 2866813.5 4134774.5 2284409.25 4445153 5620830 3153194.75 1762947.125 1168361 2823957.75 2448962 2235999.75 3961484.75 1294560.75 4180155 1442973.25 4314470 7896639.5 2522946.5 4272104.5 9540289 2314279 1150789.25 2221544.25 2221765 4615605.5 1790888.375 403662.9063 1802066.625 2269431.25 1969728 4777221.5 585061.5 924939 2657332.5 4918499 1666963.125 1901682.25 1608819.5 2467851.25 2462724 1756273.125 2864406.25 4643855 1661584.875 3441187.5 2616482.25 2123488.5 2200943 1826011.875 1697233.25 18090126 2167485.25 1801106.375 2448467.25 2284112.5 5121230 1471823.375 1998140 1841948.125 4267826 7880645 2028943.5 3676748.5 8033983 5547039.5 1672223.25 1577302.75 1998284.375 2221654.5 4580880 2019536.75 3060458 889000.8125 1579787.5 3535099.5 2358020.5 3054022.5 1889657.25 1144747.875 10003342 2915351.75 7112310.5 842658.5 1928350.875 2255627 7220170.5 2064435.25 1549926.125 1860124.125 1573274.375 1816645.5 1991083.875 2651987.25 3559682.25 893174.375 7127914 4508428.5 1827362 1924032 2223797.75 3590219.25 1702200.625 6832278.5 2407220.75 3256281.5 1798130.25 1634026.875 2139466.5 2502584.75 3388099.25 1196050.125 1711371.875 1399339.875 3768711.5 362133.125 1251047.125 5874103.5 8860674 2706667.5 1778881.125 1729993.5 1147924.875 19377084 1918296.25 4142393 7727434.5 2192154.25 1083800 2814452.5 2005581.5 13825829 1610829.5 2858370 3830110.5 2554339 1220765.5 1946860.5 3150383 1688532.5 1731055.625 3571404.5 1296008.125 2207248.25 3799539.25 2439310.5 2494358.25 5049557 4817559 4785077 1257373.875 3862035 4006268.75 802003.875 1312898.125 4088471.5 1422847.875 1269710.625 3173503.25 1476441.375 2964894.25 1680001.5 2345674.5
3-ureidopropionate 915946.5 536361.625 232643.9063 735044.8125 411222.0313 1889330.75 342719.25 590179.125 328814.9375 1360929 1086743.5 491018.9063 1038979.75 327734.7813 371215.7188 761265.0625 313189.9375 1010037.813 806927.6875 737103.125 336914.4688 1038984.938 888243.0625 925205.0625 397233.5 950628.625 875336.5 297029.9063 1676342.625 564539.6875 1312145.5 649716.5625 1012953 653940.25 812851.5 319111.375 676738.125 779787.3125 718168.25 1463069.125 1400537.875 1349233.375 1169116.5 571757.6875 2237325.5 900974.4375 3590361.5 871699.75 1289153.625 245479.6406 5287525 14536578 1875692.25 1241045.25 14132875 1818304.125 724641.75 13135449 1306895 4848435.5 17919046 9261372 209652800 2651563 3444385.75 11778627 7353866 1418001.75 7102783.5 1086320.125 5160261.5 6091862 23157582 12492835 7871969.5 8111676.5 6506421.5 7485920.5 56203860 3285865.75 8019584 44900748 43461336 8769794 25385122 228005760 6048989.5 8490288 16675252 3149821.25 57220380 1768613.625 56474980 22311332 3175068.5 41653168 125484840 4228384 5543578.5 22302874 3165600.75 103239144 1084740.625 4583488.5 16945956 3223379 8041093 2355562 1311531 6200413 1140066.875 2986644.5 10603623 2279654 16451334 2268392.5 1626935.125 49170996 13901558 29793444 35326096 3774621.75 1610128.75 4866524 3639330.75 36021708 17123710 6985176 1776071.125 12146532 91307632 816941.4375 2717765.75 53064600 9434409 5831022.5 26973018 34373516 4217150.5 8744959 23380320 8790418 52604432 32771506 6981551 1419928.25 4550301 4720773.5 28538234 85929376 1114850.5 24509130 684427.8125 11400564 2777926.25 1370217.125 3092798.25 7565017.5 2702152 912549.5625 597264.6875 40220884 3219758 5855436.5 6184763 21032124 23008284 37278092 85115648 3603593.75 3960186.25 12711817 3290561 723709.8125 1106331.625 5019146.5 16392933 3227000.25 10205098 2983317 33480688 2551892.25 2721228.25 1895026.25 26166340 761074.6875 3542247.25 51761740 7676958 3049085 11481590 2306521 4456587 113479496 4810591.5 4144256.75 790552.4375 5057355 17906210 1934436.5 1298733.5 12411222 237963120 15328197 1796519.875 69803008 103871624 45579984 2185814.5 338560032 77462696 3035375 3746048.75 15481428 4541128.5 26936400 3290489.5 7783076 99929352 26203130 2127190.75 57708036 9440678 7402556.5 11020613 516037.0938 408608.125 990781.5625 926961.3125 1786926.375 3871432.5 15092642 4212928 16287586 8926701 2240452.75 13926480 2330550.75 819360.625 1330958.5 1432042.625 3223379 6007188.5 1060474.625 1834027 400080.1875 4456677 7246833.5 3378509.5 896383.6875 1177292.25 2894071.5 655107.4375 1075533.875 5450580.5 232204160 857107.125 944339.4375 785671.4375 791018.875 30895870 3196627.25 392581.3125 15638111 1762317.5 12334579 1464494 486328.2188 9208135 1171350.875 4726989 854040.625 17345188 810844.625 12000751 2240070.5 1842192.375 1830585.75 877999.25 9052455 403587.1875 1676350.875 1336599.375 3175296.75 2565957.5 1069270.75 1327740.375 518939.8438 18937068 2298378.25 987428.9375 621850.25 4425319.5 850687.3125 2394782 2106799.75 4249078 4455256.5 845800.75 868737
gamma-glutamyltyrosine 809971 787640.9375 784165.3125 858666 299132.9375 1349276.375 832361.1875 831859 599654.75 1228153.375 1032932.063 602352.125 1008618.125 322633.5625 767931.8125 967849.125 487452.875 906131.25 720652.9375 1001732.25 577178 1239471.75 659046.625 909314.875 850289.25 761965 1507009.125 376696.1875 1052790.125 307498.9063 585705.9375 618312.0625 953766.875 1180312.625 1150821.5 803472.875 687390.875 1003530.813 779233.3125 963417.5 557885.375 620776.0625 465413.6563 834907.6875 1078640.625 1076444.25 2735963.75 833665.625 563218.6875 805585.625 1581844.75 5378947.5 870918.5625 722164.25 2814332.5 1085770.25 1111747.5 1545803.25 539955.75 2038448 3063954 1023887.75 1562623.875 407489.5313 815396.25 403009.4688 1069676.25 392511.5625 1130909.25 512630.9063 2446525.75 392534.9375 799004.4375 1481030.75 1046713.063 567061.4375 1217543.125 461164.4375 880854.1875 543199.8125 2731303.5 446842.2813 630675.1875 459256.2188 642773.25 134214.5625 1027840.625 578677.625 733651.75 1875895 788997.8125 1842234.875 765448.875 537336.3125 1247545.875 2330021.5 3338188 1879392.375 284051.2813 431153.125 860217.875 799157.3125 793427.1875 861212.875 1100243.625 904300.25 464666.5938 1480265.75 885715.625 1536112.375 1054316.25 451138.3125 564542.625 1951586.375 1275271.625 437206.8438 1098933.625 1071857.5 10039339 719480.875 223086.5938 2149264.25 1420959 3331201 369364.9688 1118420.5 476763.1563 1332550.875 1133014 1167896.875 536658.4375 2388117.5 627714.9375 645906.9375 674914.0625 497606.0625 333773.75 1405585 686869.3125 625646.6875 10174412 1172458.5 644832.9375 681374 637120.1875 1947249 1167757.125 941977.875 1048751.5 593098.6875 237735.5781 2028625.75 3390875 473775.3125 2870024.75 2735224.5 762201.9375 637013.125 635194.25 237438.3281 1050951.875 1512032.875 434897.2188 1739487.125 1791456 856205.9375 888925.9375 1071518.5 1159005.625 2875976.5 5502446 812785.8125 1045058 1284191 1805112 1413033.5 787884.5625 974128.5 1101820.625 975407.4375 1526017.75 570950.125 2406767.25 973068.0625 360204.625 1109451.5 1426932.875 1092735.5 710390.25 1225462.75 1282546.5 123621.6328 629619.25 243528.125 1372112.125 2305838.5 525359.1875 930637.75 2269768 2276787 917611.9375 1089983.375 509281.375 1459140.625 686780.4375 927495.5 487122.3125 938240 151192.4688 878630 567201.0625 921099.3125 738121.75 3133773.25 1101772.75 1303690.25 1229253.125 696392.9375 1431682.25 794601.875 820413.1875 790989.4375 1246267.875 757876.0625 727638.5625 1958211.75 809014.9375 1445585 1720793.25 3938802 2296107 587440.5 2258894.75 1312732.375 267676.625 2569932.25 559588.3125 1074551.125 1019387.938 724233.1875 1192240.125 1015627.188 1177765.875 3592554 1147697.25 364041.9063 403032.8438 1528385.375 1264869.25 926279.0625 1492694 1552846 865234.1875 1436850.625 1123791.5 695416.8125 1009086.375 1104733.125 697960.0625 1761047.125 963417.5 1081076.5 1403547.875 548313.8125 1139441.25 437947.25 361030.375 941336.6875 3779013.25 372554.1563 911499.5 315796.5625 1173857.5 658917.625 1268739.125 2151465.75 2126856.25 370001.3125 345529.8125 1195277.125 1698998.625 1635158 2342384.75 870312.625 3304635.5 1761201.625 684212.0625 1201524.125 4382917 1203470.25 1881549.25 355774.25 2658442.25 1037043.438 1021802.5 1048944
methyl indole-3-acetate 143288.0781 137652.5625 261781.9219 407730.0625 243091.6094 128648.0234 166286.7969 782318.9375 215235.2969 5877393.5 295249.3438 356687.4688 274529.7188 268832.8125 163186.8906 703135 305046.9375 760406.8125 419874.9063 808735.5 1094469.875 584306 312457.6875 555693.625 339500.4688 851937.625 187934.2031 187313.2344 542590.125 369376.2813 334001 391139.875 1704164.375 252128.1094 510279.9063 297035.7813 630300.875 128157.6094 290164 409388.5938 132060.1094 434990.9688 1064412 493790.5313 314859.8438 161010.0781 1030509.125 957565.75 125115.8359 186812.1406 1165742.625 1299918.5 1535222.375 294369.6875 166995.7656 1475943.25 135988.2344 473404.2813 634544.1875 369163.6563 1715950.75 2121366.5 141432 707157.4375 95637.2344 110079.6563 242141.2813 357098.75 19966.0879 1782131.25 1932075.875 714178.125 331630 404538.4688 202007.2656 1723099.25 86946.3906 283459.4375 188909.5938 321932.4688 111796.9766 72928.6641 1968635.625 136418.8281 52186.332 77441.4453 71557.8359 495583.0313 149934.4688 2276246.75 2089426.25 867287.3125 43713.2969 94178.1094 171867.6563 137488.5625 190457.0156 2395324.25 1884653 210412.1875 116059.1406 175261.0625 84634.4844 659667.25 176916.1563 264734.6563 108258.0703 403443.5 612885.1875 376831 542857.9375 168682.7969 4706117.5 339995.375 1312662.875 1825032.25 137391.0156 624166.3125 267897.625 4183574.75 489060.2813 97695.1563 23493306 4007483.75 4592514 219545.0156 50276.0742 235446.0469 200442.5156 717201.625 659503.125 230471.9375 120540.9609 831359 255298.4219 344095.3438 114946.9766 137579.7031 202928.5 291190.4063 218801.5781 149059.8906 59019.9727 1599397.5 451652.0625 1321097.875 46519.1719 228901.2813 139858.3281 101194.5938 176798.8594 127458.5234 1117541 334055.5625 329204.4375 94190.0156 161176.0781 123238.5781 55988.2422 486188.2813 572190.875 773008.375 71570.1953 937625.4375 34032.3398 376414.1563 112314.8828 2255947.25 166842.0625 577716.125 1067941.625 273582.2813 823280.125 105100.8281 540519.875 329258.9688 254055.4375 240672.6094 6198254 612110.5 529492 82860.2266 3241496.25 14681.6709 136500 60040.5781 85992.3672 119546.875 1026750.438 121673.9922 868700.25 356277.0938 63147.6641 84421.5625 627215.4375 163319.3594 508645.875 289877.5938 475277.0938 715432.25 104853.7344 603691.0625 160121.0938 112435.2188 155308.4375 153136.9844 387547.8125 1203846.375 338140.1563 1075406.125 678635.6875 85658.8359 1125121.5 2341153.75 806254.25 1041009.563 10072964 1750737.125 436224.8125 650990.5625 444598.0938 509827.9063 581750.25 108554.7656 160941.875 662024.5625 1539214.625 6679874.5 267153.3438 622609.875 14422579 9634921 268211.75 536406.3125 982687.875 21258328 72953.9141 287720.3438 357205.75 144417.7969 614740.4375 1563795.25 331854.5625 190866.5938 553393.125 844374.4375 226818.3438 164545.1406 127237.2031 105729.2969 1242591.625 96786.2578 263289.25 224480.0469 223814.4531 85284.5703 528876.4375 567266.1875 38459.5938 302213.625 14167320 327235.7813 1262574 226344.8438 638804.6875 267924.5625 100092 4067601.5 166216.1719 29837070 146548.125 1595808.25 282266.0313 28206334 526521.5
4-acetamidobutanoate 2796227.75 2287856.75 3204095.25 3527858.5 2368340.75 7318391 3190813 3113553 2975251.25 6851677 2932040 3970136.5 2872305.25 2606885.75 2623772.5 4013764.75 3266261.75 2993486.5 2596245 4900233.5 3029010 3645526 5950817 5675838 6430909 3219562 7171834 3333935.25 5937873 5432234 10160021 3272050.5 7309922 5728932 5877800.5 2947216 4645936.5 8563091 5292702.5 5905476.5 4003379.75 7800936 4526128 4687591.5 9426745 6135428 5921928 4221051 7171510 10548745 83032368 61709048 4782566.5 13765477 81744352 21490818 3262998.5 4672437.5 1294494.125 57734488 15495310 3397468 238130304 6219921 108451392 1682522.625 59212148 2503276.5 20744308 9885288 30232600 3191754.5 3971048 4461031 56070432 32328274 2104659.25 19002792 34013892 67742368 69807384 36392084 89598176 61394448 14863602 10674920 1830817.25 69530800 7425868 3117859 12232353 1300909.625 13384131 22616356 25802758 21943426 212280560 23544996 50340852 1142780.375 7446821 9587262 26448076 5710800 2820005.5 12070062 6894728.5 2642208.5 2294723.25 4849889.5 3824214.5 33416406 9471687 11477068 7297633.5 15701335 7249887 298757056 6494403.5 13674243 28826970 90492392 2931128.5 34950696 27313718 19330838 6259280.5 15817882 22862926 166811264 6222042.5 68615584 5946493.5 141541168 3707282.25 5318243 25347508 6367513 6722414 255721696 10758063 10591778 31103200 88655064 4818699.5 3147845.25 2990263.5 7101117 39009784 12060783 6583785 98687272 2120952.5 72357104 119280056 10790492 8339114.5 46890500 19100428 4135226 3736649.5 3645076.25 20356238 5435422 172659712 16462747 29460312 13579176 19168080 14754023 7636489 6323753.5 179011328 7407537.5 5672668.5 5236437 39542360 7402355.5 3236611.25 16068689 8616006 118445584 5346941 165558608 79555688 6535413 36290164 8998605 26454164 51515788 17162880 38735392 4179305.25 53696144 23401310 169383424 10567349 107091240 191785808 3340414.5 199063424 4117511.75 44971144 33079042 3145810.25 15006969 9856438 3738309.5 60015796 63753732 65457876 5522441.5 3927432.5 52232960 27852322 12085726 7013791 238535824 41416532 35823696 20368744 9454780 320907104 53871680 6080001 3579267 4227121.5 36646804 29281540 9199023 13344127 103334408 7522999.5 68363136 116410328 47987236 13275625 130504456 195280800 4130229 14591750 38639888 44368548 26860748 24184686 9888870 67944056 57705124 40693056 65640340 1277149.375 37778732 114801944 100337640 5916372 64033644 92519072 167795360 2134310.25 15727377 101366512 3774782 1735793.125 155463408 20361306 8236909 8333014.5 12161674 67083732 7168640 179882624 2285062 177015296 7278735.5 10674920 3658575 31305874 6701894.5 2140229.25 13635738 7045298.5 1388192.875 11120814 71819240 36864944 53575488 90517272 3757778.5 52463384 18114176 3672665 41656196 13214190 80198232 6986395.5 36227312 13086360 3390362.75 122096952 64889072
3-aminoisobutyrate 8711691 3848135.25 5003113.5 23774588 11257098 24418016 15538584 17346646 5930360 28606194 27400300 4618516.5 10223822 10507240 17116750 2310024 19632166 31043444 2584758.25 9848009 9926265 24979114 6482168.5 8063817.5 3296074.75 9109744 11992027 4301030 34969580 11269787 5530060 4838705.5 6273836.5 11479256 25530878 7851597.5 3461369.25 14627161 5018475 23154932 10640835 13713349 8818120 5210764 17390392 6608148.5 25266508 18610458 19859276 22446750 398789568 54959524 9657339 127651904 93399952 93511456 4816829 4848540.5 5589139 40172272 28889840 7002834 171488432 2897000.25 19597852 20176572 24448270 14424452 191209456 10670235 239399616 8682779 18103798 15571080 542914240 18492946 3691719.75 3486720.5 4174754.25 6379691 8511625 57090304 51534228 21818124 11963476 44574184 1101890.75 6519712.5 10328631 22049562 10162374 5197294.5 29850050 19529550 13161912 4848119.5 147125152 65136668 76935632 5207843 142090608 24060830 90799032 37000080 2212725.25 9646502 6849986.5 18691966 23421918 8167674 48862864 5400038 17253312 26772630 10349105 93251928 105855336 39639388 4907927 21567836 32729160 290672288 4360524 16357165 11041773 14552915 2864189 10163702 48422164 119668752 13240939 14501558 28154464 31038282 12892306 16047664 55744060 5386155 3637609.5 18359098 5371882.5 17667866 19495358 22207658 6184403.5 23007146 26148258 24179990 23178268 24416680 4870228.5 73996512 1481490.5 106312704 222978784 19862510 33280708 24022412 36331168 7092082 2235707.5 13864175 5503276 7205885.5 37781612 18638888 315434720 16825764 33423824 9321340 28562350 28718564 34846732 37793164 1953918.75 7783188 41258800 39475728 4763447 5887532.5 2616095 11806779 5946441.5 231743968 20900272 20087298 130139520 64646144 118368872 76801560 6015746.5 103004032 7893418.5 15403324 6243267 218343424 2981017.75 117152144 49006412 5483715 6811085 28357304 25356330 7475638 9344190 14317559 14862218 8061014 15835536 11551911 11559787 21273320 26373402 84491856 122119768 45210884 31218104 334126912 5313463.5 20188894 5408177 9995017 18667318 6619849.5 31988240 25987284 19277342 9400416 15525397 20425578 16104615 176162000 15008995 53789608 58615668 16439764 36066244 40509448 41062124 4466533 3903677.75 123612880 79073456 11265166 11926074 29685762 27722848 32014044 3830097 29503486 7909398 35713356 944804096 10688020 25377134 135443792 12646477 80419336 7602261 2786247.75 24260886 7170955 17826358 354769408 8987986 59519684 4288152.5 44950064 52662728 23581044 119333936 4603455 116577936 5827589.5 23523916 43222288 85509440 4999602.5 18638888 8165642.5 7699146 14269876 45199516 27966338 124379056 18965502 286386208 40102624 43646200 53289980 39208276 27176444 60018928 575151616 11027927 9128517 20285174 24837302 271511552 116431752
2-aminobutyrate 72555904 66442588 112070840 70919936 39154296 73459600 78856968 70419824 87260192 78921920 61033012 84207632 66106572 59945800 85260080 72072816 72328088 95879848 66061532 54770268 89985808 71542872 73060904 84059184 58375536 110453944 79961000 64427012 81777832 54845000 33325908 60162624 58175620 53906184 73849120 35638212 86452976 95493992 48131596 56563896 61620220 60334340 46584308 45951224 78571160 46790240 66788108 42149912 81100936 47092328 89608232 104251384 68396152 121808952 49495576 67629576 39927944 172648864 121340984 60111252 333514816 192057440 73285088 63770872 52422424 139215792 57705828 48148776 108614240 56143436 173392032 145273808 87068208 246597392 57217652 234061344 67008992 99446952 45043620 108738648 78202872 427534080 73253496 75512896 70612368 93224040 150349344 90199704 168057280 84528840 171761616 131907560 60605576 120490120 72730704 176302352 47011444 148054064 52792872 71515736 53676584 186928960 137463744 195021360 132316176 46901992 99268080 92800128 72667336 128293096 81083768 51008756 105111800 119144408 59294928 115246248 88087224 44784296 130221816 237763664 180623344 36196948 50249556 213715536 39283836 224814160 81552992 44293744 47427876 96248056 196958144 17528616 104397272 84730400 194398368 76069024 99785216 254193232 70001816 48224444 148087392 214240768 385392704 76799984 58499716 45717192 203587232 72824352 98567432 53715516 71073464 133235784 116883592 26856388 101197968 73538864 170127728 141509152 69408632 57547272 68065264 107495168 77601824 231231024 36960528 153851888 69453584 170504032 77191272 104709024 279641760 65509324 51160748 122033776 68665624 90209512 222684128 175812144 231161568 95265672 50008876 41939420 53983584 104078512 404046240 70690384 53357652 139186448 66237352 90774936 147672544 162203488 85740544 129445312 66570184 42052928 60463568 124237464 44196828 57927520 18078970 73001768 148830976 240482176 64357580 131652552 168018464 158547984 28679856 170021184 36796132 100721552 106646824 87091728 92700624 106329304 120974240 40634952 163524512 66539660 21929542 162834928 127156992 55215132 245728672 91541624 59069832 34704996 15958931 51127660 79215024 187293136 192997808 114186256 57141888 20451354 235819440 273787712 53489012 88058048 87320752 96574224 73903488 67792688 31313894 82989936 31357084 144459504 68081832 19575886 67491088 58733236 11291449 22628272 155895648 96567608 31278958 17370896 117588496 57334284 78781408 123415768 88789832 66022540 60612324 121592744 131860384 80738720 50507676 67407016 205304864 174130048 73717440 102037216 53027400 86333112 48343332 95644504 129475816 117061288 100267704 63910552 33060680 30331992 25119838 52559544 52630064 58028048 110561920 111760912 98040848 12814079 78781408 24708870 97251680 84563192 148471568 114903848 17616884 43851956
gamma-glutamylglutamine 29252358 26069174 36973052 29249290 17212936 33498408 28296612 28345696 46680996 24903458 28904188 27194480 32157238 33528188 29796528 49222968 33839924 24120546 29621904 35435520 36359956 45335012 38537332 47989992 35670248 48580616 50699668 32602242 43629676 31803938 44261296 38846904 52762444 53751048 61423900 55649624 34130824 52378632 38983328 31261852 28470300 20969722 29999218 19137526 22923842 41983816 38184780 41396920 17915008 50826252 15084726 45502500 3696194.25 27400038 28022396 7199677 26131072 24053652 13278144 24971128 62596640 18054834 13224906 3359843.5 13428174 20131418 17062328 10296623 18464628 13733253 64666652 15425065 12278520 4311293 28161128 24145624 16399430 17469880 7754728 20023358 9964728 58620224 6614687 11157671 14195551 4233267.5 6617793 12527890 5285343.5 8870958 6676457 4484748 11659066 5772194 11900076 17915008 29362132 29897842 5154369 1380064.125 6992281.5 12744812 10859976 5794334 6032453 6615108.5 4410408 9898217 6551774 20996876 31397850 16856038 17409026 13297971 18190440 30520470 25367920 6317939.5 12269847 20588102 189552656 16540624 8492954 54873212 12923586 30790308 4896842 3160446 13051302 9705315 15503121 8236660 12897226 24597116 6971947.5 9800398 5120631.5 9464831 10680834 3635529 20169530 9100086 145963456 5111807 19536012 17491842 16334702 19032334 9299936 4097509 6870094.5 11954505 7819132.5 12253330 55736468 7646538 21561814 56664960 10021136 19858898 7246813.5 2185193.5 13138827 12198715 4172805 19962964 13584673 2557790.25 13337814 2664435.75 22659774 47827964 33549694 23013260 34658540 22221776 59508864 44833304 9281512 19541878 14965296 7698893 21032682 11090199 49643852 28428570 5707361.5 8231134 22704548 8535024 5101609.5 19067956 4318344 17221654 3215614 5340901 7306722.5 17341140 19306784 3085888.5 8740739 31600006 22024752 30134634 7964998 7588050 4763462 33826764 9761994 10080357 200037.375 17543124 8206724.5 2026385.875 9868204 5805675 16025559 24640398 5210205 9295598 11345267 11057593 3724954.25 6022796 4968465.5 29191244 21859378 17070898 21117864 37671796 5156384 92445320 7373186.5 39992212 28338938 2587619 36894164 46529408 11569499 40667848 3299292.25 20487448 19437084 6870530.5 14928780 28970942 10920967 67874120 18604344 12894822 14575414 44744784 15116185 12505745 16986076 20072844 6229895.5 16108427 20561720 12788263 36834964 17212876 21512240 17844824 9092439 10409269 15263530 10793046 29901512 18538846 13998894 36022792 21442618 5133402.5 20434180 9449925 23322560 7719758 32968784 31347234 18378018 23504372 18098320 15062192 22937292 25704948 31252858 32111912 62232332 20151812 11173596 22232130 164935120 18474546 17911420 21053678 68594800 17918596 19371182 22146580
N-acetylneuraminate 1564927.5 1307479.125 1359157.5 1609270.375 1401418.5 2408590.75 1208108.5 1587582.25 1612900 5228846 1694559.375 2317558.5 1466342.875 1638395.875 1491055.5 2293152.75 1612181 1977329 2046831.625 2474176.75 1462689.125 2473215 2119929 1448620.375 2911228.5 1538857.875 2507145 1413871.125 2452372.5 2957381 1732333.375 1429690.125 3449030.25 1913092.375 2764740.25 2076636.375 2356024.75 3555472 1735117.375 1635092 1830115 3345697.5 1813915.125 2082427.75 2815858.5 2154735.75 3108895 1811719.875 2848717.75 1532760 31021608 28771058 4368803.5 6632250.5 29907884 13134559 3310573.25 2246877.25 1934038.5 31229044 13417973 5077742 75642416 4080631.5 48519388 1995098.375 24354388 3011644.25 11204254 3390922.25 14649859 3033652.75 3649343.25 4554928.5 30205764 9086517 3024930.5 5943454.5 8623517 26886494 24753398 19367288 30591352 17815934 10485858 7027377 3048523 21564596 4861504.5 2098397.75 3811249.5 1756132.625 23484736 22015818 10055351 12258333 34527676 20099674 20475702 3625725.75 3670344.5 8582101 14559803 3494078.25 2421507.75 12031514 4434595.5 2628319.75 3116833.75 4013354.5 4682663.5 12736055 6941489 5887607 3643985.5 7877267.5 6540670.5 58088804 4548991.5 7345490 9021170 53723292 2769381.5 16924314 19659170 6104352.5 5589114.5 7093512 14749540 46514412 7453308 21516388 5092303 29783006 3458238.25 3054775 10664447 4749878 3545157.75 32498112 7708001.5 5119969 13357904 21103744 3572225 3162138 3707177.75 4870508 18602012 6512640.5 8028451 19479434 3399144.5 18097928 36982416 7049293.5 6091382 9208377 10926744 4064882.75 6452853 5240649 8269840.5 4654336 37795248 6697350.5 9541001 5518934.5 9233560 5236568 4753404.5 3597700.5 35435344 5683832 4370518.5 4878959 10846796 6449013 2235469.5 9021676 5515670.5 34210032 11115688 34282840 17934998 5452589.5 16807616 6784390 19681444 16158913 8530531 23186722 3222246.25 24775316 5310384.5 39876756 3928150.25 23980636 46460216 3438565.75 40917560 4782571 19998252 12771941 2354938.5 4359663.5 5887607 2497175 17408818 14366261 16473991 3246335.75 4155793.75 12528654 13934485 6997152.5 3538037.75 37004332 13247234 13570913 8108261 5001525.5 68977120 24638792 4153581.25 1839800 2772862.75 14047339 6622627 3570488.25 6119832.5 15960410 3131501 23409612 16009615 7255333 5370342.5 36234784 55192604 1882214.625 24062930 8012557.5 9734234 9076450 6660067 3378050.5 15546027 11941189 15664973 23303826 1766119.125 9684782 46666296 21045032 6967137.5 41377136 22294960 36228840 2310514.75 4050377.5 23599368 4116838.25 2077740.5 43362304 8917012 4434609.5 4633681.5 9719441 29727048 3997204.5 46331372 3155083 35950988 2764844.5 2873835.75 2253093.5 9895292 3577619.5 3197505.75 4685422.5 2080704.5 3470491.75 5530935.5 23465664 12615385 13385690 20157022 2750453.25 22163202 7863858.5 1731207.375 14624976 4189886.75 28415342 2385534.5 14135308 3890904.25 3058326 44390876 18998292
N-acetylglucosaminylasparagine 123833.6484 212284.6094 146911.0938 193707.8906 147967 286747.2813 104709.2969 193533.2813 220198.9844 209901.4531 197012.5 270245.5 177813.5625 143237.5469 117318.6797 315200.1563 150633 228809.3906 81830.2344 243905.2188 108724.6875 152776.7813 297107.9063 170994.6875 326050.375 143074.6094 281406.5 163868.4531 285338.8438 364808.5 292733.1875 119368.3672 393958.1563 303754.0313 180843.25 168151.7656 252319.0156 339536.4063 293794.5938 198202.6719 122059.1328 295387.9063 182003.4375 285188.625 256005.9063 201684.3125 275612.1563 195992.625 185125.3281 296800.8125 773368.1875 913988.125 216870.5938 552779 695950.9375 400812.9688 181201.7969 196751 136741.4375 859067.125 476046.2813 194443.25 1498355.75 139773.8906 826538.125 139066.3906 423198.5 171617.4844 552952.8125 187819.2344 450274.125 226773.8125 265955.4375 202518.2969 886990.4375 365438.5 151200.2969 378594.6875 391454.9688 990526.5 426125.1875 707442.125 640951.25 560918 294485.4063 302402.25 137267.75 975951.25 126456.2031 147929.2813 121767.75 69354.4844 341135.4688 329485.25 394600.5313 275420.875 927854.3125 1153868.875 514137.5938 113931.25 375328.5938 334871.3438 1154978.875 179529.4063 136387.2813 946763.8125 333451.4688 169554.8594 253493.6406 204976.0781 500874 675289.5 310212.5 370414.6875 213835.6875 422676.3125 339156.4688 3118422.5 351302.6563 268391.9063 797085.875 2147494.25 183085.7031 562162.4375 738751.25 487013.5938 442562.2813 360025.375 532604.4375 1018781 440610.3125 880667.25 249936.7031 710906.9375 238986.5469 165481.8438 555706.25 369292.875 186208.6563 1173518.625 507505.375 186273.25 1422852.125 569269.0625 278484.3438 200512.3438 170994.6875 168217.5469 1447759.875 139947.7344 490604.9063 585618.6875 70259.625 1031478.625 2131005 271748.0625 584905.8125 468452.3438 395865.2188 117007.9766 360924.9063 156180.4375 312817.8438 217290.9531 1002821.25 372706.4063 461741.4063 148704.4531 497976.0625 235721.9688 258593.4844 210596.0781 1111876.75 265002 369741.3125 237872.75 504340.7188 441304.8438 218960.4063 338938.0625 288452.3125 1559922.75 292401.75 866129.5625 578783.75 311119.0938 656842.25 310212.5 943268.0625 769733.875 227624.5156 218994.5469 173780.375 1205412.5 122841.3203 861814.5625 194776.5 1293255 211460.0625 88014.3281 1472768.75 257928.1406 726763.0625 330298.3438 161521.4688 148924.125 140411.3906 154124.5156 1059829.25 971305.75 432799.125 214131.1719 187458.7031 357301.2188 478397.0313 271033.9688 254248.0313 1556622.875 671966 1091826.5 486264.3125 175727.6563 1828450.125 394664.9063 242397.3438 161008.4219 220620.375 349539.25 581287.625 254524.125 293425.4063 1327716.375 153207.0938 877489.9375 351658.25 327410.2813 270026.1875 1060705 717856.4375 241301.8281 654663.4375 760058.875 488762.4063 269225.875 352788.1563 153432.5313 370372.5313 786053.8125 385573.6563 661501.1875 153971.2344 588904 1192426.125 784161.8125 389328.75 481101.1563 1906886.375 1699742.625 127311.0625 213493.8594 1634061.625 492269.3125 176849.9688 381140.1875 559062.75 268156.625 220004.6875 526183.75 775578.375 241610.1406 956110.625 230399.2188 1349353.375 120649.5391 179657.1875 334761.5938 339163.3438 230850.4688 157062.7031 195182.7031 211006.5313 81221.9531 185086.0156 735040 423033.7188 730294.125 608399.3125 116639.875 707340.5 276090.6875 167074.1406 795670.875 240990.8281 2565249.5 39852.4141 362074.0313 309305.875 213385.4219 1754698 1136108.25
acetoacetate 677964 1742537 2334346.75 2632754.5 1280560.375 1830706.5 1228142.125 1100402.75 1627409.625 3529961 2225700.25 3271373.5 1864544.125 571054.125 1154782.625 572468.125 792007.625 2226135.75 1122998.5 473796.7188 1071339.875 1487371.625 271652.375 1409028 3195403.75 1392534.125 2579264.5 1677992.125 1244845.625 656997.4375 286207.2188 3262928.25 911622.9375 266614.5625 1493792.125 1503872.5 332272.3438 676395.8125 662253.625 1205352.75 523008.75 854033.9375 800730.9375 806855.625 725993.4375 284736.4375 1284517.5 750720.0625 7018066.5 560326.4375 20526684 6271240.5 1847589.75 913804.875 36768348 1252882 263001.375 3892300.25 5383901 7302791 844569.5625 61428388 696194.875 692567.875 3034265.5 2054577.75 6229761 4394779.5 199739936 7986237 19036582 7369011 23511184 4342304.5 492330.8125 20891174 3280722.75 8732254 8094915.5 47592160 2758018 4152095.5 216344800 26915362 3201707.25 2672852 58150508 3414818.75 3884884 424763.5625 4208392.5 722506 469605.0625 12366101 41016168 1698206.25 708952.6875 25260842 53165752 5693063.5 9309632 25909738 13795140 12057706 27540620 2118358.25 1632148.75 39001932 2604560.5 43407604 11199204 799521.9375 2337669.5 1163068.875 29329856 1255842.5 9955944 5564832 1194502 844513.125 9566625 3148329 54325824 50487644 13238026 17915594 1003335.188 441471.5625 764083.0625 147227936 579066.9375 5973492 513370.1875 36553200 4414719.5 413698.375 987272.1875 3252241.5 3633538.25 51941452 1414336.625 394996.4063 15753994 2362131 814764.8125 10861173 1338863 1886935.5 28023782 333095.5625 65969876 6323570.5 9647988 18887192 629589 1804090.25 32854372 492280.4688 12222672 33111972 355748.2813 3749448.75 4312617 6343899 21050274 665722.25 16878290 2340860 3825406.25 18419440 16012333 683305.4375 29056588 1860624.375 89482744 3699813.25 45062592 794711.25 1491204.125 60207516 723749.4375 1344407.75 371712 1165521.375 5965498 2233748.5 963715.125 2911668.75 530134.125 720639.4375 7090595.5 5835388 1699175.625 23272284 1730494.25 3325254.25 210121680 3567013.5 1023816.938 950831.375 4541867.5 1005327.25 2473541.75 9147430 13107227 5533869 978794.5 27320528 13310523 22946184 430218.25 620088.4375 374688.375 2000837.5 9844883 1427267.5 785518.6875 806063.0625 11840578 10560049 11932397 946660.4375 6427314.5 4471290 1778690.375 674717.25 7144930.5 1460249.25 1702206.25 1247075.125 2077745.375 9980886 6302732.5 14776734 33118672 1944584.375 900847.3125 621458.5625 3780840.5 4639531.5 2766439.75 2243234 7144847 10669003 13188476 9161838 2241795.25 9614437 7373740.5 18014984 9182401 23008404 9975453 70548984 1239931.875 18415566 1174032.25 452568.4063 2786410.75 21270208 629200.875 14401273 9460115 526352.5625 1027767.5 2325864.25 1573591.875 19224664 2564291.75 3697396.25 10303968 2129481.25 5717707.5 3278528 892576.1875
creatine 447706624 452043584 1010760576 692265728 543340096 1296215680 948707840 799875904 752646016 864687680 767329536 688822336 568058688 753322752 642100928 869016320 685923136 966366016 952445760 398303232 505006336 394844896 840857216 906726528 369179104 812477184 810173568 564294272 283832480 381367168 269054144 757375232 399530592 641441088 730844608 613280512 1493936512 1782358400 735669248 331052320 691177600 948707840 515593664 433052064 244867920 921011392 857026560 590161728 577974080 606008576 3068968960 688993664 334653888 1433940992 4721273856 262253216 272731744 1111292288 372733568 265894208 2093237504 2505711616 4964695552 373212128 4918312960 928667776 6165225472 258738592 3977296128 1778237696 6306442240 824506944 273709280 1401191040 1649256704 2438476800 261297872 2797566208 3440742912 177917120 2383173632 5072953856 5632381440 4371758592 1625514624 2465679360 203183056 4595536896 1969337344 510267456 2186156288 637971520 6498859520 4124560640 175320096 2063222528 6241420288 375759712 1185785472 366371040 273555648 589209536 1617243776 292254976 939649728 136843456 1733469952 270732160 397122496 1096263680 434198304 731865216 264961120 1046301184 1180372736 2476348160 2271505152 4473406976 1683853696 2500728320 709786304 4996679168 857619008 3655754496 3639695104 3617020160 1410531840 2607393536 738083008 1948428160 1065582144 211307888 384236256 4573458432 968454080 1030118336 3278755328 771690624 489798592 5576332800 479848736 1921530240 4936695808 6173569024 614900928 479542528 775531712 1567447680 551663552 593872128 360014176 5559972864 1413981440 4211505152 1044887744 1329811840 1148739456 2016365568 1977461504 312722944 1189852800 986965888 3842071040 971802368 1424211200 3448361728 211677472 1785289984 2980311808 1857391488 1640272640 308260032 1582860928 1189387008 203297680 362720288 3575274240 2197202432 491685984 215018496 1526225408 296302272 529274400 4524361728 4642611200 655326848 361876736 1225071488 1487363200 2389296640 389299200 634929280 180124800 898744320 1214593792 3738131712 182085200 3733304832 1590865536 1330467200 239889712 1058160832 3036604672 3286526976 549328768 1502216320 1762293248 2716540672 443497696 6555442176 3915342336 1232432512 2394508544 2575450880 1333905920 148174144 926041472 4473875456 2925778432 4557149696 196270592 2581132288 3923517440 1592154496 1704714368 437361472 347502304 477851424 188342384 363143392 935748736 2729039872 1362642560 3484748544 862149376 5928152576 693713408 4825260032 1863311744 300097024 406211072 447656288 3809575680 558064192 434242144 547079424 928961536 2373256448 190043584 266115120 395449440 157365568 192743328 289344448 2856149504 5774553600 3341296896 331854688 844618752 426218976 6343609344 219355744 436084800 8638396416 1292482048 2122548224 1776405888 291820544 1957620992 853034432 4462710272 1564353792 7402919424 1945298688 1153048832 832801344 288105728 2896466432 306388800 1024696000 747964544 1356341632 1486382976 144188864 1529515136 970981952 1241433088 478945504 5195949568 368323104 252945872 239836304 1000040320 225417728 1206844544 1709563520 451905248 747150848 639275200 289259488
"cys-gly, oxidized" 3120031 2621876 3661400.25 4183080.25 1600170 4497196 2054158.375 2616544 4517337.5 2013598.375 2887172.25 5803196 1908318 2494545.75 3690739.5 4534607.5 1722742.5 1744838.625 2539655.25 2726481.25 2018530.375 1848713.75 8346532.5 2322470 3056947.5 1242084.125 2789560.75 969396.875 1443449.625 1480736.125 3464157.5 1946452.25 2569623.5 6822593 2771433.25 3078122 1057695.875 7431247 2541991 2210959 1409146.375 1576341.125 2314832.25 2503152.5 1358667.625 2568913 5678057.5 2242666.75 2131178.75 1844519.375 1110963.125 616294.125 1306946.5 1264478.125 16912108 2344518 1684390.125 612294.9375 2510965.25 3359832.75 2907498.75 3275075.75 631890.4375 1979085.625 63670240 1111009.75 55725660 2070792.375 718739.125 36089596 51661556 1340736.375 1144561.375 1395539.25 2598170.75 9653296 3974954 10679774 6727334.5 1740920.625 2136862.75 18124704 6176436 792340.6875 1422770 155912.5313 1851344.75 2064239.5 5952290 1479823.375 1424057.625 230223.2188 21280972 538190.5 341763.625 2275726 12724023 246503.9688 20999806 1068450.125 551108.125 1066966.125 1210839.875 8029119.5 1590422.875 651694.9375 1479490.125 3200451 2396700.5 874186.125 1061819.625 8765589 7010436.5 3755773.75 1351513 2113624.75 6143329.5 3944947 1732577.125 16520571 4265368.5 2400405.75 1219022.75 4075888.75 4398557 157721.4063 3185510 1134859 4324144 796883.875 5150047.5 1851706.625 1791096.25 378747.0313 1888068.375 1118254.875 1039431.438 3162641.25 1117214.5 2406114.75 3666059.5 6418746.5 4497969.5 1277883.75 3037818.75 1647312.125 931666.9375 4086720.25 4034721.25 3336307 1523694.875 2849724.75 13609903 1826578 21057704 3910156.75 11475376 2979522.5 1484913.375 14501257 838777.5625 74276176 1367151.875 1169460.375 3044472 1233850.875 839518.3125 21492718 2532205.5 49053176 1974307 2489236.75 1653021.375 2626021.75 1287521 780776.4375 5391217.5 3974934.5 769331.0625 4607833 663752.8125 7150057 3037794.25 1481665.375 1344853.875 2568202.5 3372829.25 1143767.25 13793012 2933763.5 407061.8438 26151946 3462660.25 1285637.625 21322728 14715486 12724090 23619676 2212944.5 2426490.25 2575432.5 743765 1767612.5 7250012 902397.875 12919709 1016343.188 5313524 2231756.75 5121833.5 2748360.75 292027 2096238.5 51066868 282694.9688 89114.4922 996291.9375 239962.8906 4570503.5 683843.375 2015681.125 2711982.75 20167010 7440571.5 6613692 1759875.375 1674068 2166471.75 8709994 32660216 58483660 7956517 948766.5 557385.5625 2267001.75 844162.375 3480565.75 9016100 4659874 8090457 9394081 10481679 1809666.75 9081274 3743494.25 2020131.25 6609735 56063072 1954835 691210.25 23174644 5778574.5 3253073.75 1129933.625 4066841.75 13848268 2928981.5 2802707.5 58482348 7784740.5 2067718.5 5266238 1274092 3750885.75 1334045.375 388094.75 8544538 7933808 11531392 3740444.75 1706402.125 8681224 5680181 10552980 6476090 5327150.5 590201.5 657049.4375 3874299.75 4961193.5 9090641 26117324 2913811.5 4194924 8565383 5173112.5 1973826.875 47739816 2497450.75 17739666 2119278.5 1019888.563 247808.9844 19674770 3887282
gamma-glutamylhistidine 1327952.625 827451.5625 1218585.125 1010017.938 564302 1547705.25 860985.3125 875123.75 692687.5 1610214.625 584668.125 500295.0313 1096671.25 813504.4375 773276.3125 720129.25 837860.75 645125.0625 402883.625 1075552.25 956353.9375 1551499.875 1083284.625 1222698.625 1005798.313 815641.625 1035205.375 619146.625 1148419.625 687221.5 897876.25 669525.6875 1300029.75 1057763.125 1187553.75 307221.5625 1065366 762016.9375 722270.25 1022083.188 799919.75 1353469.375 855832.25 999494.0625 654805.5 711951.8125 1251889.375 719799.9375 1068124.5 1037112.125 2425961.5 5315190 1149191.5 575922 2240697.25 797075.25 1019349.625 772502.5 605251.5 3046582.5 7274646.5 719167.3125 1605393.375 830024.1875 1824471.5 431337.5 3310812.5 249793.75 1144553.5 1319209.75 13638005 503032.4375 619108.0625 607217.5 2384983.75 1752266.875 542765.5 2059428.75 433235.6875 3054932 790205.5 5528936 1343163.75 1050708.125 638775.5625 618457.875 322723.6875 1245600.5 651930.25 275457.75 1438903.25 833205.0625 4437550 1302889.625 1353714.375 1634428 6859501 1791638.875 1997140 233564.0156 511745.4063 1248978.375 1275039.75 875582.5625 505854.6563 1098856.875 1459293.625 343513.0313 364314.5 601450.3125 1176491.875 1276237.625 974793.625 684859.75 471966.3438 1681562.25 903492.875 453634.125 751869.875 1353048.75 9044602 1039437.063 355161.3125 3981338.5 2152717.75 2845402.5 331390.625 913855.25 611714.125 1793846.5 1341581.375 1494354.625 854749.5625 2132584.25 778937.4375 740695.5 691764.5 647590.5 618717.4375 1268494.25 1665674.5 1131716.625 5887356 1369741.625 833647.625 383739.1875 668434.75 844792.125 1022680.5 261907.4531 733171.1875 1018997 85078.3203 1497101.375 4625090 667565.4375 1876872 4730503.5 1248174.25 984613.375 657710.625 477315.9375 1644824.875 1164172.625 1572664.5 1176272.125 1023377.063 805876.4375 932274 770826.625 1519427.625 1261776.875 8818267 986579.125 751840 347909.6563 2170303 1340867.5 612463.1875 866502.3125 212029.6406 1714383.875 792864.5 1145417.625 2605564.75 612269.875 999853.125 681399.0625 2239801.75 1537194.375 669405.5625 1692112.375 388368.4375 1952783.625 781080 1429440.5 425904.875 2637224.75 3572620 521758.5625 2694599.5 810659.625 3409307.25 2124225.5 609068 1386836.5 1068471 875833.75 788220.4375 2158494.75 562634.5 1023367.438 135983.1563 849617.4375 941751.8125 550230.875 667368.875 5037314.5 1115456.75 1023024 1009342.125 705285.3125 1797718.125 1339410.75 664013 1003670.75 580272.4375 1740248.625 853909.5625 1031668.313 525546.25 2681896.75 1132956.125 2080365.625 5152961.5 1151035.125 1204220.875 2429928 696585.9375 991712.875 545797.0625 1151509.875 1131705.625 901870.3125 730406.875 862320.8125 1346444.75 6245679.5 1402617.5 1783888 373659.1563 4023014.25 3224512.5 794497.0625 1115687.25 1890241.125 2500365 1862110.625 567070.4375 1056989.875 1596008.375 1222821.75 786260.75 1807726.375 1023024 1236974.625 992628.3125 832832.625 2856762.5 804311.4375 781208.875 901293.25 2522056.25 1328977.625 1734044.75 545216.75 1770117.625 607690.5625 691948.375 2143792.25 1422776.875 621111.3125 930084.9375 848522.8125 2640726.25 2045143.375 4058007.5 419631.9063 9354163 1925518.625 601401.0625 473546.2813 11571373 2159825.75 3107649.75 556466.5625 1630272 1001450.813 2670140.5 1360316.125
1-methyladenosine 3255998.5 3879635.25 3622298.25 3451741.25 3023198 3945622.75 2634685.5 3859586.75 3718963.5 6038332.5 3644899 3823256.75 4039683 2923327.5 3525859.5 4760453.5 3108367.25 4105201.75 4009035.75 5265343.5 3084631 3230808.25 3943003 4218781.5 4975908.5 3746127 4854360 2864013 3549152.75 3929910 3931901 2942643.75 4824044.5 4272890.5 4742684.5 3860978 4160299.75 5075529.5 4618792 4846680 3285457.75 4499280 3316655.5 4394709 4968805.5 4345270 5278246 3499362 4525383.5 3328466.5 10181974 10248384 6972126 10722674 21047400 9410838 5439776 3928044.5 3447437.5 11987792 11455464 5243016.5 7697811.5 5062466.5 14448075 4904192.5 12974428 4095414.25 9793566 6343410 14120375 4049343.5 5321354.5 5664275.5 7703274 13598405 4318149.5 8649339 7905588 10762854 6181184.5 15301684 13560584 9045044 5397090.5 7335482.5 2944227.5 7220586 7207582.5 4054871.5 6091151 3666903 16857106 7478051.5 11225386 7348781 9222116 6942212.5 12550867 2824754.75 7525627 7035812.5 9196827 6617329 3803342.75 7382570 6806408 5129591.5 4357120.5 4311288.5 5078170 8699994 8267010 6084921.5 4649899.5 6681211 4270383.5 8463452 6171979 7835354.5 14734169 13714378 4316613 12351831 15186503 6282852 5217599 10665698 7471248.5 6387729.5 7671243 6348414 5318967.5 13899883 6401533 4721748 7430340 5653907 7099715 9400732 7035804 11238132 14501042 12948819 4753590 4484323 4786712.5 4534471 6569980.5 4998807 6159272 7198985 3364476 10272343 23341116 6142579.5 7085064 9542412 7376987 4613406 4785790 4018761.5 10077200 5142914 12215340 7190617 7069417.5 6837178.5 8025003.5 7170961 9281334 5376955 19849144 8070883.5 4913549 6255843 9546010 9945695 2961225.5 6085702 8933770 12368045 6543772 10980984 9872091 5601826 9356919 5193900.5 14736997 9802640 8403211 9335783 4157405 12825106 10059755 8561246 6415521.5 9362910 11138816 4873549 12704414 4903666.5 19702174 8447593 4458352 4715422 6408527.5 4240024 10436027 9036302 11762542 5934438 6126603.5 13135032 7654579.5 5025815.5 4347688 13976921 9223865 6954166.5 4688787.5 5904218 11745002 14665471 5989363 4237148.5 6001968 6391409 10525211 7965878 6408527.5 12280252 5677014.5 14275633 14253486 5945350 6578003.5 10182182 10554225 5319925.5 4567240.5 11382380 7029601 9025143 9949680 6480458.5 7950633 10293042 5680646 7071406 2754135.25 9365368 5337276.5 6682570 6734720.5 10768128 12038918 5036973 3361343.5 8624584 10478222 6206239.5 3878558 6599723.5 7484455 10580693 6007870.5 6942028 10426465 6384081.5 11102012 4668926.5 9478858 5163334 7732824.5 5803291 6425394 5708059 4571340.5 7365371.5 5287610 5425468 5567889 7139367.5 14076930 11007700 11196322 6455119 14543142 8365169.5 5537486 6226974.5 9063988 6156605.5 5872101.5 7498847 7023062 5386613.5 4895828 12680609
choline 211851104 201149600 179916512 183316848 166342384 215025232 184912400 144991392 160014064 225322096 158951888 202965952 158376224 101864088 141038832 202877024 128174528 191509632 221626384 153420896 142738208 221729968 222171936 182952128 241456288 166746320 163617056 147513904 211865232 153274368 218084128 145672256 184928576 187214480 193636720 126240048 143595856 255759488 191394080 202536928 107628032 199746944 125194792 233344416 269243872 191395520 182103088 120397416 153798080 128963672 162542544 165396144 180856880 323656832 145447168 96629920 132457032 126435744 183080528 272303840 182405824 182262848 392065344 244012144 449632224 188548048 282447648 153481552 127811176 122600408 104626192 269900672 204954448 218235664 105990208 366085120 229479216 192610864 240232416 139437680 115987120 301617120 213758736 108917328 146262992 277940096 183820608 146170448 213710080 214781088 142262816 170520560 505241344 169635024 325133184 258631008 233390320 242699536 349237568 103053864 227802256 302353248 103914456 225504656 216554224 239989488 244051488 180345568 283254592 179201136 205189632 290982368 287593568 271782144 246536016 135934800 275272608 223255360 164872016 213626656 125731128 184805888 151831824 221411904 103743936 93196120 197659168 130816568 264496848 301586976 241374336 580775360 279440032 294364416 209522304 294693664 184851824 365111392 165784992 196265312 85265464 258698896 137001040 313113472 240093760 190894704 208965968 150646592 162046128 286931008 292893152 167153936 169412496 182889664 456750304 246894256 277754816 291311648 141834256 251632816 142855056 256418768 336369920 219492784 191515680 176783136 426484992 365368384 112063432 117561432 162737632 149208336 236916112 173798288 159245824 180065744 130032688 113501184 188830624 223773856 335242208 365352480 193292432 342719104 223018656 111266376 229810176 285100448 499110112 214890864 316650720 223676272 235578048 236503296 204658864 582404224 159055728 133554704 352591744 188494400 103923880 101174976 314974784 189889296 165789968 237245216 192610864 107936952 288083840 171583424 116161064 258521136 132919624 376699168 250637840 217753856 278471840 231840560 253260752 233902000 237338784 267728800 161892912 211990304 209760320 119035112 118898864 86246328 108395616 153237040 250563728 186565456 164177024 230790400 81312040 129820080 122952952 286930432 231420880 124556744 274780384 290979328 297539360 249116704 154622976 162860208 131166336 94695272 202990656 224645200 127594072 170933984 141856992 292607936 200915856 146212032 508623520 399918048 172375152 148630160 194359872 63135700 125390720 214381920 120476816 226076832 254729264 280198656 312242656 277459040 131552184 191929312 110843808 188861232 67033876 138902496 302191360 143945008 212640720 204260608 200839808 108956448 154277648 341808960 161776512 184250240 306181856 166049152 383541728 142873328 151400736 258810128 37788932 354206464 132991224 160665968 130881824 118929120 290584352 213575104
anthranilate 177466.0156 259511.0156 335959.875 214121.75 370216.6875 348596.0938 303849.7813 297601.2813 223050.9844 267399.8125 354305.2188 236260.2031 221781.9063 369441.9375 216119.8438 221092.5625 275990.75 211857.3438 469806.7188 327873.875 103262.1641 193091.75 291912.5 993164.3125 407106 322896.2813 254227.7344 564284.5 265882.1875 134505.2969 254905.0469 323298.9688 425360.7813 743102.8125 625305.875 901387.375 523618.2813 409309.7813 753761.1875 759246.875 345762.125 312740.875 1057526 5712107.5 6870042.5 383873.1563 1143351.375 1211763.375 1774603.625 219117.3281 640102.1875 419344.5625 4219887 810462.875 606807.125 7471805.5 700952.3125 3836191.25 387216.9688 3318434.5 426957.625 1057526 198327.3125 3400598.25 510757.9375 593731.6875 399966.8438 2647342.25 2707612.25 333349.7813 1252820.75 1779086.75 1662928.875 1785510.125 3471027.25 2556578 5490766 1602762.625 4992208.5 451675.9063 2051298.625 1190350 848429.375 1435252.875 566698.5625 3757446.25 2981715.25 1492299.75 5469697 8146892 1216078.375 4960900 1568135.375 1671982.5 1605756.75 1041318.625 522349.0625 581638.875 887438.3125 4946216 700511.125 567697.9375 501682.7813 711221.25 2653357 1189006.25 1325505.625 514978.75 1009093.563 1435636.25 2790886.5 3213300 3336299.25 4666502 2344855.75 775435.375 2013761.125 8920291 2401492 1834309.75 7476999 1811600.375 4450375 1533450.125 1500526.875 529024.5 4794582.5 1162309.125 2274523 793098 905195.9375 4180462.75 312496.875 1297247.625 11309171 4017541.75 689867.5625 545950.875 1251276.5 1657789.375 1136985.75 1089128.125 2215573.25 439327.3438 3018846.25 5827559.5 725519.3125 4248795 1664062.625 1057526 452987.5 383502.6563 347849.875 3538111.5 1242795.25 1555744 3478577.75 1912963.25 2547651 4352600 1148925.75 1075179 1881219.25 3868611.5 1986993.875 619231.5625 228209.4844 619667.0625 1954265.875 249570.75 472621.0313 1992594 2443107.75 704008.125 796317.1875 4076280.5 376574.0938 1972153 1806919.875 1177011 2748313.75 1736789.625 986898.75 193213.2031 2748423 906886.5 5719270.5 416566.5625 2372368.75 7026216.5 5052099 732328.5625 9132869 1897717.875 343099.875 1578270.125 1969822.875 891478.375 1309688.875 3141481.5 2544313.75 960904.625 758348.6875 4427227 571556.0625 974862.375 1129599.75 1740540.5 2249821 1572191.5 877767.25 1677048.625 19019430 5884637 1812504.875 530836.4375 357349.7813 299476.9688 973618.75 753185.9375 1046397.813 1229370.375 4891891.5 3471123.75 829746.5 1355861.5 1620846.5 1122823.25 324104.3125 937206.4375 1944657.5 1071725 743628.1875 320415.6875 720850.3125 3597555.25 829094.75 547692.125 714854.25 2795455.5 2506429.75 2089379.5 746503 4207572 826832.6875 1806466.875 369600.6875 312006.6563 8101949.5 1726611 275009.0625 1903596.75 1362801.625 1133826.25 1122368.875 735589.0625 782295.1875 451236.75 326594.75 621238.375 4933403 423734.7188 780913.3125 465678.8125 842501.4375 1499689.875 811812 4463290 422584.8438 446635.2813 1143091.625 1290302.5 999127.25 1405614.25 473015.375 659608.375 1658810.875 813919.6875 251617.4844 1233300 1349222.375 445399.125 360600.75 1509553.875 486013.0938 1824372.75 766237.1875
gamma-glutamylleucine 2535393.75 1717886 1432677.75 1888170.625 892178.5625 2271833.75 1932253.375 1930151.25 1732711.375 1697527.25 2034832.875 1352612.875 1689254.125 1097122.375 1731408.5 1850683.375 868200.5625 2538230.25 882614.875 1795984.75 810007.0625 2460257.75 1469605.375 1897081 1468352.75 1199012.625 1333292.625 949208 1376954.5 1976193 857912.625 788808.625 1052712.375 1800609.875 1851983.25 952348.8125 1692727.375 2884956.5 1009542.438 1078524.5 758195.6875 2126627.75 938337.25 1383032.75 2247555.75 1598832 2324389.25 827775.4375 1641208.625 1762140.125 3409498 3056741.5 1683430.5 1122879.5 1778985.875 1475205.25 1407154.5 2208607 1928477 2459503.5 4857714 1449292 1926627.25 1170249.75 1119742.75 1965678.375 2463044.25 759914.75 2211181 821614.5625 3320330.5 1523982.375 1190180.625 1328224.625 3501527.75 2940909.75 1069354 1426743 342072.3438 2578546.25 2096903.875 5259197 2275025.25 892716.625 644506.9375 1514290.875 901509.3125 2339173.5 1337505.25 1314078.5 1467071.5 1602073.25 2239214 3984654.5 1956107.625 1350033.5 1622514.875 3427063.25 2109404.25 957297.3125 1151694 1434155.375 2331488 2857870.25 1178326.125 1474155.625 2284895 1076410.875 630897.125 1673085.375 2688303.5 2347884.25 2785401.75 1413734.75 667196.125 2058378.5 1386023 618748.9375 2309104.75 2868029.25 6704809 1329475.5 1124106.5 5469867.5 3036643 1516381.375 695338.4375 924628.9375 1245990.625 3150823 1478422.25 2536311 1366896.5 2538172.5 1902799.25 1694156.25 1259825.75 2154754.75 588744.6875 1127213.875 1521596.875 1554572.25 6723839 1106612.375 2008871.125 911407.25 2935593.25 1551290 1950567.5 1600383 1635311.75 1180368.5 1236445.875 1366160.25 3418456.75 1901824.75 5618848 2034095.375 1659862.875 1661216.5 1779871.875 1360688.25 1709976.5 3245434 1144807.125 1486885.875 1321440.25 2210623.5 1079484.625 1981113.875 4955058 898567 3938607.5 1807240.75 2085902.5 1783342.625 2874192.75 1910885.5 3267635.5 1839104.125 788485.75 1238340 1344622.625 2392170.5 5243800 2604728.5 870109.25 2343368.75 858461.5625 1783758.125 2124973.25 3813542.25 1169021.125 1890031.375 827073.8125 2445335.25 632007.25 2272962.25 2302420 705381.5 2097954.5 1240347.375 1358691.125 5387795 1725795.5 1704451.875 2003791.875 2193942.75 549422.75 2161280.25 364490.1875 1730611.75 1215594.5 2089664.875 2395784.25 1208721.375 1126935.875 3361616.75 1128978.875 2036651.75 1190395.75 1387299.5 3927399 1525668.5 2907167.25 1227846 1833509.875 2779953 732920.9375 1016699.25 1068104.125 1706225.625 2165365 4282410 1717886 824662.1875 3023493.5 3981430.25 1557196.875 2390292.5 1756517.25 1731575.625 1097618.625 1491344.125 1566722.625 1233398.75 1769817 3031739.75 3084720.75 1331253.75 1042572.813 2091019.125 7647743.5 996764.25 2977252 7765209 1591307.875 2677010.75 1204682.25 1140454.5 1396259.5 2605435 2283145.5 2955571.75 1061534.25 1377657.25 1914177.375 2243089.75 2983604.75 1630552.75 2349493.5 3281998.25 3400811.75 1070752.5 1137851.5 1802660.25 3591398.5 1951493.75 1975569.25 1287517 2018081 1341051.25 1385374.625 2928639.5 3516544.5 3821461 3152945.5 1416816.875 3864376 2628971.25 1334663.125 1492395.5 2958126.5 2928317.75 2226716.75 1014215.875 1662225.625 2160899 2777858 666064.3125
3-methoxytyrosine 407335.5938 501555.2813 589812.625 634980.8125 485637.3438 752226.6875 665781.3125 489754.3125 788629.25 1171243.375 546272.125 513798.4063 680374.1875 565861.75 534882.25 640076.125 880131.3125 681188.0625 969557.5 878305.75 770458.6875 814623.4375 483165.75 764750 602462.3125 1056426.625 1039323.25 534944.75 986329.5625 589682.3125 766432.4375 610592.1875 863907.1875 914236 919927.625 704831.875 772981.1875 1186903.75 1026131.125 1097796 874997.3125 813994.5 667687 969557.5 1067942.5 749595 1268092.5 885132.4375 415060.0938 623697.75 4960153 1304951.875 484431.375 1622660.25 1858631.125 3222056.25 1553293.25 757288.6875 642001.125 2121235.5 1252083.75 377284.4375 760791.3125 544674.8125 2153876.75 307714.1563 898128.9375 1246807.125 1643097.25 579736.375 1299041.875 323530.4063 505946.75 370009.2188 2565887.5 1139918.125 724116.4375 1422366.875 463198.875 1219728.375 1417811.625 1997909.75 795361.375 824288.5625 515974.4375 690039.375 374282.4063 787073.6875 359748.6875 579828.9375 1001370.625 315990.5 1148808.75 1129043.875 961859.0625 1407576 1182674.25 3391056.75 2609174 784949.1875 924883.125 1425649.625 3410136 978413.375 555948.625 2237417.25 1112100.5 403431.0313 666551.9375 685143.4375 2310518.25 1989819.125 893682.875 1352872.5 994767.375 695726.3125 2043654.375 917137.625 890074.0625 608459.5 1743483.125 3027574 476098.875 1610964 1088482 1359754.875 650147.8125 1326117.625 1669454.625 1759971.5 2008173.25 3016028.75 1033984.5 1908414.375 518050.9063 440565.0625 577485.1875 574920.5 808313.6875 1506090.25 802189.5 414317.5313 1659124.5 1470977.375 412458.6563 1401906.125 567354 1074424.625 1935264.125 635454.375 1179107.25 1316135.5 369349.125 778621.5625 4822852.5 1025027 626784.875 1003131.25 699319 1031483.563 910663.9375 255371.9844 599048.4375 535122.3125 2822060.75 607739.625 2361022.5 402039.5625 727433.375 721385.4375 814700.8125 1371038.125 2202414.25 1713968.875 1132949.375 954807.0625 1233660.5 1095817.125 382867.875 795970.8125 1011488.875 4072609.25 23597678 1498820.875 2041143.25 1084263.125 1375031.375 897344.5625 1111527.125 1994781.5 516590.4375 1882601.625 395215.2813 1131743.875 281784.5625 1981249.125 444006.1875 1873247 1614862.875 372530.7188 2647335.5 772771.6875 1266739.125 821877.9375 591302.125 557668.625 349500.6875 409177.3125 1160667.875 711988.5625 669782.875 790735.625 580241.3125 770590.9375 983188.25 1070219.625 728939.3125 3121629.25 1245437.5 953552.6875 2021898.625 437526.8438 5262948.5 625359.6875 927647.75 1115069.875 1365604.125 807342.1875 1178059.75 2242157.75 783965.5 1053239.25 1223390.5 3247121.75 2124667.5 1027299.063 953795.125 2018426.625 2627818 958070.6875 1372458.75 2791684.5 2054119 1039745.375 1406201.625 816738.4375 1641160.5 2374684.5 907794.875 2056416.25 510088 1449834.125 2745127 2868372.5 981044.3125 1537131.25 948188.875 2532716.5 475987.4688 648767.0625 1172423.25 983731.125 349201.875 514995.25 1630448.25 1121704.25 1147559.5 1830314.5 973652.5 607714.5 1582542.5 465722.0625 1751009.75 586663.125 975662 1046964.375 1417055.375 785891.6875 746868.125 742632.125 1080481.625 1124439.25 1514931.625 2440642.25 2113188 1391765.875 3537318.5 933791.3125 1761759.875 1205843.125 483719.1563 952055.875 1301635.875 2058425.25 428883.5625 710183.125 896523.6875 645330.5 3561942.75 5605852
dopamine 152989120 388676000 3896009 602298 433489760 66916848 155463456 2652375040 21568382 66916848 548625.5 586645.25
carnitine 974184256 978436544 1212174592 816900992 1093288960 1332768384 1023707776 1164703104 943885248 1043988608 1295669376 1009039616 1495580672 969778688 1146279168 1197220224 1450414080 1075208448 1260448512 1467952768 1284411776 1312856064 1153891584 1539539200 1253889280 1259294080 1402450176 1050977536 993875456 912229440 1236386816 1080694016 1460765568 1287779072 1333126656 1322009856 1210870400 1347870592 1281044352 1274611328 945793088 992935680 1092506624 1284411776 1232997632 1206235520 1003525184 1059496320 964422272 1320819072 1837284224 1393038464 1013471808 1600944640 2274848512 1312614144 1077662976 1823786880 535631680 723497792 1504718848 1436887168 2704751360 1342071424 2032971392 1062468416 941705024 1241177600 1716751616 2173284864 2839780608 1021233792 1465889664 377016768 2034115712 1307278592 1086506880 543439744 1327794176 1455612416 2105463296 1942689280 1827812736 1862951808 1571760768 993624704 872719808 2322896896 635613760 897445248 1205817984 1030274944 2215684096 1211620224 812171072 1774441216 2240151552 1734053632 1195867136 959627200 886509248 1545768448 2041363584 722504064 1111843328 1659051264 699393728 667753280 795058560 1278241536 1278293120 1825184256 1087096320 1301026944 1011048576 1335488128 1315262848 2693555968 1538911872 1422891776 2580123648 3092326912 1409669760 2194507776 1002251392 2151215104 1567979648 1099588992 928116416 2227357440 862980992 535586944 712156928 1928183808 653807296 360021344 1518524032 1038414528 687411840 5109802496 1274817792 510484480 2643254528 1535531264 1153799168 1117591168 784783488 1471631232 2966387200 1398069120 733060480 1016297664 676705984 1342023040 1987055104 978726464 614783616 567554368 1879479424 1130179968 815264064 951843840 986256896 905757312 2554187776 1537876480 1850865920 1557807488 2249180160 1516194304 305489952 1335586560 851776576 1073636672 1008193152 740027840 1311433344 1622301056 833661440 1463441536 1029472512 1813745024 1448074368 3042325248 2440330496 943989952 1474672512 1299290368 2186492160 1225010816 1118953472 1869470848 586183488 1330813824 1036671040 1643159040 717563072 2056698240 1087485824 972336896 2580364544 921852608 1191386496 1583656320 1027386304 1355943680 1075439872 1342966272 2421107712 1530464256 1833613824 505899328 235333600 3419913216 2038171008 1359143936 1133297408 1783616128 1658113920 2601337088 1220601344 1568753280 3303560704 2382734848 1072006528 958505216 1103585408 2197294848 934268096 2181268736 1598435456 3217338112 671578240 1363958272 2506730752 1561500416 1926513664 2068500608 1187017472 1344094976 1999551744 3247284736 1462371840 823736320 1065014912 2037700864 2086167680 1983282816 680017856 1439489792 753884800 1576658688 1421951744 910513600 1291594240 2755966976 955004608 920318080 1211276416 694320384 3910470912 1247186944 1260139648 2700043264 1107795328 846568640 1848962688 1547787648 1541573888 875281344 1662096896 1569733888 2481216000 1110382080 704516160 766185728 1400227840 1104096384 1397633152 1153998976 1824065664 973503104 1251533696 529407104 1489506688 1966422784 784901120 1219487744 878698048 1457455232 987664320 1137348864 2307708928 915422592 1873942656 1496098816 1794748288 1048039168 1598761728 2019327488
xanthurenate 71084.5469 299216.125 558313 131495.625 614813.625 271988.4375 568310.0625 502516.375 334666.625 825404.4375 215586.6875 155918.8438 516025.5 341812.875 357417.125 255445.7656 170874.3438 121017.3203 240141.8125 299247.3438 253314.9844 313743.875 696141.875 414509.2813 552897.75 212158.2031 187729.6094 275701.875 190297.7188 251570.4219 74112.2656 129344.8828 144802.0781 325892.1563 244666.7344 94029.8906 464148.5938 743912.625 242492.75 90614.5859 94804.3906 458069.8125 147699.4375 349615 264183.3125 247244.8281 360728.4063 130761.5234 306826.4375 89392 863205.875 1084883.625 134818.7656 233400.1563 898052.1875 136103.8281 160190.1875 2153289.75 276621.5938 1138528.125 85599.8125 1370223.5 781743.75 84273.7578 2317949 170336.9844 371318.4063 187338.5938 1172444 648392.6875 296560.4688 1920975 702975.5625 3152782 1198198.625 289255.5938 710929.1875 57838.2852 103563.8828 132795.8281 3763439.25 976763.25 1454082.875 2183630.25 1784876.5 5072560.5 3462359.75 130275.6172 839822.625 2154260.25 1455588 138663.25 556679.5 161538.5313 196569.2656 361345.375 495060 889565.5625 492073.7188 224084.8281 47312.7578 1178224.125 657127.875 69284.3984 187733.375 296197.7813 210191.5938 1646440.375 3485840 444298.4375 366567.5938 4981514.5 589968.875 760693.5 165200.5313 3589100.5 265915.375 441859.9063 520592.5313 267514.625 2786379.25 64810.6992 100385.7031 710219.5625 1583566.75 35716.3555 190269.8594 118319.2031 241161.75 2367837.75 2161041.75 574277.4375 2048641.875 155410.9375 180682.5 13631360 366289.75 1205757.125 637992.375 136538.5 134530.6406 132820.9688 906759.625 585544.5625 533190.625 349598.0938 89658.7109 54479.4102 87527.5625 2559365.5 159041.7969 183410.5469 131519.8906 153260.6875 172009.2969 323584.0313 1473554.625 87838.1328 1451849.875 292581.9063 142853.0469 1557543.125 75498.8125 2339938.25 365095.9375 842303.875 386596.3125 8244808.5 558885.1875 312767.8125 23409462 1579217.875 3907555.5 319758.1563 55894.5273 110776.8281 430669.7813 499193.5 2026304.75 203159.9844 677072.625 1761874.25 420336.7188 448867.7813 212969.1875 1166196.375 108559.5234 1420553.125 491185.5313 130209.5234 936393.5625 463315.9063 138543.2656 228970.1875 510173.25 251363.3438 41111.1523 947358.375 597178.8125 799332.25 122910.6484 410072.5938 338501.5938 98416.0234 579210.4375 571083 70284.3828 38984.0273 166325.1719 891543.0625 67931.6016 674226.6875 603177.8125 622311.25 519930.0938 74854976 5246788 250397.2813 534612.375 218997.1719 266583.9688 1591854.875 122257.8281 561611.1875 273521.2188 737371.8125 513024.3125 497719.875 357967.5625 77524.3906 420327.7188 378063.2813 218399.2031 192208.7969 46251.3828 207821.0938 453739.4063 172406.2656 168190.1719 64855.3125 138214.9844 144863.9688 93098.1875 2330241.5 406981.3438
methionine sulfoxide 6894130 6180026.5 9109779 9555976 5638429.5 12367057 11342748 4660508.5 16056415 13117605 8151521 5006698 14951977 6144127 6176531 10376827 5064361 11955467 5710125 7064574.5 5189981 10579839 6895901.5 14830255 9432075 11885868 8777557 4168806.75 12186718 4675382 7913750.5 16033400 7058195 9036826 15202346 6277030 12766439 17377474 14157175 9133278 10789802 6385385.5 6652148 10983188 11418562 9816837 10702134 9872100 9963531 7983285 23717356 41429916 10793847 8454432 20575160 5060585.5 7178682 15203289 3913775 24529602 28465004 24971612 24692076 7681145 18234232 8998891 13630980 8787870 17030536 8546389 110477440 7419173 10383143 9903923 17440500 16625044 7419655.5 10845672 11751707 9067348 11269719 48114952 18909502 17042104 11898433 12983223 4660954 14526153 12325557 6940082.5 17785972 10273289 55665220 15245845 9436290 29911620 69420616 9453957 17575750 6051919 6940368 19481804 7924517.5 10050844 9225458 14489795 17481170 4333216.5 4446565.5 13744397 10731961 8577236 7010162 7044013 8196856.5 15486778 10312252 21753674 15975477 23817254 120545616 25631630 6260638.5 45321456 16229326 67438992 5780035 9451617 7679301 18514482 23283392 11249262 6870429.5 29848450 8065033 13062925 12576077 11317463 3786248.5 20498354 9842945 14674156 111863344 33076964 6063920.5 5574439 9862753 10761788 13724152 9133280 4989534 14309658 6070327.5 9525668 42736972 5675588 95369136 81095784 6248466 3686892 4205992 8384747 27157794 11270318 38953348 20415692 8739957 17605600 18602344 13113679 16351320 15773977 15033689 7943996.5 9481446 6887725.5 21627802 12585388 7999199.5 9542849 12664104 15203466 10454192 19141442 28764164 3879663.25 7814657.5 10908513 20679094 11643584 10905955 15496769 6250679.5 40014064 11025869 15127911 4283622 29761560 21531520 5925046.5 9990131 6042811.5 38506088 30659210 6076709.5 21994702 13406267 19517806 5003534.5 24460050 23660726 6627172 7422439.5 10731961 11416230 13061232 7810178.5 55547688 27689980 8521481 8525102 17635176 24303540 19725748 11033405 6503762.5 4913718 11644654 4756383.5 13486837 11479811 37237844 15165836 26978868 21606946 5880987.5 21037120 32020256 9025020 13282782 7384622.5 20704860 26582056 7051583 4505251 4629896 8087860 58483900 10428195 4393017 3239846 6920772.5 6390247.5 7536401.5 11768811 33682268 3694749.25 8974762 6723709.5 5126036 17742622 7598086 3884140 20776542 6362670 14085980 11742524 4573883.5 27435938 6614441.5 14405062 5053033.5 11286588 8003218 11527169 7606669.5 9321982 5297467 7844486 55166340 8442583 7421180.5 6390845.5 8060142.5 11025318 8657543 14285671 5239894.5 14211096 11187486 6922483 5715809 18435738 6688262.5 9656094 5544460 14984938 7677810.5 9441639 7283733.5
5-hydroxylysine 3276773.25 994471.9375 2926704.75 1990938.625 1163193.125 3934647.5 2035241.125 898431.375 2786166.25 7566473.5 7611088.5 1632285.5 4317249.5 1785899.25 895434.25 2909003.25 1143261 10730900 1521812.875 3960298.75 1673352.875 2836921.75 1901639.75 3564995.5 2563193.75 1150880.625 2306000.25 921992.875 1142504.75 1007339.375 1386575.625 5263484.5 1108628.125 9399158 4121497.5 1222052.25 10832714 12560142 2435647.5 1140650.375 9625445 1911406.5 1694399.25 874517.125 1635253.625 2960095.75 2476918.75 848991.375 921434.375 1850655.625 2549400.25 2513088.25 2258440.5 2201912.75 3878910.75 1715821 1299483.375 2566386 2048636.75 2011109.5 2536028.25 1283887.125 2410949.5 1736951.625 1461332.75 1927651.625 2571227.5 1686411.5 4020752 760884.75 2881673.75 1507696.375 1781780.375 2477906.5 2709563.5 3147476.75 1257872.5 2763439.25 1328132.5 1301955.875 2453385.5 5069370.5 2740822.75 2779742.25 2870939.75 3723833.75 1049968.375 2283984.5 1674810.75 1465202.25 2552092.25 1943623 2317350.25 3321100.25 1962634.125 4244985 2357335.25 1861597.75 1723645.875 1211518.75 1345856 2752162.5 2491937.25 1736037.625 2395575 2302335.25 1363634.5 956706.6875 1365716 1563456.75 2134775.5 1547057.125 1497809.75 1287860.625 1349627.5 2254604.5 1627988.625 2685681.5 1414998.25 2800247 6401179 2146885.75 1159062.125 3290181 3357010.5 5241491 1083647.25 2078102.5 1616345.25 3307040 4031902.75 1936809.625 1990044 2624062.5 1817541.875 1802108.5 1247528.375 1952144.375 1672689.5 1556617.25 2773785.5 2269162.75 9890844 2515848.75 1731758.875 1222708.375 1540679.75 1771903 1942902.5 1649499.5 899695.875 2559265.25 1069792.625 2777574.25 3319242.75 1091536.5 2383855 2229874.75 1461826.625 918353.75 921315.875 1364483.5 758367.1875 1617676.125 3820144.25 2489084.25 3485467.75 2814594.5 1942764 2939958.75 2844034.75 2216364.75 1413734.625 2282370 3249671.75 1560705.25 3334430.75 3666660.75 3748081 1641267.125 5037034 2598225.75 1199232.75 2328393 6321998 1374011.25 1742390.25 2532392.75 2248529 3419742 2549423.5 1780369.625 666938.4375 2067551.75 1524671.375 3265255 670717.375 2807343.25 1756326 1279763.875 1486407.375 2032175 5107902.5 4149899 1591321.75 1723525.875 2858270.75 4187209.25 1035618.063 4663875.5 2322752 1438322.75 1117747.125 1560773.25 1402613.125 4880208 2233020.75 3217063.5 4466611 1465219.75 1956169.75 1566120.5 4921953 1384483.25 2433523.25 1268381.875 1343720.5 1523108.75 786458.3125 5121342 4386475 11783244 3948457 4477075.5 4028216 1488902.125 2616071.5 6188717 2133571.75 1478879 1747507.375 3666948.25 2874562.75 2011109.5 899807.3125 896576.8125 1022369.125 14044460 5524674.5 1425619.5 1127383.25 2044957.875 1730428 1680980.75 2420790.5 5870137 2433595.5 1039446 1572698.25 1403288.25 3414615.25 1944506 676598.5625 1831070.375 1371425.125 2247382 1769469.375 1508246.125 1767997 2820874 2721652.25 1212556.5 2644727.5 916793.625 2403553.75 2026993.25 2194413.5 1202606.75 1480085.375 3570937.75 1591826.5 1372152.125 1821046.875 2631414 2382898 1189749.375 1252148.875 1147734.375 3867370 2024299.625 1553394.5 1922146.25 4095027 2770886 1382909.625 1418580.625 2768831.75 2043279.875 3129938.75 1400377.75
4-guanidinobutanoate 826198.375 353706.3438 451693.0625 642113.5 465832.1563 459264.4375 2172103.5 346881.6563 878084.625 1024556.313 591395.6875 2035229 767680 286216.75 468980.9063 342415.8438 1353409.125 736239.125 473177.3125 643751.9375 537571.5625 1006879.75 564019.25 1383657.5 581702.5 873939.5 406005.4688 172917.3906 1098984.875 969646.8125 2415666.75 2258825.25 634797.5625 660542 392983.375 204604.8281 946974.8125 762212.1875 2576098.5 383647.0938 231836.6406 220153.5 572638.5 761702.5625 675662.5 659709.9375 347073.5313 419428.8438 355502.5625 1885404.25 8138548 1096633.25 747539.1875 1407457.375 1823650.875 346249.875 782865.3125 1080736.375 379752.3125 1934316.875 590760.25 453941.3125 2871706.75 440737.9063 2930851.75 138545.1875 2068192.625 544196.3125 1872845.875 490968.125 2321616.25 294144.6875 278583.125 257992.7656 882431.1875 776851 503677.4375 545018.5 857361.75 534961.625 2418047.5 685732.1875 1342297.5 953059.9375 1355526.5 658716.125 363175.3125 2497679.75 387401.3125 252085.4219 424278.0313 149086.7188 1525197.75 759613 204339.9375 481923.0313 6972558.5 1028858.188 673685.4375 269575.3438 226747.3906 569144.875 71060.75 436894.3438 250471.8906 540804.5 768139.0625 145458.4219 203652.5 280126.4063 134026.6563 191243.3594 411909.1563 601230 200809 396436.9063 195440.4844 1836546.125 255032.125 551052.4375 1568612.125 1326787.75 807390.6875 1085348.625 453719.5 2116253.75 373352.2813 542975.9375 819608 1418031.125 975110.9375 349789 1614927.25 237100.625 123906.0078 773127.75 316886.125 404205.6563 2594341.75 451544.3438 343925.3125 2607991.5 1092119.375 356104.0938 242421.9219 177257.7031 372175.2813 823975.0625 505782.5625 275163.8125 1562537.75 89756.2109 1026039.438 752071.25 626027.125 101100.9844 417939.2813 481427.3438 234499.4688 58460.6875 311528.6875 918341.0625 671294.25 2833481.25 2047131.875 317802.7813 530975.25 1263296.375 650536.25 1861218.125 1634220.125 1995829.75 746337 1058716 225317.2813 829445.625 242388.0781 226183.9375 323118.4063 531437.1875 3060710.25 520795.75 1220107.875 1948830.375 106932.0078 1374089.25 512633.875 5491783.5 1133912.75 559645.125 2281170.75 285864.7188 1413891.625 863714.4375 1415739.25 134162.5 1936046.25 2243015.25 327140.2813 975754.3125 391127.5625 304255.9375 999492.5 686452.0625 995801.1875 785278.125 762202.5625 660542 3736102.25 743403.375 210991.0781 218971.7969 681967.125 1400383.5 726687.1875 558316.5625 4978930 462252.25 1131325.625 709937.1875 314246.4688 1570300.375 1217140.375 419958.4063 202005.25 474705.9375 309191.5938 662367.875 685014.6875 810749.625 20945758 517310.4375 2052883.875 3542215.75 2343323.25 607381.5625 3515373.75 1245117.375 219891 1137714.25 1275278.875 758613.75 640702.125 577558.375 163946.3125 9012536 2394092.25 1214099.75 1724137.75 241516.0781 634203.875 710894.75 891714.8125 382287.125 2291227.75 9459220 1937817 272402.875 388417.9063 10533441 322009.5938 136791.6406 4424393 872621.6875 343759.25 352324.125 1019854.75 1204173.125 156237.3281 2282591.5 503947.7188 3283291 190812.25 420193.9375 97656.7813 1232864.75 273574.0938 702720.625 399744.5313 3388650.25 206834.9375 668898.9375 1733791.125 910236.4375 850499 2403965.5 158605.5156 813077.625 686852.3125 474572.7188 1875846 664968.3125 640309 256499.6406 5812800 306808.0938 1330984.75 544430.125
glycerol 3-phosphate 396254.5625 443841.7188 488843 404613.5625 552343.5 959205.625 872220.75 428325.6563 354173.5625 312704.375 478775.9688 491072.8438 264489.5 369886.3438 576331.9375 591912.625 440357.375 481810.625 576702 437973.875 243811.1094 401503.0938 824991.6875 510590.25 342881.5938 562443.0625 350456.875 454282.3438 458876.125 447079.9375 586372.8125 476293.5625 437731.5 754042.625 527588.25 498972.7188 745911.375 853781.375 429547.125 436795.0313 280875.4063 318176.75 463815.4688 669510.625 501958.25 537756.75 739266 487279.7188 406934.4688 425633.5313 778281.3125 883089.75 177756.6719 253131.4219 192995.3906 478334.7188 61302.4766 214273.3906 246911.3281 715315.8125 741985.6875 345281.4063 1453113.5 141386.1094 2951035.25 161088.2344 653009 282482.7188 774321 370834.5 1644328 193271.7813 172173.6719 127740.1172 3012322.75 349861 279913.7188 189698.4219 477701.375 1040099.625 294440.375 1056593.75 887402.3125 447869.4375 107780.3438 196238.9375 78513.3828 403609.2188 185502.9844 212677.8438 112365.5469 121425.3984 12976276 590665.5625 461062.9063 239783.375 529131.6875 672489.0625 327375.3438 186556.0469 204919.3594 441179.9375 472026.5313 156222.8906 122487.8438 442302.3438 214531.9688 230553.0156 224961.5625 136179.7344 327635.8125 308661.625 131248.8125 284317.1563 298498.125 1110716.875 332253.7813 3151488.75 267784.5938 191471.0625 1648241.375 2126511.5 155935.2656 527161.375 544835.125 311406.7813 155368.4375 159196.625 666339.25 184150.0938 924615.1875 331171.6875 133666.0469 658349.375 305368.1563 259793.4688 173781.5 409707.4063 184804.3125 2712345.75 254652.6719 381486.875 970700.25 435609.9688 317688.0625 135434.75 77353.7188 159153.6094 255745.625 183503.8438 154413.4063 534354.5625 212982.6563 246943.1563 3287428.5 263143.3438 2226144.5 2666649 444379.1563 120517.25 119125.8125 237966.4531 1208084.125 195726.125 188809.9688 228557.8438 216395.2344 173539.6094 1592608 98923.2813 121095.3594 320164.7188 1838950.875 413878.4063 86977.3047 152866.6094 258971.2344 121317.2813 437608.3438 132556.4531 325102.4375 466821.9688 125216.4297 1286782.75 388206.625 210462.7344 236709.2969 259638.6875 11161965 278489.1563 231251.1406 228623.625 112716.75 1594538.625 394860.9375 738191.9375 260464.7656 771329.125 1908439.625 112220.7578 2294984.25 1188397.625 276457.4688 174073.3281 340137.9375 275416.6563 365398.8125 438686 691064 365659.5313 290886.7188 180624.7188 323588.9063 213325.3594 127372.3828 164596.2188 5466364.5 193523.5469 488926.25 179515.9375 454766.1563 1508986.125 2256069.25 151070.1563 282068.5938 223515.9219 752991.4375 556146.3125 347689.25 330420.25 680316.1875 108515.7969 3002975.75 949651.125 559481.5625 333472.1875 531344.25 744761.875 357675.9063 349861 349861 198638.3281 331902.25 172906.0313 835872.4375 469718.9688 102163.6094 332872.125 162527.3125 445650.7813 641333.625 422866.1563 167126.1094 8912023 4607937.5 160743.6875 163952.6406 181102.6719 7804508.5 368522.5313 5752169 402613.3125 102826.9375 363652.1875 278111.125 3542391.25 162443.5938 122647.6953 98891.1094 468505.1563 323374.6563 182681.3125 161410.4531 408768.5625 218613.3125 159205.0625 115174.375 625381.5625 163948.5938 232480.2188 98837.6094 1105603.25 888833.9375 712690.625 197956.2813 361084.1563 220181.5 98853.5391 422815.75 493991.2813 258265.5313 193050.8594 132435.5 270041.75 205310.8594 516676.4375 384538.3125
imidazole lactate 2510681.25 2098497 4423768 2526738.5 2573559.5 10660806 2441511.75 3298448 5171372 20405828 4427487 2594652.5 7113041.5 4850913.5 8198813.5 3076250.75 3151760 2349943 4047336 5267363 7459002.5 6534882.5 6633025 4390781 6761960.5 2911353.5 4188641 8903385 5283613 3672761.75 1475074.875 3103317 7451232.5 3382790.25 6994921.5 2318978 3945664 4783552 4425257 3135796.5 3031707.25 4143947.75 2507513 3316098.75 3362903.25 2484043.5 6044467.5 3670561.75 2664605 4617491 65214056 17404122 5462877.5 16333019 102425616 11415868 5027049.5 8818794 3303190.5 20589182 41606260 6307889.5 123728208 7522699 101595696 2723193.75 35801072 3613068.25 12110815 14312506 43484524 4181726.5 10818284 5801716 80227456 14303713 5224359 10263910 28061248 3814915.25 28587682 31615940 48787440 43346160 3083018.5 27157706 3470361.25 17021874 6368201 3342805.75 6217381.5 2106593.25 30728204 22384546 6066572 52359884 219461280 45682148 89092992 3121224.5 5291046.5 20458614 17498382 4716018.5 4116840.25 6742453 10493671 4751367.5 6226315 2980635.5 7416626.5 21048988 10279903 5964688.5 9497078 8807006 6870863 83661104 19346488 13430037 34329308 71146448 7857216.5 75609488 70591520 12949201 8287083.5 29379120 25963686 58114136 17966986 12895056 7844771 35209200 13168441 2236376.75 11649152 10092559 4134613.25 127166640 6680860.5 8653404 23651314 52000848 8307781.5 3572301.5 13712455 5215633 50755304 21411152 15173781 21596606 2665823.25 13079284 86918584 12503601 4726075.5 9940164 25408666 5165481 4674257 14840140 12844825 6037278.5 110903248 20566760 10263910 9438459 26656070 8275625.5 8017015.5 11336930 67662184 14042343 2774589.5 5524269 18270690 10559032 8776094 10436644 3310061.25 39211900 4504354 107881952 24185676 9737726 31295896 9329185 8752490 51011308 34030080 28738106 5962695 22065448 20211024 74468752 3740951.25 34941212 146466832 6698049 13173432 3069447.75 15922749 106051856 5379596.5 12550035 12004455 4972275 11544023 30773180 24872632 4644790.5 4754949 35479228 22235292 4226554 5536047 242577216 32395332 18257002 2402525.75 14520729 217349872 15948504 6451882 7449832.5 6446831 13225199 3847291 25789090 83491368 102628184 13155552 34139148 23003858 3629591.5 30689896 96396344 62579400 3573952.75 23410812 24442684 11253332 11620319 5225626 10435261 30565104 84833552 6555557.5 16689772 2893377.75 4752021 15783016 21091538 8227908 170965344 15691118 27536874 2636022 5977583.5 38919764 20678128 3762366.75 121329776 14868747 5903073 16317253 9247523 25363910 6135424 12207205 7219936 40468716 4744162 12629885 3756636 8166730.5 3928524.25 6587903 14391211 6657460.5 2555176.25 9304668 12310192 24324836 21204732 43035232 8748375 85630648 16779330 6184457 10637824 38097600 14589235 24467422 6058622.5 24774448 7533955.5 17093820 10935488
kynurenine 14748588 12221142 21066540 23183058 14486965 23492886 16497456 20613280 21307326 46750416 19101184 22050262 22709172 11711421 16137690 25463438 19948288 22226342 23877652 29905484 16969078 32946198 29706918 22668110 27662566 17744858 43809264 20728278 22980970 25201348 23167080 14034484 24009294 28126306 24783924 14528389 24187620 29072312 25263762 26854110 22188646 34313632 20252918 29321900 42856136 27888072 26056906 17382278 16274297 24119694 290943392 130008392 61131852 163403968 43118232 162068880 30402444 37675652 20385740 257580032 61488384 45604516 126479440 49053332 229016624 19012898 102246336 18789044 93359008 10432166 249848192 42655796 46945028 32944304 290865696 183576512 19841756 39178492 59905840 125550096 99671584 139191792 141150656 70025352 23195306 95991864 15858883 63046372 50768728 43888352 30781802 45719556 224126432 121506840 86400120 161759856 189020256 187508544 201820976 10922807 160975200 82015480 197989504 35231824 18409574 116716888 106162312 23311158 38102560 31108302 54023280 214181344 72453984 65058284 35310708 53245772 67376352 105640608 115299656 107358408 353125472 84918408 15832485 261785840 472199232 81432448 115649632 72970304 33278944 221867968 109463672 58113340 41653856 171951136 85247104 28032420 67098512 68753304 38566580 221858240 32161100 63100292 276478048 208562720 23149824 26824704 42260512 42659564 198690272 79993704 50157980 102102784 17914150 72040616 543529600 81572960 84295736 65573256 46566996 31784616 26042544 22760468 127152272 96536912 61997296 194180784 99109216 102731976 41642964 102467376 62481096 62822812 270888224 89505512 27569648 16084266 30944768 54464564 17921890 56129680 65872388 294704736 49308904 130725408 160973232 25731832 333550304 45581424 48739024 128192432 100021704 57308444 16839660 103119936 14936237 269707136 29639792 89730128 369815968 10293680 350812032 23068024 162085120 79627320 34119300 99812496 50891408 23955344 130281704 126478600 62769048 105968024 49023964 245246304 56328372 95241800 114997688 97949984 61901300 86665272 141635520 50040940 529293920 101869840 82751272 16507400 19056386 25211266 30262196 49195356 49346020 37533096 39512464 268338928 138275232 32264316 31520604 84253712 49641872 20852808 40636332 67152968 73070480 39412748 31271950 17129516 23681552 98469432 35558340 38425576 16176376 107822848 95802488 46215412 42171836 123262536 34170648 128274632 20228008 26056906 119047128 47768820 19396918 43360940 76992840 41219392 55569696 64672264 12783688 35802396 27472042 43358784 88958256 15579017 27365946 24940086 122497576 60046116 35273212 43402820 26992120 21151728 40838920 53276524 108112416 55779440 49023964 26312994 92433064 50588076 23472254 43369392 85520680 56574248 21653180 16933078 44421592 57414104 135963584 80030920
glycerophosphorylcholine (GPC) 101821928 63839528 127956816 115767680 153791408 107372600 119319808 68699080 186472432 105158920 135557984 91841072 150716832 118637064 150780768 172776784 174730848 77521592 174253840 148330832 139852384 131428512 315436384 182140608 147166960 216517536 229657008 217023712 101199232 151487248 304317120 198660528 141258672 148706288 331359168 95784960 126274952 145897968 281331104 134298480 127111752 102270576 149664160 123300624 100699512 178006112 193839056 227796384 161744416 181697664 15314419 16164351 80602072 30815002 15193992 31969076 95198608 27049120 55107724 7647996 21146212 18992846 36079248 37280192 35469172 45051280 10424143 111309712 27759658 11198671 11374887 68620376 38679048 9865812 35885444 17181874 63703556 12128890 14101955 9830049 17145312 12596857 19579932 10848075 53951184 16895988 79925424 24897408 13911476 94288104 11039466 74725200 143753376 23475692 15218082 10518392 7172680 18974812 12065108 47107308 6839200.5 13676255 17112380 18042774 28381808 31764712 12781696 58102452 61832384 58416316 83748312 27388282 21222716 61340608 25006754 16899250 30637370 36607560 17057328 16239025 13073186 33361638 32008632 9636399 27952624 9513098 35198656 7850083 31380262 12041695 30496452 57210988 30104170 18607452 30166740 27742366 18923098 20467666 42426468 25040258 20907420 20610246 25044272 15583626 38667552 71076808 15892550 92675000 9266744 53118396 56215084 10093277 38290568 14010885 48067836 22775764 67058312 22865434 22896430 56637652 37630212 25466522 17338162 36368404 15445544 21662196 24287924 13469035 21559760 58985000 18163778 19420068 19908676 23477826 113584736 58402596 15526695 22650418 40564704 43896968 17169976 20330070 33310276 15549735 32215406 77926800 16346115 30496452 131814536 8164059 26691726 23151232 23061436 20636246 22012412 35141848 13298753 13461602 29752104 24390092 31840482 50847240 59524340 19333892 85143616 17159028 30442338 20301266 15072792 22850734 47711004 103619448 39746712 7269159.5 25872338 24496970 17471468 40799232 19712624 30619756 59875616 22134528 37917196 73504280 45618268 53610552 50753028 18900238 8519236 30000684 15259798 28549306 7930189.5 41771608 10714537 24883270 13524472 21374854 13621539 55977720 92018152 16914542 11992336 28939672 35404960 19752824 12426481 7212590 16404444 33882856 100590360 9218166 14015210 20244680 29997682 149934448 89482064 38364780 98213936 9979281 101934192 17315400 55349916 30846492 8221093 12836356 43275752 16849182 23044086 30826166 5388873 59729712 12989622 19917196 11920898 39408848 38836348 47945200 86238912 10522099 99885296 59520828 26650972 81867448 26294410 10120332 14799694 51937168 16384898 11622893 30187426 74550920 5043440.5 31642040 34746288 42657068 9748966 35062428 23205278 9657600
N-acetylglutamate 717136.125 321848.375 503471.75 912609.625 473246.7813 1433684.25 935551.0625 488135.75 540152.9375 982724.9375 508451.4375 727191 1003864.313 595657.5 580699.9375 954380 524205.75 825754.1875 558693.4375 668110 565327.75 609339.8125 746172.375 1066018.125 597478 801117.9375 988659.625 418812.9063 644755.5625 440021.5625 841590.5625 551041.5 632136.875 976895.5625 960221.875 663597.5 776044.375 1722764.5 525610.875 497349 512511.125 732778.6875 449425.125 493832.875 746426.8125 740380.3125 2383580.75 595312.9375 553771.75 630961.9375 1770332.5 5222047.5 824266.5 797782.0625 4558702 3500567.75 543276.75 945169.125 435431.2813 1856448.875 687988 579012.8125 1005697 483548.4063 2816766.5 442791.7813 927459.625 512310.7188 934598.5625 425260.4375 1357700.625 528075.1875 566907.25 654321.125 4229305 1197974.375 527149.5625 829936.1875 850919.75 1282318.25 782344.0625 1793435.375 2081084.375 1078229.25 618200.0625 1499559.875 332196.3438 561124.375 819668 487246.2813 872928 632158.8125 1696983 1113370.875 674549.625 971229.625 3448986.5 3365291 1865840.5 555928.625 480946.7813 1190837.375 928487.375 654160.6875 446259.6875 604219.1875 1002944.125 450232.125 391402.5 312593.875 586305.6875 3663020 842721.5625 928702.5 466038.3438 759005.6875 782177.125 723251.0625 750688 938858.5 1133834.875 3872980.75 294762.0313 2674580 2362757.75 755798.4375 766505.3125 1022715.375 1062071.5 1202951.25 1620839.125 1327884.75 752783.0625 1676843.5 979902.75 295884.0938 880562.8125 842013.75 384628.6563 2269094.5 372088.6875 1342352.625 2389445.75 967231.5625 441491.5313 601193.875 560135.375 596599.1875 1262430 506834 741799.1875 1056477.875 431371.7813 3148123.5 5821163 609687.1875 838218.0625 1507414.125 546736.5625 525777.8125 450851.0625 682060.4375 629822.6875 784378.0625 1483762.125 890875.4375 819668 1165564.875 1083502.375 542696.1875 1168420.875 775801.8125 2561898 771512.625 606544.625 706173.25 942665.0625 1224273.625 747754.6875 755616.9375 621826.0625 2061480.5 721030.5 2548403.75 862025.375 888312.75 587913.6875 1042651.438 3337739 1197158.875 1212472.875 1544584.5 532667.8125 2474655 843015.4375 3012498.25 408721.5625 1925422.75 3818992.25 467876.5 2108282.5 756514.6875 3340226.25 1092471.375 425299.7188 930759.0625 976181.0625 680007.0625 1083529.375 3017744.75 1201446 703514.6875 611569.375 1286356.5 1002814.188 517721.2813 501540.0313 10771898 690974.75 1308212.5 639242.125 764527.0625 3000619.75 616183.4375 863000.75 435570.375 837476.6875 712586.8125 954602.5625 668338.25 924219 1619768.5 585732.875 2041876.75 1692478.875 781334.1875 1222324.875 1405262.375 1426223.125 662421.5 513531.875 927400 1944567.125 532494.625 798845.25 743639.75 1576695 982201.8125 685796.3125 1394206.625 280699.4688 1034442 2772225.5 1884081.75 1146852.125 4613492 1900381.75 2068594.125 393097.8125 1191934.125 1744700.125 790131.375 322405.625 1467972.375 653191.375 840938.0625 560054.0625 969689.125 3678698.5 417912.0625 328027.2188 901470.0625 6582043.5 587132.375 860854.8125 382350.625 1043503.438 785260.4375 560752.4375 569451.375 763259.125 277776 579476.5625 2828058.75 1135996 1563588.125 1496287.75 470927.125 2190038.25 612081.4375 564387.3125 1350962.5 958358 1173083.75 653379.0625 373757.125 769796.9375 782990 4328395.5 1875355.375
N-alpha-acetylornithine 107172.8281 39288.1211 34655.2344 40949.5547 83485.8984 60381.0078 75967.1016 41198.6406 39318.3125 94975.0156 52317.9063 48982.4609 36448.3359 80579.2734 115766.5547 94571.7266 79661.4141 55529.8945 55418.1875 77094.3984 72927.7578 82143.2031 112158.4609 72965.7031 109899.1953 33858.7148 46726.9766 110778.7891 86005.3828 103922.9297 314424.0625 69771.7422 133195.5 120766.2031 265621.0625 122535.8281 214493.2656 46083.1367 109576.5 204532.2188 170096.7188 162232.3906 126850.0156 140690.8125 114055.8984 106961.4766 183045.1563 140291.5938 25889.3164 59740.25 26156.8555 284481.375 187711.5781 125851.1406 171001.6719 566863.5625 189919 236500.3281 20339.748 80543.7969 125840.2344 89075.7188 213941.4063 85506.2813 150807 146231.9844 50580.1523 82835.9141 23118.3066 93642.3438 224958.3594 94785.4766 61871.3477 144396.1094 194551.8906 223352.2813 243442.0781 222303.9219 113509.0781 105703.4531 285124.6563 58405.0664 883238.375 136569.8281 130663.0547 142383.3125 116406.8672 51973.625 184546.0938 182068.9063 115302.4453 96407.4453 76028.4297 60331.7969 71132.3438 63789.4766 368352.8438 52677.2813 271232.5313 344944.5625 111409.8984 71893.5859 163035.5313 135445.8125 82845.7031 41516.7109 92938.6953 222133.4063 79769.6641 189859.7813 168545.1875 127690.6641 318658.3125 115534.5 67779.0234 205149 226688.5156 163438.625 159879.0625 72803.375 315307.0625 112551.1719 127322.1328 157649.4844 36715.8789 62471.0078 73984.4531 29298.5645 227595.6406 387482.2188 354589.0625 46776.2617 224490.8125 52681.8867 131149.4375 151958.0781 133197.0625 89589.0547 258712 203802.5625 264142.4688 187554.1875 452054.2188 70972.2734 305156.4375 66699.6797 231870.5469 402327.1563 598261.3125 86027.9453 228199.8594 159712.1406 39604.9844 338611.2188 74756.2031 113472.1484 239232.7031 51853.3906 79028.2891 33616.9414 218622.9375 134031.6563 115534.5 47229.6133 186141.5625 179432.9375 145977.0313 416022.1563 46586.3438 285512.9063 322555.4688 136295.7344
xanthosine 238103.3281 756006.875 445836.7813 48226.4766 107234.8438 630896.8125 307261.0313 130441.8359 457355.1563 184714.5625 455790.1563 503299.9688 170128.5313 201942.625 306510.6875 154397.1875 502049.7188 277022.8438 221075.2188 218902.4219 152889.5938 190086.7031 298877.6563 177719 136615.7813 1434166.25 102966.4375 491944.9063 96541.0547 440455.75 95298.7422 67864.9141 239430.7656 414419.6563 297455.1875 173827.75 292993.75 131789.0781 132513.6719 698094.5625 187317.9844 181774.5938 155780.0625 586893.25 147117.5313 269838.7188 141730.2188 60491.3516 577808.3125 439402.25 435979.8125 100896.3516 182089.8438 200485.5 337823.1563 248600.7344 199970.1875 327471.5313 109085.8438 63579.9844 117972.9375 79104.1563 170785.3906 187043.0938 121230.1016 686118.9375 122576.1797 88223.125 250279.5469 71969.7344 354737.6875 226189.5156 192177.8594 323391.1875 89549.7578 62773.3203 80820.1797 235720.0938 270067.0938 754610 320516.4375 136122.8281 82461.8438 363024.8125 406808.4063 130903.8984 199439.75 139739.1875 165467.125 841986.1875 353227.4063 740620.25 112340.2109 897878.1875 86193.7266 204617.3125 541509.0625 305752.9063 111237.9531 306569.0938 196431.9063 208639.2344 200485.5 118603.8438
theophylline 2828718 5008059.5 677514.5 4794214 765741.375 1297585.625 5586914.5 1971248.25 4598148 5491057.5 2794232.25 3254938.25 472131.7188 2794203.75 1692901.375 1391433.125 1953310.5 2611593.5 3158986.25 776957.1875 5615124.5 3302000.75 9107181 2435130.25 2283707.75 876412.1875 904380.0625 5473712.5 2383935.5 15625674 1015343.438 364232.0938 3620389.75 2240342.25 4958641 3094930.75 2835565.5 196910.3906 4032912 2463308 593953.5 2956196.75 1146193.375 1606608.25 477513.4063 1160219.5 707624.6875 26232902 60931992 8188917.5 207708.0469 1012381.438 810053.4375 3629723 464457.5 2073182 1638290.25 2065049.875 2565793.75 881913.25 2135829.75 265987.4375 494314.1563 2070893.875 305959.5625 846198.875 502817.4375 406151.3125 327296.5313 477310.2188 613366.9375 391476.0938 3391794.75 639276.5625 488330.875 1309489.875 1716349.75 2374116.25 1406517.75 529842.5625 244498.1719 181701.4844 1608686.375 732751.1875 2616733.75 881445.1875 1136305.5 256809.1563 341725.0938 4908705 800202.75 84895.1641 330559.0313 923486.4375 316123.5313 1289702.75 1498898.375 471834.9063 89480768 618519.3125 4338692 2460920.25 3241212.5 3392741 832567.125 1258330 1531728.75 520881.75 2692752.5 718659.5 136044.6406 250969.5781 184694.4063 2148004.25 2328949.25 834109.625 231182.7188 1308750.875 943830.375 377420.5 313059 393418.8125 758432.4375 1451913.5 360165.4063 1794704.75 66299028 285733.125 143393088 1710056.375 153363696 1651715.375 447427.875 229253.8125 200144.75 1214774.125 398645.7813 509337.25 1184133.5 678039.0625 705055.5 383885.8125 723163.5 328149.5938 719031.875 1374021.625 2471363 8242564 320254 384690.0625 1385241 1369137.625 1621788.25 1583433.375 4031505 537074.9375 10769451 1160219.5 599744.5 748511.5625 932608.8125 436154.0313 1591357.625 3013320 716323.25 2988442.25 12176145 4876747 324898.5313 870532.625 841733.5 247574.625 105523.1094 381979.6563 368692.8125 630407.6875
theobromine 5187064.5 7881851 1924037.625 9337360 3699385.25 1685545.5 10534920 9004925 15442877 9769264 14779691 13155970 62480216 1865523.875 800304.4375 7030829.5 4794859 7523900 5714573 7042186.5 8122953 1165684.625 9245529 9269081 17693272 8478659 66639588 3503208 2001720 13927903 7211713 41332268 4219500.5 1370215.125 6398237.5 6527608.5 11850012 13129350 6470064.5 8851577 6479224 10895382 6381116.5 2083602.125 4051772 8968450 3357255.5 525573.4375 18790562 323825.4063 1108000 2429936.75 1031587.438 2673279 19644802 545428.25 172090.7344 2263144.75 12880590 3959534 8011748.5 28688476 64515384 134749.8906 3810026.25 41378016 20930302 14409826 3206494.75 541768.3125 35687320 1240271.25 2768744.5 1787279.375 10761193 1605988.625 10521989 1178199.75 5205100 17827808 7412076.5 7534859.5 10264157 179186.0781 5072692 2467716.5 2279193 20888878 4281776.5 2765016.25 6958364 457198.0625 8729042 40876328 1296004.5 67621504 9099748 3711842.75 4560056.5 14104487 13751397 1853453.875 13723746 82773984 22387458 14007843 18002630 845887.0625 947146.375 16264033 11795316 288129.25 21502288 6439634 13229363 270516.6875 6363995.5 1078144.125 10107287 6090357 14722303 9012693 36111944 3364501.5 7382162.5 1332451.375 21041190 3512481.5 785332.125 835269.75 4942605.5 31538356 4485484 4739671 6613321 26402614 29115876 45576556 10889711 5100120 4626835.5 325767.0313 676347.125 38302268 6641651.5 2101564.5 8604388 595284.875 12849619 4242048.5 3532987 20853402 628451.1875 17692374 26464972 3456824 2181705.75 5040313 1478916 14708509 795909.875 9906353 10380309 10711092 412430.25 88844.4453 21832586 30214174 333215.25 1488851.25 5968816 40215100 2567427.5 7320668 3459211.25 3491908.25 2752335.5 50530180 999402 7177040.5 4150631.5 9712506 3717758.75 24304896 15499844 754763.0625 9631704 5465063 9629997 1755794.25 34126812 3813113.25 22650650 3158614.75 3056921.75 717435.4375 3509670.75 902311.8125 6610144 1376397 1358895.25 5325798 4778878.5 1885708.625 31030396 1034676.438 3496296.5 6381116.5 48831968 6431570.5 341722.4063 937915.9375 12875968 6431879.5 6721576.5 1404598.375 350403.4063 1551302 10743135 15237180
gamma-glutamylphenylalanine 922806.8125 522768.0938 650854.4375 757323.1875 372047.4375 920893.5 669177.625 904350.4375 615165.75 958013.6875 700924.0625 563354.875 689994.75 484152.875 585043.125 744263.4375 495353.9688 916183.4375 627611.1875 658503.375 425071.75 985616.625 668059.375 847196.9375 650036.5 455304.375 874283.6875 334515.5625 675971.5 716549.125 401128.6875 344861.5 675614.8125 852680.75 650712.3125 216491.8438 727006.625 996241.875 487037.9063 599203 584748.625 851386.0625 442736.5938 719428.375 1165080.375 782218.5 1539967.75 409559.8125 824915.25 698208.25 6796686 11259232 2097216.5 1550396.75 8026815.5 3539576.5 1078399.125 1578477.25 786670.875 6524863.5 5782502 5262582 6812044 1783068.625 4193880.75 1460686.5 4805711 813600.5 3244076.25 1502320.875 27332104 1471807.25 3445050 1423553.875 6359493.5 3481114.75 1475394 2679041.25 1573885.375 2114390.75 2733334.5 15762825 11320675 1564481.25 997767.4375 4271862 858754.375 2584620 1901669.5 1233562.375 2895273.75 1294688.375 9623873 4140723 1818725.5 5078359 24826294 8031310.5 7552958 1076733.75 3552012.25 4147622.75 3386868.25 1598830.25 1132724.25 4572100 4158373.75 943181.875 939944.6875 1991059.25 2643980 9891935 3231760.5 1554769.75 1824641.125 1963463.5 1316522.25 1050159.75 3055043.25 3278266.5 10390105 2516453 1185365.5 20595218 20879906 6347246.5 1197691 1432816.125 3257553.5 3490101 2350826.5 3464060.75 1730085 7404475.5 3154556.75 1581448.625 2639494.5 2499509.25 734908.8125 10140211 2336664 1769985.75 21478070 10053843 3977157 636526.8125 1401466.375 2319214.25 11027500 2183634.75 2152769.25 1351366.5 734832.625 7591052 21613618 1322050.25 6944560.5 10455976 4182437.25 1581289.625 1679336 2008152.5 4585009.5 3375567.25 2066555.125 5805583.5 3640594 5857401 4262648.5 1543246.25 2919826.75 3814450 4625654.5 1396939.875 1338166.125 1688572.125 3165387.5 3075967.75 2208627.75 2727956.75 1466425.25 4667792.5 1543069.75 1972487.625 7225399.5 1598656.625 1472150.875 2921263.75 1751173.375 2744056.25 4461789 6009760.5 883234.875 6859362.5 769647.0625 7099656 645789.5 4925577.5 37094272 1542705.25 6796317 2081925.625 3711453.25 3564803.5 1597785.375 7658122 4912481.5 2981674.25 1204866.375 17180144 2530299.5 1793763.125 665868.125 6950491 4932828 1756335.875 1135955.75 16850546 2524055 6124761.5 1308393.75 5478137.5 2994423.75 1194197.375 2514673 1101667.875 1367108.125 9502620 661531.3125 1949470 1484480.5 2137947.75 4367503.5 7074288.5 5608944 1512852.25 5329844.5 3683501 1386182.125 1954439.375 1399718.375 3548193.5 2758194 1387722.125 1139530.75 1562306 1950656.125 6338752.5 3832816.25 1889499.375 619023.25 4198054 22110846 1692182 4191565.25 28690718 1517407.375 4956687 1161494.25 1609519.375 1963463.5 6972702.5 2245372.5 9303339 1505363.875 2204561 2313972.75 2050931.25 8783370 1051012.75 1547093.625 1861312.625 9682913 1626150.875 1386154.625 577853.8125 3857430.75 1117062.375 1608598.875 2118639.25 1339890.75 1222414.25 1873507 2769821.75 6339751.5 2941642.25 4561503 2311116 8269306.5 3118905.75 1161178.75 1894130.875 7843839 4095246 3138006 837409.75 2731499.5 1462801 6865713 1181720.125
1-methylguanidine 480993.1875 258733.0938 303580.8438 2039070.875 257541.9375 124275.3047 485079.75 1761211.5 4546212.5 377386.1563 1532234.25 8845130 1511129.875 177275.0156 717631.4375 33618728 348344.125 214540.5625 629442.4375 2943396.5 629065.8125 781550.3125 1064953.875 925957.8125 848712.75 1353220.125 482922.875 90699.5703 3402374.5 2062408.125 1696770.375 359523.5313 138430.7344 413083.0938 869205.125 77745.3672 118076.7422 2235038.75 364741.6875 13541686 939421.5 624305.8125 1311892.75 3310070.5 11943354 116338.8906 4099092.5 87230.5313 194316.9688 237872 1286770.375 287254.6563 680260.3125 295496.75 2100049.5 204310.3438 140562.6094 129194.9141 10976293 204871.5625 17114234 432624.2188 99115.0625 5493518 7973708 500449.5625 462583.5625 547052.5 923796.6875 144311.2656 1363683.75 20731596 1397191 4785411 47426744 400996.4375 938932.5 772248.75 9564894 340286.2188 514541.3125 16636175 541973.5625 1338793.5 371549.5313 433298.6875 309289.125 1071400.125 889001 147432.9688 7451056 13765831 729908.5 251085.75 233646.6719 488836.75 371904.9375 729908.5 1120313 10241900 415871.8438 43330000 11771280 1386266.25 1252211.375 17085574 106003.0078 2669981 661792.1875 697984.8125 202177.3594 2144690 2085790.875 687568.3125 305386.7188 25736060 406813.0625 419069.0625 1497997 1923617.375 495803.7813 1708583.75 11810652 355099.4688 18503588 2473766.5
levulinate (4-oxovalerate) 12598437 414831.75 181034.2969 569421.125 706473.125 443212.9063 442245.7813 314164.8438 496074.4688 528939.3125 422931.3438 357571.6875 472182.6563 231724.0625 844565.3125 369301.3438 496636.5625 196589 502536.9063 465270.75 386769.5313 286618.3438 355341.6875 371175.1875 429116.9375 536082.3125 371262.75 779788.3125 483383.0938 345197.6875 2605584.25 369360.7813 594589.125 705795.1875 322187.1563 320489.9063 387990.1563 837744.25 417532.25 511858.5625 1209545 586735 1087196.75 460188.75 332328.4375 469444.6875 222019.0781 338027.7813 453497.4688 966480.125 716459.6875 1318124.75 400024.6563 357407.0313 582706.5 586735 176081.25 648828.875 390155.4688 459942 264324.8438 611011.9375 528993.25 693207.625 205735.2031 352317.7188 567968.4375 636101.8125 470158.5 316330.0313 572728.5 684540.25 316447.3438 655551.5625 879255.5625 224047.4844 568951.6875 515863.9688 1825326.125 283902.375 533705.9375 1602885.5 817681.1875 694811.625 687582.6875 674672 277427.625 636750.0625 654684.75 617941.875 261322.1875 618950.625 605971.8125 741632.8125 808667.4375 871744.5625 824028.1875 884054.375 602564.125 297921.1875 457692.5938 840248.125 772058.0625 1043914.688 1298414.75 469542.4375 486092.6563 734482.375 465976.6875 1470807.25 619959.4375 405738.5625 596408.3125 643643.9375 437070.3438 761648.4375 750256.625 523452.5313 467558 332744 994894.25 918280.9375 1028277.688 866368.5 2614131.25 853857.1875 1738151 714721.3125 905466.8125 824162 572292.3125 741802.5625 982157.75 845881.4375 205841.4375 843184.3125 724567.0625 467631.0313 669095.4375 543980.1875 733011.75 488014.7188 992714.0625 628669.1875 256833.1875 334247.3438 427130.4688 758795.8125 816829.125 670035.1875 1032099.75 628103.0625 808889.4375 852505.625 734405.5625 436558.6875 365897 479633.1875 594615.625 327246.4375 347357.2188 658066.625 955301.25 538548.3125 1143311.875 697156 551381.25 421127.375 569134 982115 595575.75 420461.5 391792.0313 999645.75 299051.4063 323846.7813 377393.125 1147559.75 986481.9375 543052.6875 603481.75 972928.125 247745.0469 2229260.5 227965.1563 669019.0625 999433 1323227.75 622130.5 560013.25 1052582.25 531285.6875 374497.4688 685310.6875 579586.4375 420754.7188 752166.5 856643.5 485682.125 439646.8125 531845.125 420033.375 574071.4375 426287.0313 801206.0625 767070.375 356535.9688 827969.1875 616837.8125 413123.2188 527183.5625 765561.5 713958.8125 775318.5 985602.4375 525978 346844.0938 355568.7188 559662 623660.8125 701919.5 556929.625 496867.5 488968.5625 922947.25 445519.0938 1068581.625 580001.875 3020131.75 641589.25 490396.2188 452628.375 927237.9375 1027173.938 274310 223361 691948.1875 801513.875 419223.8125 319629.3125 453211.7813 794973.1875 551846.9375 641067.125 562555.5 441353.4063 504087.4688 766817.875 528498 1337441.5 531721.5 750025.25 1466997.75 616267.5 417028.9063 414123.4063 1475080 470693.1563 813638.5 442827.75 636845.5625 764083.375 2786366 593468.125 726843.6875 896214.625 398011.4688 1286866.375 535640.875 823377.8125 620106.375 192817.9219 733382.8125 481388.5313 987740.0625 603490.5625 627989.9375 212827.9063 481337.375 787737.6875 921337.5625 792873.3125 401362.7813 623273.4375 905280.3125 680980.4375 624646.375 230034.0469 560434.75 360935.4688 645195 996961.875
hexanoylcarnitine (C6) 2244197.75 2576858.25 1985333 1261083.875 779614 1119770.25 1289110 2235063.25 1990104.875 3593934 1789183.375 5333911.5 1411986.625 1097640.125 1622113.625 1797589.375 1746414.75 2739539.25 2625372.25 1183488.375 3341071.75 4070346.5 2174110.75 3754310.75 1392861.125 11081502 5576913.5 3494326.5 3532223.5 2453239.75 1351553.625 869541.4375 7731865.5 1815684.375 1512511.625 1794569.75 2338763 5123846 1339011.375 2558579 1183382.125 5238251.5 1485200.5 1637069.75 3660991.5 1548306.125 1998720.75 936499.125 3282084.75 1046789.313 23489204 14314657 2197941.5 9277978 55759528 5191800.5 864347.3125 6521534 1437114.25 5179768 19849698 10170804 40457424 3832913.5 20134860 3700987.25 9809545 2248623.75 22182552 10424712 25255094 4810260.5 7121963 2982262.25 26472112 22023268 4477211 10977866 11200328 18296984 20373618 55991440 38341076 33424238 4046178 11751582 3194066.25 42413692 5697931 3086758.5 9379939 4009273 54509508 15564223 5662887 20930046 22168856 14076560 13936754 2627701.25 3771557.5 15957251 22620830 6589682.5 4705947.5 4545533 8012565 4266384 3462092.25 8764468 11868566 12108366 7695186 8131760.5 5124101.5 9175841 8543296 105322672 30001126 11481499 18823840 62465000 2159933.5 18774802 15107950 15894367 8841847 14124756 4690392 45791816 8180571.5 6876744 4591424.5 30155520 6301615 2242007.25 12199396 5556473.5 4052129.5 122642344 7293539 6815194.5 52405064 26415204 5343825 862543.25 3716058 7561687 21456810 12758741 4832635 13274211 4580877.5 23052142 28691252 9493005 10201159 7493087.5 18235762 4886679 3055836.5 5902241 6050053.5 6038723 25010032 8919637 22229150 16849560 24257496 12333527 3806475.5 5372098 6136648.5 9332238 1182960.5 3200911.75 21098320 25067690 4789700 5531836 34334040 7206161 41512060 31810674 35495028 16372207 9604451 5794772 28281462 23286144 16502540 13680791 4411510.5 12866326 13100494 9143884 4742896.5 38119944 15422543 5996187.5 69515584 3486277.5 26923346 13393642 2013908.625 8920418 8057652.5 25069498 31681218 28483544 20076264 3858900.25 2166085.75 33558288 15194162 6769522 5835472 25805232 16947298 16671077 1355750.625 14501183 48909900 31590302 5708612 3241057.25 4972531 13977110 3728608.5 4476560 7548113.5 19810896 7534540.5 28260242 49611404 13822635 11251548 35473144 8635740 4369487 9506856 22725682 18029344 6985549 4725934.5 15121722 23051950 22390726 4631488 4226440.5 1689630.5 21786552 10528205 5387402 10917927 312426400 6907086 1828709 2890390.75 6595471 56445356 5442581.5 2846293.75 59600432 9062290 5876196 15545323 11373545 20552950 6520558 8429394 6378113.5 56985824 6941947.5 8051096.5 4171350 7548113.5 4733117.5 4851811 9203340 4359315.5 6309842 7426152.5 2600078.25 14549090 18606608 7716123.5 13543759 34719000 24126488 3428398.25 1189669.125 24052022 4879199.5 9055321 9867155 12013376 4723157.5 8921367 28408968
N-acetylaspartate (NAA) 1274151.125 772939.0625 1371847.125 585471.375 800223.4375 446872.5 505052 1349184.75 1420163 889129.75 1622427.5 972486.125 1171638.75 796359.375 851320.5 1319395.625 764052.75 881443.25 1143529.875 1149797.25 1137978.875 833007.5 1029866.625 946301.5 726553.125 1725627 775758.625 967971.75 618560.9375 1010332.5 868938.75 1204956 1015451.438 1265246.25 609213.25 1017603.875 1574861.875 1296477 383707.9375 882439 1205057.625 849806.3125 638269.5625 816353.25 789862.1875 1655479.125 340629.375 460071.25 3643169.25 2863975.5 693515.375 1067647.375 1406984.375 2296617 696507.5 591341.4375 271583.875 1598765.625 1734912.875 576666.3125 863442.5 630902.5 5607176.5 809800.9375 624139.125 747516.625 357960.3125 821930.625 764749.8125 648058.25 512543.3125 2801484.25 1346456.625 468175.6563 659310.125 844668.375 1107804.875 596995.9375 1705346 1379883.625 1003801.875 802790.125 990263.5 440742.4063 1158787 1157237.25 787780.5 1944223 605556.4375 739721.8125 1179136.875 2400602.5 2886668.75 1203599.25 1209559.25 1000163.938 769094.3125 733409.9375 775321.125 570835.875 459431.4688 710228.4375 445371.1875 2731499 695143.4375 1012726.813 758350.9375 1169150.375 751263.6875 1152506 770967.875 812627.6875 1240056.125 4281867.5 601199.3125 1327249.375 720090.1875 849396.75 582647.5 1066457.375 1500426.75 1532063.375 765874.0625 1576334.375 557622 1818199.625 501641.5625 1035973.438 638082.8125 485767.7188 2883789.75 390292.3438 533703.75 1058881.125 713077.3125 298455.6875 613912.8125 678417.625 443053.3438 1587392 580723 815454.0625 1537778.375 650140.125 3107114.5 2296188.25 853341.375 961825.9375 894195.25 576467.5 627901.5 334733.3125 825521.3125 992367.8125 900539.4375 993636.25 658005.4375 1580809.125 403222.2813 1230795.25 775478 510112.5 889975.75 919718 853454.5 845747.3125 605144.8125 822068.5625 795444.9375 522878.9688 1040666.813 1019128.188 1146345.125 796077.125 1024204 1250563.75 627131.625 1623393.125 527256.6875 3357482.75 1173772.5 948398.4375 1705872.875 583258.8125 1116184.5 1316194.125 413699.625 2739221 1577789.375 622841.1875 1392988.5 661787.25 2184938.75 1088347.875 747040.1875 1034343.625 956997 1013184.938 1943987.875 1023964.438 912408.5625 934713 339483.7813 1112684.625 692571.125 744315.25 596079.8125 5284285 1236735.5 602215 1196988.75 567661.5 1812454.625 706883.25 1011103.375 712091.375 873637.75 1582759.375 2058595.5 1552363 740357.9375 2524044.75 958317.6875 2334733.25 1766286.875 883111.4375 917960.25 1429803.75 1481620.125 825474 1119890.125 1393541.875 2918593.5 972966.4375 1365667.125 652479.625 1930214 1264098.875 1311978.75 1555860.75 541972.875 1487486.375 6530836 2638900 700333.4375 3485213.75 1755673.5 363483.6563 1150213.125 1874460.875 412494.2188 408413.1563 1561181.625 846825.1875 861749.75 725628.625 950306.1875 2707055.75 1285660.375 578063.8125 809671.125 3036684.25 775382.4375 1107520.75 291797.75 496090.4375 375624 865262.875 710325.125 628245.875 632946.125 1450940.25 4027559.25 2139893.5 1320348.875 2525921.25 550475.375 1196483.125 741817.6875 1121730.75 2331068.5 1101708.5 1311099.875 489739.5 614351.75 896903.8125 690619.8125 1590560 1931450.5
acetylcarnitine (C2) 329441376 294384736 234383488 219880800 254514528 645813056 275607968 277858464 186920304 379151776 284913792 452175648 323261312 154614992 289413760 387412864 321955840 388930400 277139136 426661472 659564096 466808576 238999952 477165888 262621776 544317568 474153760 342764384 394077248 243543344 324199360 262243152 565168256 308773024 305467104 278846656 379605472 482697920 232266832 347130656 197959424 436394400 196995488 266796192 437327520 250510528 540540928 212574160 324243520 280078592 1647728896 1187047296 288018624 826532160 1652874496 638837312 157565888 825481472 139480448 365857088 1149227648 572740480 2439040000 525339072 1492611584 437196000 614243456 182143040 1763814400 622133632 1406144896 321769024 765798400 636651712 1774111232 1674760832 453950432 504751328 845090240 1025493632 1492183040 2606689024 1542503040 1946812416 336828864 1264379904 194265808 1289022464 480399008 404752032 732700096 268371696 3105791744 1479000448 855608640 1205454464 1437585536 1689930624 730363200 227985664 307801664 727080960 1879510528 563675072 381220928 900593344 535062176 381188032 212730144 589184576 716085824 1816523264 517357856 862470016 471291040 895400640 1251874944 3763970048 1749397504 684817600 1295749248 3149475072 238820912 1678336640 558657536 1494935424 960133120 503515072 442029600 2032814464 529107680 288221952 442674304 1720436992 613564416 470059200 1154659840 530442112 173282912 6296963072 359716800 808101184 3340738048 694404928 406302912 139267040 466511296 582980864 1387242112 400701632 401620768 758071232 802697728 1994534784 2708577792 601098496 829835200 650065216 806137408 223802624 454267264 678240640 297295584 672824064 1352112128 594322304 1933124608 1535304192 1179050624 459845504 530875488 470822464 802704896 1452832384 145660288 280853280 1197504640 733785216 395926528 414571872 883337280 491646304 363823232 4745167360 2510035968 419234400 479348480 621697216 1856534016 932214784 1876660224 676357248 595317056 1004408960 500146496 1406753920 348181056 1352235520 389740224 425422592 2411787520 302785984 1264586112 690196672 136649840 262876208 497792928 575139264 1267430016 1795487232 1180068864 215898000 665473792 3091540224 884885632 545310912 433208704 1498971392 1308031232 1133352704 233069328 646745792 3278390272 1857805184 1150190464 611619648 750997824 1664939136 377546592 628087744 496240160 2236643072 568816640 1275971584 1305587840 545792128 1006395520 2750331136 882567424 391013376 528789408 1264381952 1329277056 315582784 295746080 899751040 1645218304 997253632 328941024 430094240 115548912 952121984 884490688 498508288 733547584 4564822528 893935168 238587248 186260976 380151168 5570216960 528936352 291847744 4102067200 457204512 871416896 711179456 1165357952 1054562240 555699136 1601707008 640531200 2396715264 762158976 292965792 572740480 550627520 509540128 261875136 454276512 477971616 440603936 508816064 323981952 981680000 803485760 415576704 333535872 871339264 472481920 491700192 350137760 773491840 488652736 529143008 576664320 1018251776 645100160 1192403072 1405105664
trizma acetate 10850524 482590.6875 21218458 10850524
"2,3-dihydroxypyridine" 1098387.75 980234.1875 692674 99377.5313 825306.375 726625.875 185064.9063 1067975.75 376308.8438 189143.5313 87841.4688 475850.2188 301018 811894.8125 480219.5 588922.625 718956.0625 513166.4375 269476.8438 135175.0469 417034.625 246404.7031 2816096.25 227676.5156 513146.8438 881745.1875 258128.5 1085299.125 194218.6406 82383.6484 168117.0469 261209.2344 77585.6406 94051.9844 167306.2813 350620.6875 87528.5859 107947.6563 176749.3438 314578.5625 268084.4063 191938.2188 149058.8906 59172.5586 159787.75 85269.875 131412.2813 97138.2656 277319.1875 508878.25 383949.5625 383459.875 275486.2813 402618.125 262819.0313 88968.9688 83908.1719 204006.5625 75093.6641 537734.125 392316.9688 231927.5156 28179.2148 116820.4922 58702.3047 159255.4844 171528.4063 486619.8125 155237.9375 1810340.375 3492367.5 2264418 111436.9922 160311.2813 154450.5469 232352.0313 228242.5 171401.3594 520118.0625 413669.4688 113837.3281 897959.125 288296.5313 126412.4453 112719.3516 252359.7656 337470.6563 466218.9688 198115.0938 50335.0313 1272923.5 434415.0625 174516.1875 129991.4688 95153.0391 234678.5781 159531.4063 345307.6563 515507.9375 263897.2188 302010.1875 360905.1563 250270.7344 293834.125 198943.5313 103182.4766 404058.8125 71745.6094 203450.9219 298399.1563 588870 199521.4688 395506.1563 324907.6563 363677.2188 395632.4375 248918.0469 386471.9688 363789.2813 273084.8125 127657.6484 1209046.75 244698.4531 152703.0625 31728.2637 383693.3438 186133.9844 235392.7344 100873.6719 375522 517615 258128.5 315787.3438 1065115.625 413582.5938 52770.8555 427481.1563 107152.8281 144430.7969 228965.3594 86884.2891 292150.75 31859.7969 71061 357746.5 395923.3438 62069.9961 2219993.75 138279.125 517571.5 367677.625 226285.375 612623.3125 47603.1367 179668.9688 301337.75 563473.5 149027.8594
iminodiacetate (IDA) 136942528 182652352 135830112 137207344 128933624 134218880 124502384 120871432 167577440 121946016 111550256 191767056 150702432 115185960 133306048 139947040 146464272 148197168 139864352 127846592 120271560 124094632 188394224 193328128 180791424 185204064 230166768 155882528 163773168 125077344 187553616 178000592 179181952 226425520 174271328 358148320 213453920 190652096 187557504 233078640 273643456 197206224 245161184 305292384 295905312 346289088 131794984 168288240 230887904 143690880 260086848 267241440 281928352 342106048 329766240 273288736 346205248 358669952 254163376 220103200 286072736 373964128 292281600 303926816 211731040 327341120 346933376 267163088 248497424 278947840 295042848 311964224 309286176 239839888 182731280 327895520 342128576 303611424 274072800 241762912 256951072 229681216 351910656 340993088 269565760 247560384 254098176 247512064 347413632 322972384 234517440 284690080 320722944 276171264 263053088 295223200 300757760 245594304 203973744 243008736 268579040 247030032 244997568 324404832 249565744 209281680 258867856 323155328 313684256 303870912 288218176 273664576 339332864 266254880 268614272 285357888 292400512 330601280 400593376 293236768 387884832 208050752 273643456 278459648 365647200 320674912 320726656 299894336 294213824 307446144 283770784 277136160 396015520 292215648 424784544 398736256 353586368 421787744 397961280 421305344 335736032 385386464 419216672 380946560 501689088 455260928 354404928 358412544 244486944 306257344 295540800 278633568 274310944 210677488 150830080 220987648 242871104 253844688 233310880 279347584 306257088 354810400 272667424 352729632 354301376 457535712 445388576 356413120 366711072 265557968 117287880 262974336 330494848 399593472 374251872 430480672 393797696 333563872 345151200 355357216 353633792 294382848 314334656 288769888 279298144 152399040 141142352 278910528 147177840 122528568 139118736 123896072 122050328 133887088 154529904 117374352 148566272 138892656 268831520 144391312 101570848 144372272 378124160 189431200 136546288 208275392 179247616 190003168 215876320 264657792 385535136 434909056 291021792 351315712 212159376 261158224 281975136 91332024 230700592 445329120 108357560 404530368 290844416 158643648 284108064 300412832 314468448 237064944 280034208 270294368 321744704 500210304 275669536 431099488 443166112 344516864 345253664 346044416 251534048 367580480 107678952 250802256 135187024 373251328 303855392 172523392 125258824 258538096 231938336 257906448 232774080 428680032 200058176 299124736 336280128 299748448 236047696 119295384 318384064 418722208 642217728 229871632 327528384 316523136 259548208 256069936 391860672 269289376 333165824 239497088 241084448 185464464 186829104 248593184 260483840 253344416 492726016 421263744 375859008 278369088 429316576 258455840 235440848 276385888 348738560 439883872 287544704 361132256 255089472 333186592 359404000 245995680 233787280 295459168 413264736 286676512 392125568 332329792 272975968 268132720
homoarginine 46336464 21944526 76136976 20745044 22251206 31170206 54718520 40163940 67670384 16619249 54721768 29369054 83480200 11676935 43373732 36715772 33226378 33721812 34709688 36934904 25240508 30187826 20277482 38750732 16861374 55432252 31876862 48283888 26698612 21289284 50308568 28925444 19959792 35642660 31967480 33317680 54498444 36666064 32965160 9610214 17373018 12546176 13744496 16902062 21518306 38541508 29843230 26309912 8735797 37987412 23911288 22098402 23356940 7091910.5 14140649 5690689 20843570 9195197 17305562 28385184 9216618 6529035.5 10027334 4479478.5 8490528 11732725 8466676 8302722 17430624 24219080 3446775.25 16398255 10305737 3980254 4796675.5 6590246 8422961 4958850.5 6683885.5 12155675 4680797.5 5626433.5 9462041 11640674 16172143 6415589 8588629 5204596.5 6595087.5 11958489 10858882 15883372 6679042 5455875.5 24256368 44808436 19850358 7793878 9643845 4009288.25 14722504 4037670 8052749 9401441 9024887 9675039 7974973.5 9020339 11367485 7083126 3089892.75 11262303 8304701 4342350 5789631.5 7709726.5 3280772.25 11672807 7693859.5 128545016 2012975.875 6106592 19797302 16469634 28517680 2419293.25 12418301 7615690 15800079 14416144 7021291.5 8636269 14781646 14275699 5872274 6683640.5 12733010 6380018.5 7972534 7960671.5 14060286 103195728 12506434 9077560 16413661 8638968 11773419 7015466 7855036.5 5936563 10471925 3008677.75 597695.5 9701354 4600847.5 8624883 8546941 6617938 7981637 4195657 3893344.5 8091613.5 14936820 11710153 54502536 16448173 20917818 33537006 18140616 33698124 63988164 10506974 19350658 20553770 13243352 19795736 10683144 11010584 11741194 8610752 15676127 7492410.5 4710832.5 18673552 9692100 9260223 6118166.5 18820536 19083836 6605423.5 20872384 4733499 32853738 97867632 2471003 3219714.25 20139404 14023900 6777503.5 7276156 13219720 6818606.5 13305213 9058954 9788265 9766823 13540798 3728561 12574006 11380552 5947157.5 6393095 12815974 4792389 11105725 8338046 8224106.5 8511899 3143601.5 8477554 11233891 9772135 16774654 10069716 24950226 13692774 8527619 9766985 29033562 20495514 71428992 25007328 46382280 21695830 11699508 24508860 20092518 4506197 38695296 8949574 8329123 19621256 7309030.5 20573674 11396283 88249928 14186209 21118954 9014297 21360568 5574275 6761947 15821686 14432734 606875.875 9815750 11374441 5099031 20301196 17542016 38721764 12870241 14145575 8681525 29446562 7310719 26682496 4890514 25452706 5452139.5 6898568.5 7486456 2454108.75 9890171 11704830 19248936 35986020 42592788 10064544 12295655 7709204 6428040 10042865 11736490 18530888 3692108.75 12465717 48846720 9598927 69819072 6229136 35903124 1304780.375 50091444 9547827 5846283 2818187.5
3-hydroxykynurenine 456925.1875 71245.5859 220175.3438 2271983.75 88186.3047 2772476 313619.8438 2517750 3914796.25 1474614.25 129424.8594 1566479 617519.5 817933.25 770358.1875 2531244 251834.7969 3946834.5 7269839.5 696065.9375 1300517.625 3533571 1013198.5 2886356.75 412833.5938 775054.3125 3812147 3762801 8894547 2282089 1979446.25 431119.0313 1714919.5 728085.5625 288403.5 1626653.75 566720.5625 1074083.75 2799212.75 1434275.375 3829483.5 2413765.75 6598001.5 5430020 7596012 14206625 9809119 572391.5 132618.6563 2922019.75 697075.9375 119961.3203 2104369.25 654811.5625 5779771.5 6028255.5 1170739.25 1296027.875 2438472.5 413469.9063 777293.5625 3947319.5 1596895 2004729.25 756248.75 11077705 7688717.5 1315338.375 2343983.5 1593254.75 402201.625 8570420 2515081.5 984547.4375 696309.75 4656260.5 2676259.25 3128525.75 1059759.125 2114344 261439.9219 2928940.25 710622.875 1228229.625 5529850.5 235183.2969 171040.1406 724689.8125 619157.5 7389486.5 10301410 1356932.875 10971851 1180917.625 13751479 4897715 1182199 402468.9375 989460.5 679332.5625 1187244 1357664.75 2936077 1616819.375 4785473 3802840 1610178.25 2093675.375 2035279.75 725693.6875 1967784.625 2185854.5 454569.6875 156211.0781 2305121.25 2032938.125 445531.9375 480755.4688 693723.25 4109723 432224.875 5021953.5 5527494.5 762226.8125 6113871 1156938.25 8565165 2245417 1916271.75 812371.5625 8597494 2736755.75 499533.5 448179.1875 7270998 1567525.625 1140650.25 1542883.125 249361.5 724723.75 1809118.25 2094797.375 609551 1470236.25 4618993 21254318 6813600 3146004.25 597660.3125 1641524.75 1397413.5 2679568.75 2576077.75 3243681.5 760971.1875 583971.0625 167891.375 443162.5 483188.4063 842001.5 2678952 147241.9219 1473773.625 148919.8125 412965.75 863027.8125 1453563.5 868972.3125 450393.625 176208.7344 1012476.563 862502.1875 1417610.875 150805.0625 1484418.875 1321124.875 1134339.5 1231781.75 28170290 1294731.125 159871.125 431747.1563 498759.5938 377128.0313 165282.9219 1129446.75 2168858.75 2381299 492297.6875 1182976.875 927365.4375 1307928 843684.6875 458159.4688 1416984.25 591283.375 524304.625 415553.8125 1950994 947590.8125 531536.4375 163309.3125 1256429.75 1224175 561163.125 1191325.625 1745555.375 1702581.125 1994400.875
guanidine 2204945.25 63485112 1043515.75 396027.5 1137231 565478.6875 1137231 116347.6328 2158114.5 25811272 68419160 321282.4688
N-acetylglycine 2583448.75 2191278.5 2387515.75 5335138 2319865.75 20091550 2739458 2348334 4929633.5 5362530.5 3064747 5688778 2876343.5 12317444 5844690.5 8257742.5 3854502.75 2666990.75 2803413 5544166 8228125 4575648.5 12897406 8078307 7603572 9825209 5886206.5 3775693.5 4217091 4050252.25 3581759.75 3313364.75 6817212.5 3252481.75 4331315 2980708.25 6287324.5 7046828.5 5638438 2847729 5496460.5 8457983 5333936 3996103 6184752.5 3788169 17330568 4734741.5 4288173.5 3853004.25 6912243 6434767 3751042.75 13254153 9891314 27914842 3646397 5067301 4159094 5496460.5 5919924 3553671.25 6673227 2759774 4951818.5 5340769 6020791 2459166 6957149 2413786 8739095 4043216.25 4225939 5233497.5 15303913 8696594 7283748 2757076.75 7898330.5 4450279 7110805.5 7668553.5 7194828 4338998 2175158.25 6227529 4640808.5 4086961.75 5511585 6167465 3674400 2387645 5280198 8827496 5134522.5 4776318 6244629.5 6609623 6044474.5 3998851.5 4585617.5 4815168.5 9363495 5272875.5 2927521.5 3680136.5 4561650.5 5186070.5 4955761.5 2604355.25 11430368 6998877.5 7327928 9191313 2783901 3853403.25 9528749 5291836.5 6086885.5 5178023 9059401 6784708 2914530.75 10751878 8092472 6403571.5 9117859 4794558.5 13681122 9729380 7543093 5580094 7811531 8768101 7813400 4398617 6032702.5 5632125.5 2567114.5 4498380 3357056.75 5303409.5 10356687 4925784.5 3361005.25 4448943 6606447.5 8183407 5568071 3478018 6910317 6267573 9756673 8845890 8236732.5 7796968.5 4030929.5 5566979.5 4522098 4770253 18887192 14841474 3371165.75 7489507.5 5124603 6344217.5 5886588 3901037.75 4741127 3202247 9526636 2674426.5 8962536 6651755.5 3682611.25 5143187 4895592 4783069.5 6799091.5 4245980.5 6037175.5 8048533.5 29245108 12994520 9956109 22047084 5097910 22068086 4184877.75 5119086 17328856 10197021 4302650.5 7321059.5 3508329.75 13521470 3258333.75 5715442.5 10436400 8037913 8146706.5 2827012.5 6158112 9070901 2586426.75 3525007.75 5064593 3440093.5 4148140.75 15885166 5014610 3752800.75 17104802 4653500 18260836 3354894.25 4045438.25 9385399 8033333.5 4062800.75 3937177.25 4282257.5 10414507 3242301.25 8108066.5 11405936 8835907 6651577 4996232.5 4363753.5 7603132.5 3825102 3959720 8480014 6397709 5067280 5335372.5 10063774 7988795 3679500 3936729 8723227 4783613 6138759.5 9310328 3381985 4656036.5 6377405.5 3668879 6293056.5 3774822.25 3685605.25 11710466 5782370.5 7606651.5 17916922 3861001.75 7335424 3576952.25 2846969 4530017.5 3418486.5 5425942 16427614 6934565.5 3786985.75 4381746 12703570 9880590 9530577 6786756.5 5211016.5 7763678.5 5362571 2875985.5 10733072 10786402 5484188 4442424 2712070.5 4024799.5 9728393 9365845 18719878 11388572 8263439.5 7099154.5 3565041.75 5847208.5 3641850.75 8818651 10641936 4639253 16372536 4014527 9536110 4008230.25 8520219 12797375 4286568.5
1-methylhistidine 23420444 16863794 41158300 19063844 15679234 58761444 16264987 33382670 39425772 98012336 28593716 19979904 41126296 20621248 23332852 29203906 28539214 18731882 24316428 41451092 23997296 37054416 51872592 42009992 52250024 29296416 35205776 26973210 39416816 42996284 29056956 22083728 55314464 61893016 51117344 19040766 95633624 79151528 34017908 26276728 19085278 58556456 28427026 43250892 44664580 43054592 42429916 22810372 27683976 25715824 386845088 143303360 54232456 133252008 173277040 162904896 22768044 17758496 17302938 296690784 158194848 54245288 234228976 22338172 307301600 19104758 145925616 18827214 177268560 88004648 161504128 14672676 30724590 32529516 486724128 129870832 26145776 58556456 97862720 99771144 186873744 335865728 144876896 121969520 14994205 56155208 10673257 123922952 27131990 12838232 38166852 11486796 105174320 230576528 72849744 88745064 213924768 223822176 164971472 10253952 51121644 52474384 149518304 32135852 12625280 172531344 79960200 16355689 19949938 14217710 84616832 147045024 58097000 43315420 33125016 50478004 83026832 133524200 53558312 57400440 134597440 311093824 18018418 253502400 155388560 71501240 41697644 96914752 183241792 222174960 40867840 246428864 33061414 232396080 27408104 13298096 93035824 48024168 32610064 325440928 58581968 52562504 156084288 134073648 19533788 14128953 36158764 23826876 372324352 46520896 108144968 223031264 20904708 99351080 384050784 76360144 28578094 55150864 79392752 30491566 38764612 39268076 83646832 27963306 457271616 93175648 139369312 56067780 73560872 67484512 41553736 37175440 209660960 72540632 24710504 26587848 129662424 69319256 24438288 58530944 34616684 493987168 46049112 387033952 236954080 24441190 180460144 66223132 120350976 189682048 90820472 241040528 20586816 114149192 81055112 618196352 53266556 243156000 400897568 71603104 941755584 12411470 55065508 97798344 57794512 29193386 46576412 40229536 223666448 168538704 80708336 25219262 31385894 138606864 184714336 53154196 32127598 239207232 142627408 89566176 169826976 30590352 707077824 177978752 49586708 27027286 28726252 181453360 76658984 67796008 90360672 93305776 40482500 237493664 284757312 120013608 82231824 371265280 374306976 22762876 136201456 181368608 82790472 119037960 54092944 51527476 85432768 198189360 117642760 177773136 9693952 119042088 489059968 249460928 71159360 186859408 97755688 200766640 16973922 46591860 92125048 64685248 19506966 192428384 100180360 31960666 53105016 117749520 88915872 36613364 255691616 31785956 247161904 23012834 40268076 17951964 406961504 48088728 31580622 56410868 32274562 13354575 109505608 127292176 84110200 97523264 160366080 30193620 204698832 98911664 30905956 65196400 72657656 299705088 30851762 91701264 52214060 45436128 362042592 473711616
butyrylcarnitine (C4) 11779310 10903775 6542030 7827172 8964810 11598425 9824382 14841513 6231132.5 7153264 10943079 11121944 9460698 9841309 10733918 12287445 8991046 10772455 9516508 10279596 6641840.5 19933500 11457742 11611101 21107420 10116213 8514432 6191300 10110013 5289195 11049596 5459081 11038811 4991367.5 9853628 15032813 17229896 21237682 8785855 6244956 5238144.5 14728563 8278392 10690706 14933035 17554462 7671362.5 7414591 12825491 17425624 32581194 12607229 8843051 15695943 85632720 9952790 5796844.5 26036914 2771801.5 7509685.5 165102496 16359392 140997584 10333443 29745486 6230334 9600630 7865606 38899936 21775452 30551030 8967915 32967942 4816555.5 34891536 32797568 9414301 12679106 25801180 24108140 36037400 75763304 36686976 39950824 11561455 20372030 5046156 49437444 21559428 9572943 19097534 6955588.5 220522224 19034182 7865669.5 46603452 43479760 116604400 10332471 7849496.5 5691814 23343134 26729008 13429929 9855379 14618747 11517075 5009848.5 12608185 14746044 191011328 10327004 11716109 15250515 20852890 17254286 14700510 99033104 51336940 19557734 36717372 82521504 7877043.5 45606384 10818987 47550496 17928652 13619098 10705363 27764406 10004322 6066769.5 8575992 47012700 25202246 6989983 26148934 9016089 5718510 219864592 22052818 7587956.5 58474104 54310840 11115515 5632922 5443175 21890188 33680428 13367570 8322209 17532400 4845006 22222144 30499716 22666260 11756462 11198944 22201574 7439030 6148133 19736028 7550951 6936299 27380800 13814426 30764700 22923050 73465400 23587130 8376267.5 10682687 5140635 9323593 9265639 16806414 19058110 5176652.5 12727185 21327008 19357276 20219936 39005668 46676160 10030047 10046034 10601560 53045868 18611712 43943116 16743045 6584250 18948230 14233243 12325183 8623164 29222388 12988047 9148366 32336884 7231954 24819004 15489761 7906329 16075816 14580068 99184120 86776576 87495064 39590008 5661504 4749213.5 49665764 25624478 18532994 7753893.5 22024462 137845456 30384780 8542988 56556568 36250304 48553928 8002480.5 14580068 9344744 34181380 10300111 50912736 29838718 34316808 16018299 42540460 56303096 14926893 18221386 73085088 3710687.25 17262778 16284257 31451214 21385366 11058283 8191795 33947540 27769840 19229556 6456261.5 14906750 3444635 36432852 11278540 18725578 150862160 14170443 6798824 6883154 18892638 314485376 13946047 5371652.5 131011432 12867622 8953187 19834050 18118316 23512098 9374417 23275500 8731389 69089208 14476054 12572364 8256869.5 12623372 8919898 13930290 22957268 20075822 9702253 11881030 7774530.5 22821070 27616992 10570882 26713790 22921534 21286762 6599586 24762528 37516296 12622251 17356840 11000868 21936346 7059823 10141601 49422476
isobutyrylcarnitine (C4) 3912570.25 3006876.75 10639007 5893600 14075287 10339990 2672828.75 7433297 9263113 17604622 7451186.5 13186131 14806053 6836929 6428311.5 4373817.5 5217351 4777291.5 5981354.5 4366662 6515587 19313114 17712910 4336041.5 31184002 4411203.5 13918232 7886938.5 13250827 8274803.5 4010679 7924939.5 19536292 22058770 10853834 5250423 5656911.5 12105479 9681299 9976802 12262326 18950734 3465212.75 8596396 12283217 9015634 4375034 7042912.5 12837710 17476466 49145656 13638865 7699106 13723134 42175884 20925064 9800119 11116831 3020604.5 17319794 9142145 10186206 122408496 12913370 71357984 3629039.75 28014832 10140285 21156676 11371099 29850336 6953011 9644435 3755307 45923784 30563602 7820192 9352764 23330658 31300686 36351748 25349232 36332464 28547160 2525459 40836504 10405343 47825168 9603490 6112650 5441989 9646041 57172540 48673352 13812619 22654078 33496230 60644560 31436358 18198092 18737850 17378532 15984054 7317400 4144224 17097040 11190809 8801648 5085645 3213574.25 18205438 25204904 10827453 9871183 3235086.5 10137174 15422836 92440280 31403440 11782210 16929628 75695456 17130164 13989024 27303610 12093978 23790616 12917063 17626530 38268136 24766972 42571204 10901770 24866490 9432922 4428920 42691276 12575914 4996391 325012800 2505323 7322832.5 56264932 36617228 10060772 15370130 5584835 14799594 51401916 7964139.5 9737950 14685820 7444845.5 13488677 57622376 18027366 6550605 9829152 11876086 4326125.5 5350578.5 20628904 15055276 31382548 22424886 9813875 29958544 9101435 18299160 9874870 5961444.5 3069429.75 10480264 8566136 24815998 7560049.5 7529333 10169357 10304046 9553529 14473650 40745840 37221808 34329028 27536696 10622417 37988740 8779999 78326984 20138828 14769620 23696024 15775631 20876696 5166645 29470248 5398223.5 22352944 14021321 2474888.75 82897016 6241540 49558228 10372889 5645029.5 13307325 9189975 5216977.5 78279040 14612245 43601740 3841092.25 11743824 14212238 28855182 22266778 11044941 17260734 9912099 37123260 26953694 8260250 78867560 80319872 22929220 4753220.5 6000475.5 64601328 12104884 8807355 18401442 11805479 5954761.5 36723896 43926208 13661303 9506649 47339676 17299736 8220908.5 79536488 35064344 27770982 15185615 12913370 7381370.5 14250647 26504898 5172946 45728900 7138130 37696156 88499608 20698332 34086600 111869360 33065662 35365604 9137017 6226653.5 390573792 12469096 9775844 66382916 16699516 4589076.5 13918437 52779496 10373346 6889753.5 10065118 30230314 38197244 5273454.5 2331666.5 9729799 23111314 24373282 8995720 7423284 6421438.5 5034390.5 25260654 6991767.5 11190774 23224824 23284542 7208679.5 21105682 10823319 3085607.75 34786772 8440269 14755582 2307061.5 5960256.5 10236227 6387143.5 75588032 36851820
trigonelline (N'-methylnicotinate) 69871072 37300000 9487584 26641944 21645568 7064619.5 46142600 9852338 4469981.5 78755216 19024988 7989198.5 43911020 17943596 17348936 10900182 51472820 6151088 32496732 38128284 48667596 97461368 17025454 37084332 5621631 69254312 22703932 48866984 64347476 7955002.5 59007316 58827216 57118676 249997280 33606776 7539350.5 16889014 76169648 97086336 54214540 8678312 15369713 104996224 11916901 43311644 14346070 12380488 11649254 9648239 15771587 130830680 44768084 6671824 8828483 26802276 5397852 12284197 9793557 6285008.5 64558696 14326622 3038928.25 5590237.5 7645732.5 125803592 2969303.75 42433916 15501546 1294264.625 6566033.5 18866490 1585300.75 6570547.5 3541286.5 36791084 3017283.25 11125060 11108528 810930.3125 18552552 19924626 23490458 2588026.75 4149500 3814952 2367301.5 8971583 13347418 724188.5625 3940901 2284681.25 2483380 10988453 6936852.5 6987022 17700634 66125020 19085286 5761204 9482533 5142823 8794958 3081152 4025218 1748994.875 24202604 1576612.5 681030.25 3916658.25 2351853.25 10988693 9551569 1677060.375 52641900 1185835.125 12241955 10779926 4017089.5 1464676.375 1577153 51112200 54384068 6310881.5 3089777 28472288 6184625.5 5756122.5 41836988 20996846 13816880 9648239 45785244 5533912.5 7651843 1390015.625 1818603.125 3825532.5 4323786.5 14506205 84372488 6802828.5 785565.4375 7474450.5 1513515.875 8950726 4432642 3132119.75 13566065 10317963 40510344 9385026 3077462.75 599671.625 25919640 7359334 10078792 936563.625 3754993.25 10192790 17140620 1036256.688 2634158.25 5970723.5 5429693 54219204 748065.875 584388.3125 8089589.5 9195346 4985759 1454008.875 5819777 133829816 5322206.5 10581836 9202239 9689018 390753.3125 4357225.5 3506546.75 4135549 59605400 9780805 63641756 9312741 2783829.5 49174072 5827029.5 47061452 20931338 4157984.25 2098582.25 7864036 6458042 5442052 50556724 4055578.5 35563068 27511730 1831838.875 78986600 4530701 5038967 9759136 15428619 2399921.75 1655431.75 248848.5 21869768 657578.375 10242026 6714520.5 8535170 18083384 10572541 7355504.5 14945272 136133408 3560119.5 10034680 22950052 929352.4375 14737664 17683846 513096.75 5407610.5 707251.3125 22407766 38247368 11968159 27130116 25074526 5042709.5 31757600 10657065 44713552 2539989.75 88364176 22130980 12237005 9607460 13941870 21074682 5354264.5 14069108 2831449 8064789.5 31648962 62323080 119137088 1134788.875 10867007 149259200 334165888 8500357 20881310 48055140 262122560 18963542 12219352 128756320 2305842.75 3912557.5 23167116 23212634 1819411.375 2326961.25 5702906 8580968 3671723.75 48569052 7232100 7335232 718231.0625 9176654 1271280.625 65499568 4680933.5 18040804 15043224 9747890 4088185.75 7859707.5 74040872 2195762.75 84960792 50232684 2877186 9449990 8593631 4055303.75 48827148 1673319.375 131075736 1598968.25 6749331.5 4231703.5 4664144.5 73631328 35511524
"glutamate, gamma-methyl ester" 800448.1875 683486.375 696084.875 742206.0625 554264.375 760287.9375 726360.6875 698807.4375 803028.875 985979.875 950056.5625 680268.375 913450.9375 668229.9375 663807.8125 969659.5625 668973.4375 788718.125 887626.0625 927478.625 668325.125 996847.375 476544.4375 769576.6875 884440.6875 898273.4375 714017.875 661510.1875 750345 679526.1875 593493.1875 527616.9375 1087244 881784.0625 579910.8125 823938.125 897824 662637.75 840645.875 498161.0313 474464.625 207047.2188 554081.9375 461226.8438 738281.3125 626533.75 796311.375 650607.25 1509289.875 848113.5625 718554.875 767161.625 1068168.875 1105050.75 1315817.75 753261.375 794899.25 934283.4375 644678.1875 1189435.5 1672011.375 653054.1875 736170.25 592887.375 578355.75 679327.75 916102.9375 718351.8125 821787.1875 667505.9375 1290177.25 760073 838069.25 402370.125 1020362.688 1260260 637528.3125 830733.375 541405.9375 1108415.875 730355.4375 1676050.125 902845.9375 597925.5625 696276.875 483679.6563 859178 628192.9375 344450.9375 646681.0625 568071.1875 542390.8125 688742.125 809962 891687.9375 1296300.5 1047574.313 1091561.75 867054.375 413882.5938 395792.2188 376522.3125 837038.5625 684024.3125 508635.1875 626037.125 520117.0625 666024.8125 690597.9375 762225.4375 841386.6875 847707.1875 764797.5625 650438.625 562086.375 1060661.375 846060.375 1440553 810691.9375 656873.8125 3192271.25 1274145.75 592381.8125 1699475.375 972988 651930.8125 637688.0625 549581.375 666419.125 1078860.5 928612.1875 314499.6875 427285.6875 773613.5 692525.375 495734.9375 650169.25 1001622.688 567243.3125 816985.1875 900955.125 709918.125 2055268.125 732104.8125 541203.875 575311.3125 971715.625 976001.8125 579138.875 545087.5 810948.125 559855.75 329971.1563 724588 1077205.625 483193.25 759963.6875 1154108.25 732234.0625 713625.625 643591.3125 677187.625 731659.9375 890700.625 1183317.75 802481.1875 595465.3125 491658.0625 963071.25 629597.25 1251730.375 662745.25 1122593.375 1047372.875 612091.3125 749657.75 1631576.75 739569 656378.9375 658301.25 754238.9375 1466355 475598.6875 647159.3125 866165 822269.6875 885006.6875 1283076.375 1355060.125 580662.125 1273223 1016780.938 591713.75 631806.6875 1144079 755515.1875 745683.75 1144671.375 842086.8125 369624.9688 1157708.25 695707.9375 989483.5 1042959.75 307799.3125 739693.3125 320687.1563 1335093.5 1702800.875 510611.8438 817687.25 545706.4375 1358325.25 3506558.5 335647.9063 449392.3125 837018.4375 1083969.875 796707.4375 862491.8125 411420.7188 1518271.5 943312.375 1100919 535918.25 834675.4375 470289.2188 579050.875 907100.75 581224.5625 2603159.75 494419.8125 3060277.75 974998.4375 405176.75 939507.6875 1217401.125 491771.2813 884053 912009 946085.0625 812784.75 601887.75 1073481.25 559049.5 793100.1875 1771027.125 957906.625 358969.8125 463095.1875 936327.375 667974.875 597474 1069352.625 854164.1875 557195.8125 602790.5 678843.5 2734110.75 788581.1875 756118.9375 1937881.375 603517 766328.0625 1169944.75 703556.6875 1252749.75 587671.1875 489516.1563 822529.25 953212.375 183310.4219 760996.75 448992.5313 600082.9375 546671.75 723968.625 636970.875 1411652.875 526488.5625 726663.1875 750345 583755.0625 998959.875 1030484.063 530241.875 1352403.75 707760.4375 496278.0625 908647.3125 2012532.875 931548.3125 764914.3125 550344.5625 627219.8125 554979.5 985362 598002.3125
3-methylxanthine 135018.6719 569195.4375 125666.6016 477958.125 63353.1133 116752.4531 205266.4844 212915.6094 286563.8125 1422912.25 739454.875 748541.0625 900816.6875 80695.6406 189086.8594 143280.5313 162766.7188 317087.5625 367355.1563 762557.625 207050.2344 371262.5 264919.875 85123.4922 246236.8281 2706226.5 193386.5625 45867.9727 599404.375 729107.125 1592165.5 161527.9844 649140.8125 498173.0313 641024.875 188714.0313 234505.8438 289545.2813 368473.5938 254153.6406 293935.4688 1873490.625 137080.1563 51852.7656 806788.9375 2929152.5 443354.9688 54939.4609 32927.7969 1110943.625 1738871.875 932278 172751.7813 2570955.25 1946681.375 554604.75 147995.6719 601375.25 970895.25 426595.7188 669042.375 1041880.938 88284.0234 371262.5 516363.75 181010.8594 63209.5938 192235.2188 646375.625 42178.6758 1147046.5 45310.4492 728098.9375 96271.7031 79559.4063 376591.2813 106283.4453 238137.2344 2252666 337355.7813 2130703.5 246791.9375 67796.8516 514142.8438 1796542.875 85536.8281 101638.2344 3548716.5 447905.4375 5721715.5 8184458 69794.3438 124468.5938 2830556.25 106913.4688 185175.2656 1343330.625 216809.8438 917389.375 360921.6875 230202.4688 2718607.25 313012.6875 295488.5625 103357.4219 34198.2539 176429.8594 361515.5313 44802.0781 2341066.5 776182.25 483538.7813 109277.2734 910570.0625 983920.5625 159655.7969 2434046.5 142794.4219 2389243 256536.2969 1117504.375 756297.8125 102969.3125 21540818 1290023.25 2219989.25 374051.375 423440.8438 1466013.125 640497.625 301878.5938 693045.9375 1348616.5 536219.1875 772986.875 565758.625 8563043 202774.0313 138497.5313 548335.25 26102.959 766777.8125 1869791 120182.0313 754433.6875 9030986 341254.3125 981739.3125 231701.375 264525.9063 1304541.125 129447.9063 1645907.25 941084.8125 1202850.375 40996.4258 1089550.875 90312.6875 70602.0156 869926.8125 211026.7813 171950.4375 1375516.125 85770.5156 60161.5352 1202173.625 161142.0781 80773.7578 1902602 3083906.25
threonylphenylalanine 112452.1016 138213.125 217272.4688 375561.5938 578623.6875 186359.75 255477.75 279425.1875 110412.9531 247209.2656 143986.2969 154950.1875 213373.0938 212013.9219 325272.375 228403.375 749780.1875 110564.7266 141535.0938 250674.5469 294809.875 131144.375 130622.0781 93090 124087.5 172235 202893.3438 240752.6875 241163.0781 98443.4922 66492.1328 191178.2344 237797.8594 266950.375 123140.4297 146869.9219 93650.4531 121184.375 279582.875 193319.9688 134603.7188 153011.9531 354663.1563 323860.6563 106771.3359 157326.7813 464858.2188 212535.3906 204361 94763.7109 98092.4766 162365.7188 192355.0938 191624.2031 89171.125 80003.0313 110992.9063 301383.4688 188799.0938 122765.6641 163402.6719 152773.6875 244896.2813 60290.7695 123804.3125 74223.9141 206810.5313 103526.5078 338887.5625 103795.2891 523840.6875 163471.3438 127024.5391 147029.3281 284169.0313 146153.4688 180276.2344 191057.8438 213351.0469 140182.7344 196268.8906 178012 271055 432265 375437 147305 283941 115277 463662.9688 373025 505968 727317 487691.0313 554964 309472 173772 268535 114240 178935 144012 157633 133988 56589.9961 87644 97551 178535 164861 96964 164372 187573 185563 223315.0156 441691.9688 285872.5 198096.6406 158167 242249 47383 90127 348190 364762 192616 238090 252832 195417 103001 183318 212566 165590 118105 202902 91959.9922 64182.9102 83506.8594 197068.3906 190514 259543 175310.9375 107344 65373 193085.5781 121239 99435.0078 146072.0781 192673.8906 106366.0469 205782.0469 131988.0156 167677.6563 840588.0625 171515 357531.5938 352559.9688 158380 186435.0156 187836 59205.0039 104381 115758.1797 148358.8438 186804.0469 93020.4766 121196.2422 46224.5039 348921 267721 296923 198557.9844 196131 87203 124663.0078 127867 111744 558153.375 202735.625 86610.5313 412925.7813 107575.9609 232190.8438 75098 104324.8594 77396.4609 124805.3672 191325.0781 209972.0781 290698.5313 151305.1719 306926.0313 140511.7031 77476.3672 205329.2969 332399.5938 277237.6563 244741.9531 397897.1875 168465.3281 324254.0625 283177.0313 148995.5625 317872.9375 288767 258858.9844 140902 162823 338920 397729 164585
gamma-glutamylvaline 5277505 2988020 2949647.25 3829062 1660183.625 4152891.5 2643968 3125130.25 3455698.5 5739381.5 4195486 3096875.75 2851998.25 2616790.5 3167689.25 3725541.75 2049822.25 4194767.5 2246309 4067194.75 1663304.875 3866768.5 3555800.25 2345731.5 3764712.5 1852115.5 4335430.5 1899804.5 3608835.25 3416018.25 1710870.375 1503764.875 2983645.5 2835231.25 3431926 1830795 3519649 4677700.5 1940524.75 2843385 1682917.625 4751489.5 2165890 2733369.25 4215816 3114634 4437324 1421031.125 3904405.75 3880616.5 12657305 12254906 9352388 6952595 9392831 11633991 2750507 4733949 2833486.5 10298962 19511792 3679324.5 9981569 5050723 9477549 3566909.25 10220700 1298874 6458280 3763885.25 12723314 4950432 2379512.5 4130467.5 13546759 10705748 2351803 3529506.25 1163140.125 17353822 10657865 24878430 8117190 4365889.5 1400623.875 3247331.5 2670495.5 10089679 2503909.5 3248633.25 2767325.25 4175886.25 9291565 12683405 6227951 4792978.5 10677325 14865664 10740022 1312664 3818800 2084150.75 11576153 6075151.5 1738909 6936256.5 4509825 1614782 2637235.25 3128696.5 5728798 12326402 5348474.5 4208401.5 2337024.75 7078140.5 3720850.75 3029361.5 5860173 4298785 17166794 9738794 1993169.5 18730056 10812920 2958226.5 2080087.125 4456474 4326608 11052403 4435375 9009932 4469848.5 7851065 3835548.25 4583536 5273041 5034980 2374772 8196031.5 5519250 2656444 15351034 3842075 5299821.5 1579491.875 4931026.5 3059535 7028122 4184889.75 3833167.75 3794670.75 1931628.375 9536081 11675077 4488343 8186462.5 6457888 5648086.5 3299525 4986107.5 3587758.25 6480132.5 7698020.5 7925678.5 3530985.5 5682203 6403185.5 2656724.25 5573913 8577033 2374165.75 14171673 3620477 4105108 5584624.5 8402654 4072818.25 5177967 8094205.5 1474378.375 11770797 3969166.75 6244093 11374531 4070106 3676354.25 3822288.75 5239767 6067410.5 5865878 11345162 3118842.75 5011303.5 2544935.5 11787308 2657794.75 4433426 16519296 2124547 9614245 2172443.25 3986184.25 10420108 2511898.5 3435364.75 4765304 3600017.75 4866754.5 10457253 2465255.75 4440532 2874462.5 9145849 8321372 2598336.25 1967717.25 10899259 3387373.75 6582329 4222186.5 2743982.75 17347640 5953217 8958223 2291129.25 3354153.5 11417516 2295101.5 4472361.5 2476791.75 5417171 3235443 15997545 9913220 3166878.5 6130742 15439499 8417820 4018764.25 5993257 9308032 2687678.75 4193260.25 8363432 2796585.75 6380686 10979825 9320135 6816987 2018480.5 11063876 23977126 2814525 5523334 19662260 3642808.75 14543046 2509283.25 4193365.75 4435375 5304796 4823871.5 6106845 6010158.5 3273516.5 3759270.75 7855516 17893646 4854624 10097512 7085010 9993956 2950830.5 3142255.25 4201399 9374762 4899493.5 5427959 2648639 6515217.5 4134018.25 2935609 8188274 12425151 12664164 14462295 3887328.75 23935032 7847370 3311851.25 6350064 6916996.5 7537818.5 6866285 2709113.75 4392761 3810916.5 11391402 4135104.5
3-methylcrotonylglycine 118580.7734 342312.125 163713.7969 201828.0625 281690.2813 162866.7969 246476.625 42703.9414 124577.1797 82292.2891 92183.9297 326670.125 174321.0469 82331.5078 82814.7422 111721.7188 156738.5156 33180.3594 263699.75 182188.8281 108119.7266 112692.7813 155370.2969 151963.4219 364072.6875 118008.1797 172049.125 617733.5625 130223.8906 68741.1875 117504.9297 341005.4375 104359.0156 1905374.125 806907 681946.5 44949.7461 62750.7266 94680.3672 55477.3789 144571.4688 4478557 326654.875 158057.1875 137933.125 108290.9063 316263.9688 412732.4375 320574.2813 144006.7969 142041.3438 488906.4688 122160 208625.9063 746703.3125 284300.6563 277085.75 315599.25 350989.1875 317468.5938 84092.2969 172498.875 153249.5625 240284.0938 243354.1094 199852.7031 135965.7031 101987.3984 183440.6094 286955.5938 76304.8047 148320.0938 2981911.25 181313.6875 81343.2422 4321295.5 232815.5781 338899.3125 1295637.125 230223.0625 352793.1875 164390.4063 304057.1875 2262827.5 2157226 507837.0313 229684.2813 241225.4063 58714.2578 357358.5625 47445.4375 146024.8281 81260.5234 110523.2031 103755.0234 175654.75 172274 104053.2031 607099.125 37752.8945 224336.0781 174158.0469 51305.582 93864.9531 132369.5469 279740.5313 161198.8594 163298.6406 382469.6563 100138.4219 202402.25 92690.4219 43456.8164 1012351.813 71145.1484 209102.5938 175309.5625 146071.8125 110180.9219 205007.5469 53920.2422 925181.25 298958.8125 285067.6563 208127.5 335660.8438 159618.7813 252013.875 119737.3203 169866.4531 73952.5234 653185.9375 185460.4219 472136 1410001.375 612179.8125 146117.8438 74433.1719 172274 204136.5 223813.5313 93589.7813 412174.5 235556.2188 86858.9766 105463.6016 276718.5625 58992.3086 2262842.75 99079.8906 98268.7422 110863.625 98095.1406 423890.125 127678.9063 41139.7031 212076 326305.0313 475989.4375 662718.3125 103516.2734 188039.6094 162722.0156 115365.1641 148701.5313 39646.5313 120926.2266 43498.4414 890777.4375 119812.1563 337039.625 3458380.75 509860.125 202304.7031 2340578.75 120442.9922 2070522.125 161009.0156 140498.8281 87743.9609 104644.7813 718479.6875 168688.8438 52862.0625 170515.5938 356291.1563 58043.1602 756614 286819.125 105733.5781 242308.7813 228963.5469 99052.1094 35594.0469 74702.9219 483671.875 458867 34082.3164 296498.5313 39469.4688 155529.0469 327730.7188 773232 421352.9688 177445.7813 133693.6719 4376692 171241.3594
propionylcarnitine (C3) 25214954 25147584 32445246 34015044 37963156 56007088 29663788 35005820 26057114 44942756 47217224 59894988 36272860 22518386 27836714 33356194 38651512 37084140 25308284 28690094 38031040 72085376 36550532 42925788 40504604 33675256 33406000 23366316 42887408 28921750 27142516 26311300 56703248 60220856 42512292 29533140 28763386 84512200 28904058 43371668 20293410 33346198 18028364 24255114 48165296 26339320 18235890 22487346 30154610 38955492 91655240 74525608 24903790 37654528 101062480 25341620 18345002 45502808 12266828 26989756 63765160 49378040 259103760 40155632 122065512 22286642 46149248 22738368 125615600 41079732 125864144 28831654 39650772 26339332 101916568 73104288 18347096 21290044 38760824 75344640 88557592 180703408 104670744 119618760 37181424 61124688 19025386 130169976 29458120 18252326 36134272 33900316 211944496 60405152 24527740 117640568 135970704 64574696 38764320 33173432 19654312 72693192 58589192 33339418 29074002 70122976 23170856 14322206 20029330 34766988 28049434 65610960 42326236 30717198 23949132 50097012 96891200 317522624 117132120 66060172 90221776 287694624 26827120 123100568 26987018 168793328 49476568 36910580 31986922 175227392 54250800 23009836 20059554 92633768 29566406 12898179 69284296 35055036 18555178 536641312 26493004 22254680 246085808 72504592 28002490 25865004 17445572 34062096 135584960 40076516 14789178 42202188 17691922 43861384 185678240 29428906 56290212 30920442 63310088 22632264 17968652 28350666 43475520 38347532 64389464 42173400 42124884 59619888 85149968 48905452 12274828 28143828 34514532 24084430 46034516 26657662 55290188 36949852 26880818 52236120 46983588 77075760 36320324 114895384 203027456 21438296 59168260 22074846 209572160 49078724 57480004 55601576 28602030 52846520 20313100 61385008 11801096 102768160 34091460 17753674 81204008 32570362 77086376 92290528 19831392 39901360 30393478 22753146 54947388 48136908 96326272 8510158 15385515 89534736 81679256 46620428 32491394 81383184 65454860 116142496 24074574 58193892 192027664 147779248 32322094 15747661 20731292 122129960 19332744 57687040 55055484 139110112 25188186 61406160 67109944 47135180 57886684 143211808 24115044 25480678 95050176 94203480 69909392 20822000 18678222 38066168 93550872 72043032 16721433 38182828 12018366 58484600 31884574 20448178 51027392 306629664 176082480 22739184 34088696 19746368 461567776 27374344 29011438 303061984 26675916 29082486 46546812 60841688 52434244 23905636 148440752 56594632 104430224 21428244 9241021 24817646 42491932 38651512 32108112 37780320 50172736 17041266 27147616 8277350 34223932 57414580 41329604 19088124 44615480 39332292 13535308 38906152 43311612 22668010 24111982 32132274 71887992 36864700 60525920 107294992
prolylhydroxyproline 16156448 5370156 16078848 9577463 5024270 16798242 10123516 13821096 17093318 37864580 22638064 11814106 21680820 14124494 6656138.5 13572642 13029898 27728062 10953501 17436518 11648941 15712204 18327314 15688380 32814160 5163127 24226490 4408979 7789657 5868063.5 5157531.5 44146868 14715958 20803736 13810669 8166588 22314924 38119164 11855640 6996750.5 18470154 16907584 17010678 9837881 10338768 14351340 12143612 9624969 9853189 5391570 7204878.5 22323528 11365217 22990602 90238096 72701280 9808847 18718422 5134458.5 23780870 19942330 12919159 63017132 17625956 70804408 9015476 33976216 10566276 24936946 11206798 10938599 10386782 35580468 23359940 26886606 39903384 10805926 20449700 88932912 16538050 22709276 95312616 39158400 47494564 24657742 16157376 9094009 14086864 19261548 14017319 22024208 6833037 17304738 40739880 23906588 37244660 15846725 18853922 86684848 12038511 12003990 31584044 78130672 14584344 18163150 9910917 11248277 16976022 7537853 8509592 13875048 22752728 19332918 23654868 15806052 14937773 14914177 13385368 10534156 15231513 17399776 40312476 10515563 35407924 41011252 42877700 13902152 36951636 2708273.25 26790368 33199492 28432134 15549676 24852228 19024172 8120148 35501444 12961843 6125943.5 27060870 176938.2031 9111704 17344870 76445200 14340038 7498196 13134212 23492262 43393136 22215586 12942118 20667066 10110248 48339956 16971358 10015046 5921943.5 28762596 15639362 6282473.5 16612073 17570452 7292942.5 10088665 61093884 17612218 59245736 17662724 15361790 7238134.5 18698340 11416229 13446333 6438666 17990668 17776558 20845350 31766482 11063158 16147727 45224880 30588152 18777470 54897324 47696788 9430528 29310792 24524094 7757280.5 37469208 18053648 17418182 5560957 28692742 11190355 79336976 17920050 11128193 19416486 13817002 22714062 20443714 17454852 43598468 8021455.5 6016682 17436518 27000836 14575338 18611532 12987003 15121364 10923500 23560276 36938672 22369526 17192292 22111962 46437420 30591506 7168704 9754426 124545336 12086486 10377401 6251118 6612762.5 22176550 13878608 30023410 37328276 148862736 22240482 22462506 36541652 9320882 13610296 47625860 54742156 12289050 28729438 42415808 14821621 31674420 9317176 7049197.5 12214351 81465624 112836672 34802976 10735692 17850282 52055088 51288680 18880482 211611120 28872802 51283364 6468384.5 28477628 28662374 7558746 8978770 45159388 28026218 13222406 11691492 25975700 13319782 45982592 48132932 7545033.5 74039336 9664001 17322806 13262865 31118484 11848191 12599104 24741112 13626845 16177026 20786640 49685988 37113392 38438728 34617636 7637854.5 61796476 17705016 13472761 20521200 21098872 47286104 4505584 42503244 42414748 11202223 147949072 25170836
4-imidazoleacetate 1388179.75 325086.4063 371582.5313 1027677.5 1464733.625 1154936.625 641865.625 234700.9531 298355.4063 4240655.5 863225.125 1683765.25 755534.5625 623504.5625 2117383.75 824733.6875 361465.1563 1790729.25 633228.125 313768.7813 851998.625 424035.9375 122958.8984 1227807.375 1008128.938 1647683.25 885925.25 1895127.875 1288232.125 723040.6875 602714 823058.25 1427747.625 1077028.375 854481.3125 1037144.813 430938.0938 601192.9375 2623105.25 490655.125 1062375.75 386564.5625 448102.2188 1472509.25 871533.9375 924186.3125 738417.0625 1016858.938 534765.4375 802665.0625 678516.6875 828222.75 1324594.5 507784.0938 565862.875 564491.375 1152314.375 440960.1875 226331.7813 1489369.125 323063.4063 1565422.5 618370.875 3492734 920884.75 1586320.875 481381.6563 408366.5313 681236 631432.625 853246.375 321929.2188 1008098.375 683791.4375 234398.4531 561352.9375 601634.9375 425906.4375 747380.625 1239889.25 1172032.125 849576.25 1575648.25 832135 2296052.25 1485817.25 794678.75 783684.3125 426152.4375 279494.9688 1016523 251908.7031 86588.1172 641215.6875 240375.8594 851599 551985.0625 925991.625 921599.375 289958.25 481879.875 992436.0625 871675.9375 950980.625 697668.4375 840129.875 743937.4375 403389.875 1321839.25 630573.625 737827.375 765632.4375 711092.8125 1371000.375 863957.875 1084087.375 2513725.75 824140.125 388801.5 1097566.125 1290421.625 1532694.125 778761.9375 93175.1641 635748.1875 888690.6875 394385.6563 1237776.75 1172606 738770.5 716487.9375 233723.4063 1005065.188 478658.9063 1029659.563 894818.25 1339849 975580.5 1586821.625 2270320.25 2917258.5 841211.75 76004.6328 1577964.375 530355.6875 1832720.125 1237683.625 558338.125 337928.0938 1432564 777818.4375 1349767.625 590630.5 1898265.5 366552.6563 335858.4063 3236773.5 552700.5625 1133320.625 1199188.125 1041263.313 1464247.75 675071.375 667998.3125 731485.1875 1095283.5 945338.8125 1208735.5 1356016.625 227854.0938 236493.2031 829998.6875 952020.5 1111209.625 1306565.5 607952.625 876356.1875 466725.8125 2709867 1228518.375 264541.9063 859512.25 248598.3281
1-methyl-4-imidazoleacetate 7864749.5 1262303.375 5650869 2536839.25 5440973 4286315.5 5342328 2295141.75 1857655.75 27117128 2087065.375 2584416.25 3017819.5 7743138 2721154.25 6036357.5 2934304.75 3413415 2840719.75 4332291 2059677 3253432.25 5556034.5 2199495.5 8424809 1748888.375 5084526 1295307.5 5427722 4396190.5 7127407 3488312.75 7812915 2564554.25 3088238.25 1832525.25 3692108.25 5920095.5 4220777.5 2286861.25 5233292 5766001.5 4164883.75 1884404.875 2374793.5 2095611.75 3635453.25 2400302.5 1437504 20373916 26486284 10316868 5656307 9400629 11976378 18829094 4871932 1588836.125 2505160.5 34121996 8801591 1760832.375 18918020 3670669.5 23244686 881818.6875 6808870.5 2975490.75 6697737 2448701.75 6299004 2820025 2539302 1094617.875 48500052 8666637 2368074 4217367 8154544.5 5338642 14553499 8300870.5 11765265 25295346 4758981.5 5264544.5 1387819.5 13116438 2718346.75 2785017.75 5236736.5 2264615 6295824 8117919.5 6897817 4680723 23786958 18139140 13624433 1062967.375 4417515.5 2099207.5 4542270.5 2300149.25 1785540.375 7232487.5 5233292 1899242.75 2627867 2828122.5 1372787.875 10660194 4040054.5 4147908.75 2339246 3898222 3888796.25 11083641 3561847 3685158.25 10409787 38447612 2811305 12534324 5970915.5 6005456 3566594.25 5976103.5 11893830 13306083 1480331.25 66362532 6919301 26612092 1785282.375 2685254.75 10564541 5030449 1749723.875 22789828 5420759 3805782.75 6559500.5 7258177 3582509.5 2788874.75 4054715 4546418 10600022 2689283.25 7243412.5 12101414 2288171.25 9063173 27412076 2880932 2839108.75 6036303.5 6215068.5 2945303.5 1661013.375 3534146 8370065 3602882 41493148 5773939.5 11081627 1805460.25 4484351 4599462 3880970.5 4513171 29819534 2194383.5 5209949 3615327.5 6668054 4447252.5 2126662.75 9490648 3246713.5 38860672 4401294 34097472 16983712 3433901.25 11866024 3698234.75 7712303.5 15867001 10550418 17011366 2411561.5 10788997 3066750 86795928 4242634 28861290 27006566 2389541.5 47573376 2028779.25 4717773.5 6755515 3177670.25 2274902.25 2722018 8683118 16269952 6389578.5 3733595.5 4280804.5 3615170.25 6279723.5 8157986.5 5256635 4566325.5 41914568 10329475 5788810 16664520 2787537.25 47704116 21622582 6972888 2807638.5 4427548.5 8147154 13312151 7116519 11503240 24062282 2972812.25 25356442 25832640 4824528.5 8040658 32110924 32410278 3609213.75 10547060 8106955 10045772 8432124 3508011.25 2828962.75 13217497 12555091 16716926 40788224 2569632 14022953 69669376 34984800 4347575.5 42716544 14456711 101606696 2474744 4432663 27037662 4285894.5 2063643.75 19465752 9088453 2444014.25 2971983.75 8127054 12438016 5006433.5 49750932 2383155.25 44435832 1818677.5 3092482.25 1440915.25 10005267 2047245.5 3296564.25 2549515.75 3030548.25 1287667 9218808 63303076 3926787.25 13893923 50700020 3356649 17954960 7439883 1892685.375 30609992 2756267.5 60878864 2202468 6613481.5 7990374.5 2089534.875 46543516 22117608
guanidinosuccinate 132763.2969 331156.75 165068.3438 93049.2109 156206.6406 208781.5 196269.2344 134686.5781 322824.4063 80965.7656 181224.3438 129600.4844 257684.3906 3029356.25 944750.75 757833.3125 1498561.125 1743859.75 614056.5 3911632.25 13176241 1174033.5 710993.8125 814647.5 19525094 292511.625 231292.5781 3360063.75 2269706.75 859803.375 1154359.5 2759805.25 1046552.75 2541908.75 844468.625 1546248.125 284992.3125 2404111.75 1411044.5 1358853.875 252569 104187.2266 1428315.375 295643 160522.9531 621245.8125 12595401 180494.7344 265131.7188 14648929 1245398 1646907.375 187459.9844 159906.6406 2101225.25 5344554 1106576.5 115892.3438 5816664.5 494918.5938 53491372 201501.7969 775179.3125 3357129.75 546295.6875 2316561.5 929092.6875 14361208 773282.6875 258429.4219 159305.4844 196878.2188 179740.1563 3697653.25 584237.8125 10438845 89215.0313 333659.1875 491264.6875 11927863 107983.4219 4965290 687811.4375 114603.5938 3124836.25 2486076 989094.4375 1171957.125 4430741.5 248067.7031 3737641.25 9345221 31018328 111594.625 8818667 413070.9375 3271927.5 7608845 554643.9375 2613668.5 348804 26959056 711429.1875 136833.7656 730620.5625 560575.5 130854.7891 64915.1328 2916607.5 881773.625 515946.5 104286.8203 10919472 14419186 2229120.75 2590818.5 233463.3438 852136 786089.3125 684945.1875 231417.9688 124483.5938 2044765.875 44909300 4219909.5 5188213 15377137 3723068.75 856004.1875 1400585 2345685.25 547359.125 384847.5313 10922273 4791843.5 652818.1875 114703.875 345178 1406934.875 229839.4063 1717674.25 3391820.75 165054.1094 282685.4063 677125.375 1824049.125 4042417.75 3694335 142456.1875 10363967 5217338.5
gamma-glutamyl-epsilon-lysine 1053961.625 431249.9375 682843 351840.2188 530745.8125 479436.1875 559530.1875 482779.0313 335237.875 378124.4688 480373.4375 363148.9688 853612 757400.25 454651.875 705655.25 759084.5 380543.5 554815.125 848071.5 509206.8125 714904.4375 985786.625 624101.5625 512027.9688 450790.875 2082594.875 709321.4375 575584.3125 971910.4375 668710.8125 634622.3125 1060262.5 2029236.75 560481.875 357100.2813 424436.1875 1727664.5 665928.9375 277916.875 649827.25 917216.4375 388717.7188 1034228.313 508561.9063 1093574 1597999.625 376522.75 252132.5 300289 1201814.375 947592.5625 548523.1875 398526.0938 838889.5 561903.0625 1322055.625 365147.6875 426491.2813 378726.4375 356917.375 191648.4375 690182.5 659755.25 289419.9375 1086597.125 631658.3125 594934.75 583126.125 1591145.625 1324365.25 834191.0625 152324.9531 262426.2813 651415.25 865399.25 295256.0313 301793.9688 699613.6875 646533.9375 250253.4219 176903.0781 361954.9375 591780.875 514444.5 460287.2813 247468.3281 498294.7813 454097.5938 805929.4375 637565.25 227071.2656 1352016.5 1622334.75 1000891.063 118802.5391 298838.1875 492752.0313 1192329.125 438667.1875 450518.9063 1355838 189790.2656 262404.5625 244791.375 313616.0625 484822.9688 461469.1563 278960.25 519904.5938 942586.25 120679.7109 981723.0625 814187.3125 112630.3281 378206.0625 2688974.25 392634.9063 870207.5625 847728.125 297256.5 491893.8438 220841.8125 97835.4453 504237.6875 788413.75 566023.3125 357012.5938 222888.5469 779608.125 643373.875 3219433 966642.3125 858592.25 197666.2031 311930.5625 352190.625 792061.9375 253666.1563 484599.2188 689276.5625 590262.8125 165691.1719 644202.9375 148794.5156 511032.2188 799105.3125 242187.2031 828376.875 1610366.625 129367.875 910252.3125 452658.9688 787155.0625 519188.0625 1147526.625 335180.5 923169.8125 282699.5313 850469.625 534069.0625 413258.0938 694902.375 553361.75 1475495 324332.9688 542018.125 481227.1563 338227.125 639897.6875 577728.8125 563075.0625 340592.4375 417701.6563 1126620.125 402688.875 630693.625 386782.25 630826.6875 1242405.625 69645.2656 320919 537250.875 506749.75 456557.4063 387871.4063 475163.5 229885.25 2823561.75 1194737 575951.875 322745 1349141.625 1261779.125 607727.6875 982682.375 1534090.75 545199.875 1025016.688 353738.5625 388321.3125 2436413 395517.7813 672216.1875 483090.7188 412039.2813 664777.5625 461786.125 399429.4375 387476.8125 1389797.625 365576.5313 410362.2188 246870.125 1840091.5 269533.125 1496373.25 201166.5 337724.2813 807207.3125 834045.5 349694.4375 1084629.625 523378.875 231546.4531 603612.3125 2527510.75 718823.25 1090740.75 453540.5625 1057477.375 479259.3438 1413254.375 1172003.75
N-acetylarginine 1537855.125 1747587 1675145.875 1348969.375 1363447.625 1758496.375 2383194.25 1100584.5 2147004.75 2078997 2310787.5 2259161.5 3271047.25 1398021.25 2184181.25 1705026.625 1887145.25 1476281.5 1076150.625 3535749.25 1184313.75 2391060.75 2017209.375 995368.5625 3519828.75 1427169.5 2483404.75 1532113 2243897.5 1485959.375 1344275.125 2860194.5 1339226.625 2958273 4002979.5 1476408.75 3060359 2850800.25 3147234.25 973141.375 857413.25 1398083.5 939550.5625 1360304 1286199.25 1924801.25 3271499.75 1224018.5 332515.0313 3770782 3942860 1673786.25 1635619.375 1148548.5 608201.625 905837.125 1247498.75 1055696.125 596297.5 2667683.25 534185 362264.9688 741238.0625 1074938.375 1243004.875 426057.6875 1057930.875 581277 1182023.5 885436.625 1979014.25 650092.875 1186795.625 159053.1406 1953345.25 509609.5625 312958.75 447306.4063 1627958.125 2381547.75 1114159.75 511080.2813 1104928.75 1120335.5 256895.125 493296.5625 2699068.25 225110.0156 319930.375 827443.4375 930344.6875 1071571.5 1874324.25 738270.4375 1184840.625 4562828 2579986.75 688625.5625 336658.0938 1167268 222221.7188 431401.5625 653036.8125 535063.5 2094797 508581.3438 391590.4063 521886.625 718206.1875 890257.0625 553313.5 894850 889655.8125 561058.0625 618162.125 585757.875 1486832.75 824874.1875 705417.0625 1138315.5 736065.9375 598110.1875 1435030 694928.0625 1702869.75 533382.5 587538.625 1676413.625 1966936 4836679.5 1140473.875 1687490.625 600201.8125 245859.7344 1000831.625 511975.8125 367068.4063 1917440.875 977786.75 446273.5938 3982728.25 1136157.125 395204.2813 873345.625 402278.3438 844618.5 3527998.75 622228.25 812495.125 1808596.625 576550.625 3757557 594309.0625 273763.9063 297175.8438 1467503.125 587435.4375 296541.9688 574603.9375 1214035.625 1076204.75 807271.3125 1987177.75 1471209 355530.9063 962027.625 1717732.25 733316.25 1708377.125 447531.3125 271629.2813 1298658.875 831384.8125 1585384.625 585294.5625 682520 938655.75 4222894.5 541944.5 4009662.75 3486155.5 904251.25 3182484.5 398894.25 781860.0625 1003050.188 886341.25 2314298.75 306501.0313 1280423.125 1511589.875 2935614 320214.4688 2085182.75 4039265.75 416529.2188 1356138.25 585526.3125 1348148.5 726851 655626.5625 450424.75 346830.5313 1308196 1258692.375 963244 947806.8125 238731.7188 1818414 1143513.125 620974.3125 545042.4375 4350049.5 365895.8438 858893.6875 2115538.5 339452.3438 4137057.25 2689765.25 944277.9375 842350.375 654247.375 2722430.75 1413950.5 1373240.5 2523147.5 585216.875 1067369.5 2523503.75 1708484.25 1283020 1271438.75 7763320 675397.125 1214804.75 2829619.25 1138315.5 730914.8125 1185641.625 604421.9375 1029089 2378583 2162257.5 793544.6875 8780142 976147.5 1557703.375 2813579.5 1124785 1642628.375 676015.9375 3453619 693362.25 400208.875 3608053.25 478985.8125 845069.375 5608663 1561154.375 291683.0313 2224343.25 2446524 4196587 494551.8438 2486674.25 895005.0625 1403788.75 305757.7813 279081.1563 193606.0469 1141784.125 714831.5625 1380679.25 867674.1875 2709105.75 587452.75 2729502.75 996905.375 3387172.75 2097629 2395968 239413.25 1576455.5 854543.125 1196593.375 2556236.5 368722.125 3777787 1788638.25 569753.375 1210024.5 628113.5 2618040 1301760.625
N-acetylthreonine 2233918.25 1777137.25 2138215.75 2435875.5 2070402.25 3355354.5 1483360.125 2030032.625 2348592.25 4496427.5 2236370 2280813.25 2755209.25 1774981.5 1693919.75 2579183.75 1833901.125 2382760.75 2225446.25 3136258 2341845.75 2170913.5 4103796.75 2244991.5 3743620.75 2497078.25 3161044 1890667.875 3559445.5 3361813 2626445.75 1978228.125 4168904.5 3056037.5 3283848 2050561.75 2583454 4210473 2459134 2011865.375 2409996.25 3924414.5 2195997.25 2590921 3825106.5 3058990.25 4843922.5 2645811.5 2799501.25 2681302.5 21004094 15551280 4161210.25 8027998.5 26637406 19882106 2873901.75 2451951.75 1680388.75 28364632 10889883 3699814.75 25291274 2642382.75 26523454 1993846.625 13384319 2618998.75 11260285 3038412.75 17271698 3379415.75 4266795.5 3709255.5 20163566 7839027 3189827.25 4603391.5 9234378 16750214 13231654 15135403 16927402 9659825 4069736.25 7373002 2413481.5 11187535 3281713.5 2492236.75 5322726 1512236.625 10027512 15572851 8360204 10529356 28864830 16720563 17249458 2793148.25 4492176 4505577 15128339 5464565 2862453.25 11704847 4759345.5 2513406.25 2391665 3167077.75 5388541.5 14178995 6691142.5 4816827 4066799.5 6593637 7292024 27657100 5510412.5 6511304 19680228 35853020 2887052 15503851 14505624 6437274.5 5193868 8362502 12221118 30964364 5423177 25459806 4119547.5 20338402 3289115.5 2462135 9511092 4283048.5 3190690.25 36649928 6655117.5 3950005.5 13993533 12972822 2860787 2646449.25 3725323.25 4421386 18406552 5742407.5 7643436 15426662 2301332.25 18025770 26613014 7898062 3163117 7091060.5 7670911.5 3664669.5 3969784.75 4301212.5 6789871.5 3744714.25 27075356 6732255.5 11153597 3930600.75 6976768 5251049 5441516 5667046.5 23942646 4978995 4271451.5 4484531.5 10061016 5654358 2674447.25 7526001 4405634 24845732 4646100 29347174 14157005 4135124.5 13639353 5705187 12965412 14110923 8003142 18866580 2808857 12538530 5037929 43209696 4026551.25 22787886 37925156 4109360.25 35059672 3158814.75 10185160 12338836 2560976 4158357.75 4958108.5 3470427 14004425 12206342 8676510 3649511.75 3485460.25 8928954 14357439 5688907.5 3206101.5 32574494 14668878 8692277 7906481 4661858.5 43563428 13933243 5829529.5 3115901.5 3419774.25 13951910 6424884 5633646 6811283.5 12602407 4633309.5 16823212 18753766 11378990 8205577.5 39847036 33099700 2537136.25 11132571 11736609 9020628 7846739.5 5585614 3772618.5 15602752 15372544 11444260 23546190 1661981.625 9781032 47888280 21245066 5283035 33235464 10815212 29747840 2117381 4105217.25 14645326 5464565 2331625.25 29918942 9678477 4445938 4811122 10151522 18355802 4662592 22091788 3760921.75 30205322 2403311.75 4040306 2206404.25 9220121 3235025.5 2921525 5410151.5 2593906 2334275.5 7159937 23591770 11156804 15572717 16815248 2980542.5 23181746 7511187 2763358.25 14533798 5497778.5 25146572 3056268.75 8673979 5487614 3544098 40321436 17904554
gamma-glutamylglycine 6531531 4663580.5 4896972 7192718 3414880.75 9393158 4488317 4203023 7084846 7014442.5 5868039.5 6078182.5 6611403 10809710 5264767.5 6906119.5 5779159.5 4608062.5 4964416 6739970 5057886.5 7079777.5 6930426 9573750 9033748 5633987.5 6494764.5 3147122.25 5376061.5 4058402.25 5402435 6065174.5 6757180.5 8434212 9237267 4565549.5 5277753 10346344 5905981.5 6576804.5 8787104 7045745.5 10821392 4854514.5 6412452.5 5541966.5 9143497 9504771 5460351 5352373.5 4551546.5 13052634 4062234.5 2874754.75 7374467 3724443.25 7871454.5 3594247.25 2652852 4259074.5 16730856 3469958.25 4290283.5 2529845 3627287.75 3485720 6407448.5 3007790 3922963 2426737.5 11241448 3269332.5 2870547 1621703.375 3517421.25 8048016.5 3570822.75 5248581.5 2373728.25 3724874.25 2121478.5 18042900 3230948 2654664 3564135 2274262.25 2074174.875 4708258 2571191.75 2790461 6252965.5 3493410.75 4196532.5 4269015.5 4073740.5 4963802.5 5534485.5 5780111.5 4181825 1043714.563 1960268.75 5548372.5 2576855 3138805.25 3779859.75 3400366.25 3437257 1676542 1592137.25 5045297.5 12329673 3710334.75 5400600 3369960.5 2748093 7703945 3208735.25 2203255.5 2763557.25 3859473.25 51784308 3947071 2378148.5 11904267 3704073.5 10242185 1952800.25 1239762.25 3156899.25 3768831.25 4619506.5 4226507.5 3325553.5 4574863 3458194.25 3518841.25 3195141.75 2485058.5 2158868 3129679.5 4507172.5 2388651.75 26623432 3732072.5 2178137.75 3709567 3157044.25 7267583 2857819.75 1494399 2494953 3357318 1414327.125 6799236.5 8012198 2448794 11555107 11943244 3514737.5 4115592.75 4234461 1633446.25 4816726 4721168 2184497.25 3860052.5 3713578.5 2768232.25 3340316 3967328.5 7227057 10051609 9415074 2997279.5 4939204 5108372.5 9367112 6197572 2362641.25 4819490.5 3658978 3451030.5 7877318 2203759.75 9473564 6138251.5 2265507.75 4259074.5 3937549 2772435 1912272.875 5060281.5 1220743.875 3384017.75 1342887.5 1848316.75 1678344.125 5034210.5 5633632 1520158.125 2325465.5 5653922 4911008.5 6586971 4072774 3944856.25 3142364 5609526.5 2061032.125 4939170 662248.3125 6618656.5 1417041.25 1754099.125 4249424 2256557 3490848 6300733 4832978 3537255 4766016 3422734.25 3254117.25 1966580.5 2497363.5 6847882.5 4810426.5 3230359.5 3875868 10199743 2771234.5 13281029 4349796.5 8842413 7565871 1446860.375 6776345.5 8563711 1638483.75 10654795 2559659.5 4688883.5 4234298.5 2244455.5 5635404 3642778.25 2178055 15147525 6685508.5 3838252.75 3255584.5 6449481.5 4821512.5 4283688.5 5321142.5 5538747 3164334.75 4873957.5 3233530.75 3799400.75 3669086.5 2683108 3791674.25 8153272.5 3882504.5 3357568.25 6125888 2053560.5 7173495.5 4315237.5 3401415.5 3619587 4922089.5 1959935.75 3784490.5 2334024 4277729 2234191.5 7645778 8047341 11546693 5178205 5430609 5774617.5 7120198 5253900.5 9959831 3577152.5 25607908 5986498.5 2966125.25 8345655.5 36559236 7033984 7947131.5 2888608 7043257.5 4785478.5 5071077 4204216.5
gamma-glutamyltryptophan 144857.3438 162276.0156 184597.9375 74055.5703 225535.0469 104188.3516 164856.4844 122879.8984 255036.1563 163606.1719 146800.9531 152492.0625 83515.8828 125167.1016 183532.4219 128910.2656 208836.5625 153442.1719 171160.1875 116000.9297 314243.125 227065.6094 156138.8438 131829.0938 147129.375 270239 110745.4922 131435.8594 120654.5938 125872.2188 82256.1563 201873.8125 195671.9844 194869.0156 115131.6016 131137.0781 295742.75 166429.1094 108029.4453 110583.8203 168171.2188 142783.75 109669.9219 246145.875 202270.5 323923.4375 129777.1953 98839.1797 153386.1406 145308.5469 298225.7813 58823.4609 286152 249289.5156 113559.2891 292414.9063 134704.625 148759.3125 677941.375 124964.9297 445777.25 58442.5508 74688.1094 90239.5391 82881.6094 32826.918 75927.1563 66707.1953 155181 174863.4375 128597.9063 102741.9219 74171.8438 91969.6875 80744.5156 477582.0625 83574.0156 32408.6953 125945.4141 162745.4375 188571.9063 186304.6719 67423.8984 151949.7656 296612.75 109154.9453 208925.9375 86429.5547 613916.1875 113462.9688 254236.1563 136521.5469 280318.5938 183993.1563 105934.1172 177894.2344 167886.4375 249337.2344 254226.6094 267495.1875 39984.4023 253216.625 334689.125 278715.125 99082.0547 98043.4375 147292.9219 162988.375 40799.1563 134590.0938 141112.4375 348119.0938 306925.125 89113.7656 68051.0313 132137.7656 110632.3516 59388.6758 129731.0625 194097.9063 402025.25 269559.0625 113471.8438 188460.6719 260434.2656 165644.8281 84960.5391 160252.5313 133539.375 240521.5938 168700.6875 905343.875 199222.1719 126912.4453 123874.1406 147092.0313 62870.7539 78132.5859 189276.8125 242218.2813 414319.4688 65146.7344 112528.2813 133599.7969 145713.4844 229800.75 169345.4688 153135.6875 106961.3438 286451 155217.2344 59393.0664 175145.2813 74616.4531 239786.7344 382848.5625 422598.0938 213765.7969 155181 71519.9297 378081.3125 71495.7656 157893.0625 228054.2188 148090.5156 164895.6719 81633.8281 83844.6016 389208.8125 56001.793 164111.1719 129668.2656 128031.3594 94502.7578 92816.6328 143566.0156 287760.375 62814.7305 131119.5 85808.5391 339895.1875 188100.7656 423260.125 57705.0234 375988.9375 161388.375 118263.2734 359559.2813 373184.625 181977.4844 593701.0625 331153.4063 91876.3672 300277.1563 125387.5078 189025.2656 112478.4219 61342 275303.9375 588493.1875 253719.0156 69500.2578 176149.2656 269539.2813 123916.9844 505994.4375 486341 52215.8086 417036.6563 180666.0781 126170.1641 368999.2813 213830.4063 384954.6563 67370.1016 235620.9531 153620.0469 101680.75 149249.5469 160604.0469 126890.4844 294574 845562.75 146250.8281 419286.25 237314.7344 283407.5313 190493.8125 156400.9531 100870.3359 56969.2305 192873.8594 44708.0547 107310.25 261212.2969 238073.8906 356215.4063 305178.4688 264729 67757.9609 989091.25 137895.8281 186726.2188 118038.0938 705335.25 75254.6484 235946.5625 73980.4531
stachydrine 31158354 88040584 23054900 296857856 94641024 66726320 201965888 21610800 128829704 177995376 24294850 423101504 76769744 27457006 26025276 167339952 115098232 248363120 30223094 141048224 72589848 677598080 103059312 25875542 21502000 248712528 496718432 6874124 321267168 197439360 274288800 730146368 64144068 248291008 551268736 69590464 92671672 798235200 67434104 561267008 428521088 1072156224 25626404 55019196 156697664 14712938 447000896 37319396 151341664 91717744 336904576 27252758 18440628 265825376 51964040 72493832 60603436 7104818.5 136958768 260847984 4725656 42689852 181002752 155326960 42960724 132516968 624170944 13942937 9512059 25019872 359682112 1045453.938 51722512 8345612 118381424 2872847.75 47604588 155168512 3337945 11746027 84363928 11863184 11097570 259889040 15686023 48021072 98874688 794672000 31945308 703020352 770781.3125 44449528 159095136 125814472 62761388 98680720 30566316 331473440 61691264 235364560 99844328 44399504 88182896 156458320 237523456 311087904 244827968 150453968 45452356 1213226.5 509055584 165884960 12367826 596242880 8120370 7028110 23504418 7352271.5 15388648 1168409.75 46278988 28240336 575835712 601987200 433297664 17971570 6136250.5 30779314 209104192 14756170 11987051 50001276 24645404 5455491.5 646640.125 412235840 2621081 188312000 14608850 6321528.5 248818656 84882832 44217116 11411389 127169080 17334286 13418324 1745531.125 121085800 42090668 105217368 3003505.5 1952635.25 4980500 93626864 7412880.5 1266852 1431898.25 21193590 4832436.5 6561804.5 373644928 43430396 2542941.25 120024832 17695918 5887002.5 239618176 395636224 111235056 62300560 244302672 142496544 12552599 24116014 32178408 14087725 1294579.125 203201696 101335304 764931.5625 52076760 253458864 87422048 290555712 52290408 303405344 10177838 105875352 37748180 44152176 8513370 70229856 4907401.5 37841052 192255088 7481956 137029120 68527584 61154016 448541024 605511.1875 33571124 57747976 375627488 1128337 1906424.25 583377 59738968 17830016 3630341.75 12330515 160256448 45066016 59297736 131109048 508453440 385813280 105856512 71118088 38796144 1165257.75 415173056 36167008 1728530.125 14705192 4340830.5 438319072 26474274 55019196 34067208 5120178.5 51085064 179174208 454510144 211163056 157834736 180958144 32152998 207892960 106226472 448355584 19335172 99582808 13214207 29310238 9934836 24453310 115073488 77482480 29523202 32719990 126586232 60111276 3396255.25 1328450.25 31006494 280469280 5046615.5 116451792 45901596 10636112 31199122 35261152 45474512 3935742 57058688 93835832 713040256 1716869.875 29672936 4750043 144962128 3724274.5 6667776 310269568 126890048 45879296 93141272 67536432 39709212 504681760 232408160 69239064 8526245 104869352 345244128 31625802 26890530 10459985 20508354 29489246 7607610.5 458896480 24122784 365608096 225253280 91233456 25140772 197379040
nicotinamide riboside 37723.6836 29006.6758 685530.8125 610821.9375 27221.6973 36142.6797 43785.1055 51248.5625 73949.9844 916724.375 225642.2031 96715.6719 46968.6484 70437.0781 45102.3828 89517.3516 65900.7813 984039.375 37500.8438 475623.2188 1518283.25 169844.8906 329676.2188 404990.75 553425.25 125022.7109 118955.8125 66716.2891 900586.3125 359717.625 144516.7969 168013.7969 94184.9453 372872.875 104176.6016 496223.125 374718.7813 215933.8906 143382.8125 102526.8203 179482.5156 332910.9063 227132.9844 399433.4063 167068.9375 205302.9531 275001.5 321026.4375 357227.7188 79009.5078 396873.9375 375455.75 197081.4219 260742.7813 115701.5938 422107.4375 438215.25 94956.3047 263131.0938 109995.7578 580647.6875 474032 727502.0625 366906 1034760.5 200692.7969 602722.375 154841.375 333082.0625 248448.0156 146907.4531 319854.9688 68248.0547 250891.0156 373346.4688 201972.9219 131491.2969 169254.0625 134380.5625 320141.75 295495.125 237617 190212.7031 252923.7344 146211.8906 442097.0313 394022.1875 461002.625 1136337.125 467671.2813 117577.2266 207968.7031 1231119.125 264640.1875 176472.9063 718456.0625 124503 688874.1875 325606.125 462350.75 219876.1563 322957.0625 104362.3516 285861.5 162907.2188 187425.2344 244245.4063 253251.5156 277498.6563 370774.1875 422387.4688 698637.5 182239.875 139938.4531 239007.7344 402055.5313 91214.3359 229959.5625 664703 48152.6406 406454.9375 379251.9063 251879.7656 357220.9063 549382.0625 129566.75 86726.6641 284039.3438 209885.1094 153482.5156 433073.1563 194874.8438 281322 191849.2813 633946 369257.7813 389703.6875 287330.6875 1510578.875 414464.8125 96154.4609 114860.2578 407015.125 327365.7188 110690.6406 124790.7734 285177.1563 495895.3438 65144.0117 408879.375 309586.4063 103673.9219 541414.25 256589.2188 236516.6406 724032.8125 281932.9688 314199.25 69482.9063 280711.0313 748420.4375 356692.5313 212461.3594 577406.875 150063.9063 334071.5938 787518.75 144969.875 52161.1719 112447.9219 289064.6875 127085.4063 418587.3125 1075052.875 761215.5625 320392.0938 597396.8125 264361.7188 93920.2891 115383.5 81673.6797 1382874.25 370457.1875 157319.5625 161741.7031 674458.125 356555.0625 273366 70518.3516 79796.4922 117222.4219 430439.9688 323852.375 2417130.75 363670.25 1113178.625 915941.875 137802.3438 1103374 981440.5 73167.2266 93316.5781 209131.4531 131251.4219 440929.9063 430035.25 98143.8516 734418.5 667251.25 287642.5 101995.3984 447296.375 527144.875 344992.1875 312854.1875 1157591.125 648242.0625 338510 93531.0156 355847.0938 1094061.75 102288.8359 970243.4375 376084.875 356242.2188 337467.125 232044.0156 1692216.375 243815.5 868952.6875 412120.4375 241790.2969 98612.9297 354416.9375 257167.5781 168653.0781 439859.5313 193559.9219 139283.7813 117875.7656 397875.0313 833420.625 619903.1875 559385.0625 230238.7344 884681.6875 323391.2813 306934.9375 203616.4531 392985.9063 249863.7031 87646.9844 184827.4375 300492.0625 114371.8828 492847.125 222869.9844
gamma-glutamylmethionine 1768488.25 1239006.125 1699854.625 1316432.25 549489.1875 2293748.25 1145963.75 1614683.875 2316810.25 1292411.625 1516615.25 863395.25 1952563 512821.5313 953206.1875 1790358.375 647063.4375 1883991.875 1046690.5 1447691.375 874758.5 2100389.75 1293714 2803895 1897221.5 1263409.375 1807919.875 808604.4375 1565536 1043566.438 1220112 1058838 1463018 2287837.25 2678663 1153062.125 1893435.875 2934701.75 1412498.5 1223831.375 1361421.75 996543.75 840737.1875 1148774.5 1732051.5 1643253.625 2076137.875 1122101.25 1294659.75 1353110.25 2385023.25 5156752 1029485.75 1481042 2551297.25 248971.1875 1404583.5 2805730.5 755847.875 5695988 5185245.5 3010910 3099350.25 834294.125 906799.3125 2210740.5 3371496.25 769841.9375 908521.3125 1002267.688 16213342 1597424.25 759379.4375 557764.125 2985487.75 4227075 1156477.5 1960118.625 663822.6875 584400 1013356.125 12261540 1187910.875 963218.6875 1003285.688 823723.25 629124.25 1311815.75 1394095.125 647828.1875 2654818.5 623092.5625 1201449.75 1883805.625 1293714 2227882 13479968 1375581.125 1366881.625 105852.1484 510223.3438 2803102 1008707.75 805403.1875 1287612.5 926756 932375.5625 899917.375 305144.8125 1907479.375 1173698.625 1356285.375 1606152.875 853793.4375 1064086.875 1613074.125 1025164.125 402759.125 1556259.625 3214339.25 37829816 1379140.125 786274.4375 13240866 1066642 4633881.5 473689.375 303921.8125 739952.9375 1494614.25 2286873 591894.5 1625632.25 4706597 1175652.375 1245312.75 827384.9375 1177923.25 410474.9688 437954.5 785758.3125 1359218.25 42891812 1923929.875 1126940.125 612671.125 2188199.25 1855018.875 1105325.25 562436.1875 512553.5625 881342.25 675601.5625 937375.3125 3588413 757820.9375 2346505 7685464.5 1054716.375 1471490.875 555869.25 367847.7813 1484492.875 1737504.5 2019085.75 2825402.25 1293714 608917.75 1110680.5 408935.0938 2383584 3469694 2535061 1449965.5 1378765.375 1615067.625 4800688 3379542.25 814707.75 1490378.25 1711015.25 771918.75 774226.3125 1241511.125 7750760 1156560.75 506522.5 1310351.375 1552405.625 1432977.375 470344.0313 2282103.5 421697.2188 1440618.375 541880.5 612966 356437.375 2671066.75 2095004.375 229726.1406 897550.1875 1568241.875 2165152.5 3541219 968376.375 1390231.5 921287.0625 4491615.5 350746.625 1343084.125 60411.7891 1962136 556973.375 499298.625 915702 967358.5625 1390051.875 4860448 1970656.875 1217428.125 910769 1830497.5 869783.8125 806411.5625 764421.1875 1840525.5 1077206.875 1130235.875 428022.7813 2183431.75 511922.2813 2767226.75 1700690.375 5952584 2459938 163944.2188 4058438 4247539.5 843846.5625 4277299 309176.6875 1566306.5 2077992.125 636382.375 590109.625 1703971 432105.875 11990647 2252461.75 438245.4063 741817.5 3176208.75 715649.25 672631.9375 3030047 1332700.25 444505.375 1184581.875 1054704.875 2041972 1074164.25 1241279.375 5236177.5 678582.3125 810890.625 2372795.25 506348 2208509 940946.25 672603.25 2155437 2259844.75 848083.8125 1741228.375 501996.0938 1495324.75 825993.8125 2432360 16587953 1631476.625 848698.75 613448.375 654009.9375 727028.9375 1612999.75 3115965.75 1812584.375 2309340.75 1968303.625 894216.125 379420.9063 10593607 1386781.5 2846788.75 1031151.938 4216170 1290042.125 901845.125 470831.6875
gamma-glutamylthreonine 4023593.75 2204314.75 3021560.5 2158295.25 1010072 3208396.75 1581915.625 1579437 3419339.25 2815296.75 2372488.5 1525834.5 2580612 1461000.875 1702117.25 2007645.375 1593658.625 2297193.5 1633008.75 3020606.75 1922611.375 3025675.5 2198866.75 3067874.75 3788191 2617414.25 3455019 1747033 2321591.75 1777091.875 2332301.25 2189719.25 2979534.75 3006779.25 3160802.75 2559261.5 3216106 3819707 2431162.25 2159277.75 1800663.625 1756405.25 1490405.375 1631613.5 2798722.75 2290127.5 6985299 2978284.25 2354413 2431883.5 2042026.75 5734679.5 2375940.5 957055.625 1813244.5 1189913.5 1676766.625 1419677 1122912.375 1606416.625 3339988 1431871.625 1679332.375 1051436.375 1293877.625 1506588.625 1593150.625 842866.5625 1422074.375 792191.0625 2952829.25 1261032.125 1301821.125 678628.8125 795459.8125 2152217.25 1118920.875 1663006.625 609536.25 1376651.125 765456.1875 3898734 1171776.625 821885.75 1208069.25 1264222.625 840624.625 1681529.625 1025243.063 841458.5 2521199.75 1493169.125 1581009.5 1054910.125 1099904.625 1444977.125 3244861.75 3154242 1369056 566006.25 696625.0625 1216552.375 1089938 1592255.375 1203553.75 1120447.625 1534886.125 713087.4375 565871.5625 2421476.75 3398268.5 1186683.5 1551294 670083.1875 1093357.25 2843853.5 1371866.375 1049758 1326919.25 1800173.75 15750067 1465946 923869.4375 3520882.25 1368358 4242452 703937.8125 949888.4375 747429.25 2071990.75 1191688 2425508 1184651.75 1301267.25 1199473 2093616.75 1385898.75 1214966.25 1384809.25 1009722.75 1325402.625 1133723.125 14508295 1522499.875 1030671.875 1068393.125 1285731.5 2462617.5 1376703.125 1449034.375 1239134.375 2216101.25 707654.8125 2310994.25 1886527.625 1042198 33019488 4962581 1131598.25 1292785.875 1356897 930724.1875 1688349.625 1945923.375 1047265.688 1921136.5 1676488.625 1484565.5 1450579.625 3808619.25 3440592.5 3803505 3477567.75 1188272 1752734.625 2085834.75 3577411.25 2840091 1455060.125 2307820 1275685.375 1270766.75 1580088.125 867372.25 3958387.5 1350562.5 1580696 1094514.875 1167147.75 1386753.625 918972.875 2215424.75 584405.8125 1496045.875 1399853.375 1235935 530700.875 2130224.5 1718156.25 796873.375 821928.8125 1512152.5 2195132.5 4619729.5 1671271.875 1804450.375 1587235.125 1558398.625 825281.6875 1436826.375 936535.6875 2292687.75 637732.9375 1294383.125 1195402.625 1348266.75 1430268.875 1755294.5 2145081.5 1634953.75 1926890.375 1449346.5 1396361.375 877355.25 1949681.75 2088135.25 1740918.875 875887.375 705595.4375 2289796.5 1009500.563 2699517.5 2553327.25 2617468.25 2726479.25 1264476.75 3531548.25 3513043.5 708841.25 3297871.25 1480165.5 2038290.5 1351795.625 1220339.125 1312965.25 1297474 2061367.5 7621911.5 2863225.5 1637008.375 1182357.125 1490868.5 2173433 1060839.5 2032151.625 2379388.75 922297.375 2240929.5 1101069.5 1111587.625 1521684.875 1037743.5 1940994 1611534.875 1195184.5 1887457.5 2881923.5 788087.625 3791673.5 1152738.75 1171694.5 1460868.25 1551294 1194569.75 1141216.5 201700.4375 902051.125 1179807 2065613.75 3318847 3295565.75 2940612 1028722.688 1518723.75 946519.6875 1801592.75 2087730.25 1108837.375 5848631.5 2166208.25 1480459.625 2298151.75 10010590 1438694.625 3899301.75 552385.125 3335045.5 1410849.875 1255158.25 1230246.375
nicotinate ribonucleoside 81234.8125 111211.5469 70864.0391 92767.8906 98383.6875 67659.9609 99755.8438 97428.6016 81151.2188 53902.8047 113369.8281 104159.5547 106098.1875 121375.125 121598.3359 102301.8516 112512.5703 87120.9609 80000.5 73946.2813 135239.3906 92459.1641 137101.9531 96110.2734 136455.0781 136189.4219 54992.8711 92324.3125 134922.0313 76349.0234 113720 163047.1094 101071.3672 267272.7813 174874.4531 63633.4766 173921.3594 102518.2109 223941.875 204628.5313 164303.5 269331.5 133182.1406 164596.7188 118372.8672 75248.1875 190862.5625 166010.75 202171.5313 207782.875 176731.9063 309665 212175.9219 148646.6719 141674.7188 89655.4063 181207.6406 90725.2109 179550.9219 309389.3125 116975.8594 122781.9688 139787.6719 244644.4219 61894.7578 279148.4688 186011.5313 82718.1328 89440.1953 208151.9375 228190.9688 206040.7813 252807.1094 160464.3125 192444.5781 79882.2266 256250.4063 141528.875 207846.0313 143860.5625 178395.75 49096.2461 391323.0938 81872.4297 207221.75 249040.1406 161637.2813 263807.5 124805.9609 222640.0781 221419.9844 146981.0469 197439.6563 183958.1875 191151.5781 210016.75 194681.125 156881.4063 130218.1172 64589.2813 87395.7422 280767.8438 235767.625 150767.5938 104235.1563 125370.6641 208558.3438 258272.625 130950.8906 269335.25 171610.5313 338695.5313 143224.7344 324911.7188 90281.4609 58420.3438 253689.2813 275333.4688 250083.25 69268.6719 183800.7969 118448.5 121867.7891 228079.7813 169074.8281 377056.75 102419.8906 199833.0469 327785.4063 192271.25 208800.1406 160164.5313 196203.2188 235166.0469 249715.7813 407199.5 356982.1875 418936.625 267689.5 105763.7891 255465.6875 108072.4766 164371.2813 103796.7813 45689.1602 49594.7695 121729.9453 136325.2969 123432.3203 140489.4531 160924.9688 235113.3281 212899.4063 133760.0781 216675.2188 205562.6875 222902.5313 460627.2188 131601.4531 198497.7031 103115.4297 77355.8359 183148.0156 431011.3438 300631.6875 404189.1875 195609.0625 314533.5 147480.4219 155453.8594 209297.9531 197711.9375 187701.5313 113973.4766 85863.625 35288.3906 163831.7344 37749.1719 63297.8711 252687.5469 254009.7188 61816.5352 58979.3672 99784.8828 59529.5156 216801.9688 405448.4688 126575.3438 73851.7422 42603.8086 188906.4063 130225.5625 82135.4453 20622.0723 104167.8828 206780.6719 320223.4063 219347.0781 113376.9453 219813.0625 354320.6563 156235.5938 106790.2266 183602.3281 137601.8125 143438.9375 208077.2031 85625.3516 174763.9219 73511.1797 143817.2656 89230.3984 41272.5352 32916.8398 96421.9375 77738.1719 169736.8281 111210.6563 350573.1875 214818.75 264418.5938 136629.4688 152195.1406 179489.7969 274831.5313 175808.75 109353.7266 198401.4063 175357.9688 255844.8906 107520.1406 473215.0938 147913.0156 123026.5234 78854.4063 107800.5313 79732.6875 72017.5078 232287.0469 217970.0625 229655.5938 199141.75 260357.0938 60756.4844 114774.8906 147709.3594 300942.9375 288557.9375 83145.8828 414165.1563 131945.9844 395684.1563 234189.1563 166502.5156 112664.6328 57032.875 188125.3281 89981.1406 140913.2813 221666.75 174842.0156 140033.1875
N-acetylproline 693819.5 349760.9688 230318.3594 364814.5625 506997.9375 465654.875 737871.5625 333540.5625 389272.8438 1218369.125 414071.9375 622705.5 439912.4688 295409.0313 626873.125 420513.2188 195508.375 612011.25 187802.125 538769 450353.1875 208306.4219 3471064.25 2633194 750631.25 452911.8438 285964.3438 103762.2734 526466.125 212539.2656 980469.75 395153.8438 497252.3125 510385.2188 263055 349185.2813 492354.4688 380390.1563 643971.8125 377339.75 355400.1875 319627.3438 526341.4375 349727.5313 460491.9688 778639 157256.3281 311046.1875 490301.0313 504322.7188 1115944.875 1529480.75 922402.125 742661.5625 1635378.25 988743.25 479832.4063 353572.3125 300120.0625 2333897.75 667183.8125 192715.7656 777811.4375 484910.5625 2709597.5 133228.4688 1149150.875 362433.5938 748425.8125 575746.375 1548521.75 418389.4688 294970.125 133569.25 2712859.75 2779700 284263.1563 1064603.625 248422.6406 723135.125 702859.8125 1346674.875 963832.4375 562959.25 373038.7813 427482.5 295617.1875 1110444.125 167177.8594 211410.75 913410 139468.9063 1402020.125 530877.3125 727354.4375 737233.625 2796880 1285828.125 994871.9375 202005.0938 434992.5 953097.25 371375.7813 255227.4219 401115.8125 558305.5 351441.2813 116384.6406 208031.0625 505967.4063 458689.2813 735967.6875 1669836.5 544307 312631.8438 557256.8125 186768.8594 485506.6875 755063.4375 851504.4375 238777.0938 2501732 358421.4375 1223435.5 778422.125 2624300.5 226764.2031 582242.1875 841783.4375 1575183 918525.375 4426334 430820.6563 1163896.875 309095 477728.3125 295177 257604.4063 392611.4063 668650.75 124313.4297 1292001.25 605546.6875 693255.5 275714.875 198773.875 1507638.625 89805.75 218176.875 1856000.25 246334.6719 4188232.5 475012.625 729579.5625 438377.8125 270612.1563 294789.2188 133706.2344 251088.1563 367442.9063 424362.1563 2743113.75 232500.4531 571405.125 267556.8438 1410796.75 491643.5625 842725.0625 373858.7813 4910016 254942.3594 787939.875 285467.9375 994393.25 899134.1875 307803.875 427570.0938 1724008.625 923392.375 3570196.75 1155822.75 872310.125 609765.25 609894.5625 726370.25 1147998.875 711493.875 2052784.375 234116.1875 838058.25 523357.2188 2652076 557902 1217615.125 2990598 357369.4688 12566624 1095661.25 1363710.25 1011582.438 293166.7188 1136376.625 521750 557902 1417757.5 1124758.375 907950.8125 287870.0938 264481.8438 518396.6563 1109716 389949.3438 401627.4375 2751810.75 1158644.25 245663.4531 263490.9063 438111.0313 2769909 658439.875 225284.3906 476653.5625 82913.2656 523491.9063 725295.25 262185.7813 745081.625 1380166.625 688093.625 1965874.5 1729498.125 1567716.125 2834041.5 2534133 823019.5 590003.125 864923.4375 475780.1563 590134.6875 211358.125 1111793 1943892.375 951426.9375 3887927.75 368235.125 1412353.25 13765275 4795184.5 373322.5 1228512.25 332363.2188 6154986 282403.0313 254961.5938 1005102.125 599353.875 2564673.25 377989.7188 905878.1875 417621.5625 456443.7188 2666980.25 380991.0625 1535511.75 362142.1875 1042753.563 396526.4063 715458.9375 285149.7188 783040 358553.9688 436550.0938 557573 557902 170443.9375 508801.8125 3677779 854941.375 1211052.75 1849289.75 246445.1719 1758972.875 848717.25 197668.5 1702155.625 948081.8125 3049545.25 497044.6875 202958.0781 878907.5 527940.125 7106663.5 1171180.5
isovalerylcarnitine (C5) 5286346.5 4723989 5891418.5 8058401 3185632.25 7011018.5 2786814.25 7233105 2208831.25 9845963 7316766 6826989 5966031.5 4354008 4029610.75 5491346.5 2267505.75 9512525 3091359.75 5738185.5 2324425.5 7344286 6431947 4447857.5 5256374 2079429 5167531 2555192.5 6029976.5 6037213.5 2886924.25 2168012.75 5032241.5 7458264 4387539 2545726.5 9692905 14873177 7391106.5 2527774.75 2346165.75 3728258 2454308.25 3859577.5 7007961.5 7467366.5 5002145.5 1997847.5 2999033.5 7319341.5 12969300 9489713 6943993 8234656 18158360 2581719.75 3190803.5 8169959.5 4978210.5 8348119.5 14498138 14702640 151676496 4095557.5 17443150 7616833.5 6383479.5 2590092 12330219 8523935 37381268 5180594 10413927 3859279.75 18618970 16917794 2613009.25 2945552.75 6938796 12070390 24517000 19155954 17437066 13169741 2309647.25 7806910.5 4937382 31321756 6961687 5422915 3044259 8711097 86187120 19165980 3554889 14949542 22166776 7204823.5 15917948 4682712.5 4728051 41109848 19387670 7501679.5 4345469 8148503 8342388.5 3815801.25 10190202 6267822.5 8568804 7880916 9771626 4212324 2767971 5247974 5735042.5 54973444 41666604 22198288 28909014 28557266 8485198 46603700 9196264 8089016.5 8668433 8266728.5 5325749.5 26859602 32541350 6745573 7900431 16689063 8402625 2031105.75 19953492 6350755 2807134.25 92942168 3898208.5 2704652.25 63645812 16777032 6381800 5614016 2995090.25 8066884 15273739 7049321.5 5212224.5 6338852.5 2375837.25 4795824.5 24092344 5857091 9197098 6045048 8227168.5 5742196.5 5423619 14539222 11189285 10830498 14299883 6138315.5 5601514.5 11925694 23881172 9205011 2635280.5 3831162.25 4020021.5 5103743.5 7048950 5409486 4472415.5 8073060.5 5973053.5 7635616 12963098 8993799 115334856 15628139 20205700 9821131 13105310 5367509.5 60947528 12865857 9928146 30824432 6084024 11985684 4753273 5122160.5 2871894.25 17843262 19904360 4470332.5 19436262 2420772.5 45616348 9897940 5177618 14462005 7470851 13086230 5989922 10598891 15972444 5357350 3673967 11413154 21066116 7716591 7506831 9181564 16359040 16662212 3976902.25 49026984 46074996 27237220 5488765.5 5214414 5771836 26744910 2484941.75 8927829 16352876 8275171.5 5141903 20267674 8024129 11498922 22731666 26317170 4867842 4466586.5 14191757 19731176 5117262.5 14256422 2889691.75 6471366 11396844 7070504.5 2693540.25 3894943.25 2219384.75 9734859 9132993 2990376.25 12585937 108964384 7745881 4440785.5 5915196.5 3643218.75 77475392 7355224 6969630 67015312 5711110.5 2721355.75 12090414 14344228 8669017 4283610 12738723 17954560 11514873 4858614.5 3043003.25 5890722 7395922 10152510 6532118 4444927.5 8012328 2423395.75 4469468 1205461.375 6741073.5 11418343 11263336 10917634 6869049.5 7355224 3857501.25 13837378 7035753 4085823.75 5346171 2945031.5 13255103 5042291.5 7687149.5 8734013
7-methylxanthine 183849.1094 666903.4375 113380.8359 319489.4688 78236.8516 114894.6172 140213.2813 326064.125 754582.5625 771686.4375 745582.375 721222.3125 1841234.5 59426.6328 295020.4063 194679.875 257803.3594 436413.3125 480891.5938 607781.375 164316.4688 262715 217256.7344 88517.9219 374702.7188 2739868.5 244831.1875 122980.2188 515848.2188 695470.3125 2168790.25 311754.4375 103728.5938 416707.25 631707.8125 537860.9375 223169.6406 244397.8281 260043.7656 288695.7813 335972.2188 265386.25 100687.1484 1002878.938 107261.1016 844343.875 89538.2578 455036.0938 75377.3672 213123.375 429706.2188 841101.4375 1090449.5 252349.2656 620057.6875 640960.3125 380318.8125 107788.1953 450038.3438 47498.7266 116654.9219 165005.2656 27527.1953 267626.6563 287346.5625 212561.0469 74701.9688 742672 46325.1875 120574.8594 217785.9375 995215.8125 204148.6563 1625919.875 127552.9297 53486.6172 187970.75 508473.8125 199412.75 151654.25 2560793.25 407173.6875 1651574.625 967934.0625 148890.3594 100347.7969 666779.25 106644.9375 99891.4609 231555.8906 244305.375 198866.7969 415653.2813 45768.6758 368817.9063 247430.2031 896552.75 61974.2422 632573 98062.6563 120098.6172 274703.5625 114137.3438 501244.4375 867375.25 49942.8359 112380.3594 209861.5938 547005 213347.7969 494841.9063 124466.1953 273928.7188 733016.875 443757.0625 78574.9766 363870.9063 566375.9375 198120.375 367122.4375 393289.5625 647919.1875 1153859.375 125624.5313 1280404.75 483283.0313 228436.125 207021.6875 398213.0625 7749855 150452.8594 71193.5313 510067.4063 217107.4844 427848.125 74115.6719 90970.9844 2359800 88190.1484 297624.375 250120.7031 285838.5 102089.7344 1028649.813 46226.1641 63626.7148 68656.0156 709233.25 542129 59628.0859 46389.6133 709247.25 75866.3438 727503.5625 152331.6875 77041.9141 1250482.625 82606.0313 44617.8555 685269.4375 37343.9102 2508826.75 1071299.875
1-methylurate 274056.2813 795171.5625 51080.1484 249786.7344 64325.25 75153.2188 55333.8047 302310.4375 788614 606437.0625 353970.3125 390421.9688 52468.8281 207671.4844 118904.0938 224362.1563 331767.4063 367509.25 481617.125 235263.8125 80079.0391 178800.0938 143132.8594 285914.2188 327854.0313 274627.3438 511759.7813 915587.6875 2077150.875 225357.0313 437707.3125 1009528.688 707403.5 233257.875 333303 95620.5547 700400.5625 746552.9375 86120.0391 370094.2813 106624.4375 109590.1953 66010.8516 2271400.5 894442.9375 190053.2344 224286.9219 2817888 974373.75 144326.0156 3888989.75 163021.375 1535301.375 147518.4688 6519754 1667371.75 161321.1563 251748.0625 305408.1875 668254.9375 45416.5742 59444.9648 2725907 395058.875 209587.6563 221441.4219 1708093 2159653 388119.0313 1203087.875 598141.25 253728.8438 1299022.5 62505.543 532134.375 417323.75 366071 201043.1719 5289673.5 1009395.188 1882939 158195.0781 96101.1016 391848.75 73485.7422 125920.9375 124451.7188 47283.1914 49127.6836 516732.3438 173330.6875 277918.75 52895.4297 286740.25 213588.1875 2566341 44140.3008 196312.4688 97481.8047 5140563.5 527137.25 1086859.375 71891.7266 102569.2031 695000 544248.375 3107016.5 67928.375 5820584 98578.1016 1703427.625 94230.4141 228581.1875 76949.7813 2199515.25 133837.625 404582.4063 543146.125 85483.4922 209540.875 532585.5625 186917.875 140622.1719 659548.4375 1076563.5 3354680.5 254367.4063 71834.7109 391551.0313 194091.3906 224090.5625 45475.5977 213777.2656 5404429.5 203516.8594 77748.7891 68691.3984 133483.8125 4020632.75 146966.2188 337662.4063 145062.4219 119532.7734 2015317.75 57642.3359 3746413 477418.8125 106422.9297 614945.6875 542315.5 1048857.125 512701.75 812485 57046.0039 690290.4375 127945.8125 5544276 41273.1836 1404008.75 4253397.5 9995096 664290.9375 519191.0625 266285.7813 46885.6758 91408.8047 6691782 450013.875 911655.875 1246235 477966.1563 185897.4375 4759161.5 259426.25 411423.75 192645.6875 39495.9102 8442831 1063080 34992.1992 732824.375 297631.9375 1275146 587630.625 64117.5898 1836119.25 1334054.625 328943.5938 125410.5391 3070755.5 6417381.5 162000.9688 326003.9688 528846 281003.4375 143438.0156 162924.1563 1081480.625 1157284.5 1544458.375 2132510.75 778946.5625 5490282 11777223 134081.3125 1881848.125 593503.6875 10100137 78746.9688 241940.5938 8569993 91581.3516 3724072.5 333303 59798.9922 55511.7031 412911.6563 1675729.5 153517.625 1029283.688 3886879.25 79616.2109 1226827 58328.8516 128181.4141 307124.3438 226794.3438 4270823 491910.5 4329134 1950569 68016 1354541.375 217175.3906 1780247.625 3100186.5 241109.9375 62696.4844 3914499.5 981964.0625
N1-methylinosine 852912.4375 499137.625 614746.375 569176 488437.5938 1150343.75 345654.9375 716058 571284.25 1599698.875 673952.75 593570.125 572228.1875 551942.0625 452391.625 610339.875 496548.75 571888.0625 753280.4375 714793.0625 556132.5625 562227.375 1065615.125 755547.0625 1059234.5 381972.5 948490.5625 641300.1875 704304.5 881583.9375 564609.75 207231.7969 1263219.5 852035.9375 741491.75 469378.625 605182.0625 851629.5 634661.375 722826.0625 445347.1563 1297754.25 669424.875 975199.75 1058098.25 1129436.75 1136679.375 512734.7188 849089.125 805059.875 13673064 5312912 1623450.25 2891705.25 16660369 8809591 873084.875 1011918.25 462809.7188 13374701 2355052 1190666.125 12578776 1503347.375 10648295 693655.875 10227052 869187.5625 3668341.25 1256533.125 6803248 1204780.25 1572366.125 1197847.25 11445149 5236137 965741.375 3087391.25 4224887 8384497 13960300 6219542.5 11241395 5822087 1561883.875 3808701.5 839559.25 5171086.5 1220113.25 510399 2691814 635861.0625 5469208.5 6696333 3831526.25 3361298.75 19267144 7555465 11566222 476594.0625 2901117 2330590.25 5104368.5 1950500.375 959042.6875 4339097 1934374.375 811511.6875 841272.8125 1373059.75 855274.875 5495773.5 3082366.25 1947624.25 1509024.875 2666147 3865858.75 12772686 1914293.125 2909249 5540413.5 15527108 668610.9375 5831205 8081212 1789405.5 2430896.25 6472104 6041271 15511830 1559510.125 13706547 2171160 16609033 1726144.875 766875.0625 4064648 1964923.75 1700799 15777076 1646106.875 1433527.25 4690960 10324877 872168.3125 847148.125 1387423.625 1704700.375 8654572 2894037.5 2909728.75 8298123.5 600927.625 12141181 18970618 3324328.5 1618925.125 4157290.25 3094129 1431307.25 1062558.875 1254640.125 5396819.5 1703364.875 17697400 2393364.5 4812653 2237166 2723981.75 2500239.75 1989502 1673881.5 10771903 2345330.75 1390203.375 1480932 3504057.75 3079219.5 721463.375 2560701.25 1953019.875 16962092 1481069.125 18886370 5418690.5 1560531.375 5932719 2146534.5 4949890.5 10451368 5365493.5 9285743 1129480.75 8335787 2719461.25 24815882 1390892.375 10516377 20551434 1518269.625 14835176 1236968.75 6604225 5361717.5 824876.5 2412843.25 2592366 1767849.375 7351833 6300551 7445221 1628916.75 975241.125 8213715.5 5347896.5 2404011 1149482 22686528 5756020.5 4147015.25 4173562.5 2199094 21330434 8876976 2359264 1160247.375 1094771.75 4517388 2768326.25 1658130.5 3733818.75 4980760 1988696.125 8108996 9592848 4245920 2661795.5 16724985 15574635 580621.8125 3344530.25 4834093 6113338 3221559.5 1611798.375 1757291.375 6253641 7198972 6843388.5 11604644 749629.5625 5558867 17334730 11309816 2679020 12660702 5011253.5 15226805 919918.0625 2703201 6039430.5 1937845.375 676121.25 2485337 3718891 1227665.625 1490873 4511705 4864364 2030381 10919643 1155406.625 9643446 598982.5625 2355052 854089.8125 5285979 1261932 754854.1875 2680527.5 922162.9375 467269.1563 3100068.75 16254963 5511909.5 5170514 7058278.5 1495340.25 10999264 3495401 927108.25 4911968 1623775.5 11335097 931164.3125 1794404.125 2350840 1764405.375 17283868 7434094.5
"N2,N2-dimethylguanosine" 634997.8125 505888.25 547991.125 557826.875 420439.1563 739181.75 366266.625 624666.375 515926.6875 1290774.625 534721.4375 751358.375 485220.0938 547750.5 375290.1875 607278.875 479344.3125 489072.2813 612807.8125 741345.0625 536002.75 684379.25 836282.5625 660288.3125 941239.6875 593592.0625 1066763.25 484260.9375 683458.875 980511.875 603174.125 401639.125 1131979.125 797085.9375 809386.625 630617.0625 708669.9375 1251173.5 654135 847384.6875 579143.625 1327324.25 666538.5 931993.6875 1204992.375 984561.125 1334844.5 539352.4375 667005.5 562647.0625 11909205 4989582 1048601 2935540.5 7456428 7070737.5 737270.5 858071.5 379063.4063 14319823 2469906.75 924260.4375 6362713 1245568 14824785 663194.1875 6373982.5 792556.5 2755057.75 1131990.75 3319578.75 868074.9375 1204032 639875.4375 14559566 4112313.5 856720.375 2317118 3363647.5 8537427 11807475 6126105 7877461.5 5015773 1293557.25 2159579.75 561239.5625 5237204.5 1305771.875 807693.4375 1821276.5 503866.1563 6327991.5 3173660 2763743 2558091.75 16474488 6195912.5 7869917.5 436937.0625 2210641.75 1629710.875 2626460 1759048.25 792919.3125 3721412.75 1862641.5 762503.5 708574.625 1061819.875 1061197.375 3569647 2314864.5 1986211.625 1333741.25 1817645.875 1348826.625 8870778 1925092.375 2348746 4266302.5 20473720 774714.3125 3968536.25 3403118 1666168 1708129 2948609 5265332 12411966 834646.5 12498758 1491200.875 15400088 1758991.375 954601.375 2786339.5 1601244.5 1646288.375 14681634 1916017.75 1828248 3382505 5855987.5 961336 671655.5625 1073971.75 1319273.375 6580154 2188266 2560753.75 5624001.5 677050.375 5339199.5 21131214 2208622.25 1755428 4024048.5 2930492 905411.5 905311.125 1228390.375 3851068.5 1257624.625 10860033 1726411.125 3240300.75 1727267.875 2310613.75 1997586.875 1724321.125 1278832.625 11312067 1076327.625 1019005.438 1238806.625 3529959.75 2493354.5 637239.375 2105640.5 1646333.125 18810334 1595113.5 17503148 4760785 1256634.375 4602021 1678334.125 3122912.75 6496664 4444214 6842488.5 1124620.75 7688424 2209502.5 27303946 1104578.75 8402617 21359768 1070693 15200344 1074905.125 5479832.5 3645684.25 928062.25 1821276.5 2197574 1247963 7315013 5516537 6758640 1377182.75 1216858.375 7387937 4291019 1770447.25 1128533.875 23433582 2624544.75 4244949.5 2662598.75 1677234.5 29557270 7191275.5 1814305 850798.3125 1224042.875 4211987 2730247.5 1440595.5 3012526.25 5624912.5 1770307.875 11297784 11940656 1610923.375 2388110.25 16325893 9811257 819574.8125 2405784.5 4075751 4275199.5 3189494.75 2241819 1630450.125 6935648 5215235 3349677.25 8458244 550591.625 5194570 13028695 9360851 2194479.5 8499498 2621334.5 10710575 737073.5 2572167 5604412 1581021.5 546367.0625 12364934 3264904.25 1380345.375 1384528.5 3097105.5 8169856.5 1802308 10017359 919373.5 16190237 1064228.875 2244104.25 923824.3125 3766050.75 1363850.375 683326.4375 2147012 885474.6875 783970.875 2269690.25 12866102 4216238.5 5498635 7137071 972056.3125 9611967 2348998 728435.1875 3823854.5 1032513.688 9232920 768272.4375 1428457.875 2350127 1408777.5 13097434 6367675
N4-acetylcytidine 264114.3438 841435.75 489873.5938 441147.1563 443982.125 546692.125 200005.7656 520355.25 291858.875 1521132.375 361814.3125 465519.8125 444736.875 292163.625 103386.5703 448125.2813 318562.9063 438318.4375 468901.9375 494133.5625 576142.75 279036.2188 241215.8906 651329.9375 893945.25 266989.9688 223779.9531 444930.5313 734217.3125 408825.3438 341810.5 229237.7188 408082.625 615232.6875 342774.75 205194.3594 884793.25 820300.4375 233955.0625 818410.375 414089.7188 992884.9375 347653.6563 807480.75 847693.6875 684755.625 1077414.75 283086.3125 971295.4375 440794.25 3357041.5 4515193.5 937656.3125 1084865.125 2969939.25 3445407.5 460280.0938 622477.0625 157585.6563 4906875 2165439.25 333858.9688 6181766 511143.625 1278978.125 283817.2813 4400896.5 546300.5625 3829145.5 965881.5625 6235236 568767.4375 440278.7188 1876287.5 2260561.5 1775716.125 236219 2310025.5 2314180.5 3325553.25 4144988 3882777.5 4545771.5 3835375 927703.3125 2523243 299723.625 2658454.25 670531.6875 196734.9688 1484462.875 110788.6953 2109943.25 6223582 1430868.5 2369491.25 3881535.75 2087123.25 3542891.25 332351.0938 1484808.75 4162210.25 4752936.5 2788883.5 344784.5313 2239644.5 1516900.875 384192.7813 137342.7031 439715.0625 1722905.125 2067272.75 1356811.75 1031838.375 1860193.25 811106.5 2914415.5 1545885.625 1232563.375 2361223.75 5068389.5 438457.375 4315897 3937343.25 1566494.875 963105 3562875.25 2003389.25 4429656 1422655.625 1989183.25 1688860.5 3137825.5 776152.125 1254885.125 2235109.25 625489.1875 1085843.375 6337048 3874069.5 1461431.5 3806650 5922297.5 192735.7656 338971.9688 597792.25 296461.6875 2875448.75 1724289.625 1784333 4283420.5 5047125.5 6621692.5 2477564 2217209.75 2701501 2851453 766335.375 668867.625 891370.1875 2072435.125 867836.625 6404032 1357197.75 5376442 1316633.25 1615265.5 1431531.25 2357296.25 931946.1875 3890775.5 657967.875 707630.4375 480289.5625 3664201 1302190.75 277306.375 901452.625 949236.375 4435521.5 1004743.313 4040328.25 7466454.5 703281.625 2866554.5 846430.5 2867041.75 7916958 1849351.625 3452780 690507.625 2173352 1799371.375 7029512 1240023.125 4979673 6837838 1190729.25 4091551 3410523 4510298 871910.75 951830.4375 1923461.625 736957.5 5397236 3758843 1808801.5 1203659.25 1461431.5 2455037.25 3052971.5 1234074.875 647483.0625 5746491.5 4702324 1894710.875 1987033.75 1278332.75 7386600 5209334.5 1426632 455805.3125 543243.6875 3123543.75 755332.4375 1248142 2554374.5 933908.625 2153476.25 4275244.5 3069363.75 1877769.75 7117345 5635035.5 186074.0781 2361844 2386305.25 5791828.5 2530695.75 1786797.375 966521.9375 1980155 1906635.75 2845058.5 3114719 505340.2188 2002875.75 4055887.5 3063689 1493524.75 5038501.5 1740986.375 2077232.875 246299.4688 988197 1980300 1570279.375 252251.2656 2051927.75 1240759.625 791650.6875 2223694.75 1579625.5 1418730.25 7783043.5 336934.9063 421325.5313 822771.5 1560830.5 407101.1563 2421293 1325493.625 2507358.75 304478.6563 738392.5625 1734438.375 2191559 2688300.5 1438400.125 2693281 657040.3125 7654268.5 2988162 432053.9688 1291726.625 2235210 3055277.5 1045650.563 3520609 968555.5625 582341.3125 2357372 3073421
cysteine-glutathione disulfide 232326.8438 617849.25 1137967.5 654298.3125 819297.6875 657565.0625 596735.875 500737.8125 3234352 550844.375 476034.4375 2317640.25 3599884.75 2804813.25 1716478.875 2370693 2052697.875 1224544 543948.125 3363184 2729762 4235351.5 1948852.25 816224.4375 955678.875 6617766.5 422574.25 1214337.25 5251823.5 2712954 2764900.5 2869206 7512864.5 6865357.5 5068500 3789161 446031.25 6229151.5 2147101.75 802286.1875 2824079.75 338534.8438 1984190.625 744981.1875 1223985.5 6147792 874566.9375 3220518.25 153893.5781 387363.9688 241589.625 300893.5938 815837.75 254812.4375 140499.3438 179463.6719 125964.6719 129666.7734 646655.625 398786.8438 140449.7656 3551268 1403356.125 212461.3906 196190.2813 659159.9375 4172340.25 165041.7969 142069.1094 124948.8125 564973.0625 420170.3438 314657.3438 429074.625 1413209.375 608212.875 257229.9531 5067795.5 422713.5938 106681.875 180424.9375 137601.1719 375979.375 97021.0781 160832.5 6449639 133001.75 54652.8008 617676.0625 977902.3125 828197.6875 727307.875 84878.8047 158132.6094 337057.4375 261933.5625 189628.0938 132651.8594 98838.7188 90170.0859 269130.125 128069.6875 96801.9531 213220.7813 4156642.25 581396.5625 194185.125 314354.9063 1885564.75 324737.7188 477316.8438 356335.9375 5569177 1421482.125 143245.9219 646408.5 877713.6875 6100762 44195.9766 100766.2813 572568.375 439428 287827.4063 259837.1563 152050.4375 393628.0313 114569.0781 179000.8125 124344.7734 202144.7344 445373.7813 238401.2031 600200.125 416417.1563 343104.5625 286382.25 246342.8125 270308.5625 119404.75 310985.875 131430.6719 348361.5625 525872.6875 287784.5313 229036.3906 9275215 154629.375 255500.1875 2160352.75 216206.9219 492955.6563 105394.7266 528672.0625 128302.5469 905660.3125 532233.125 303364 98867.1563 105857.8203 715658.8125 573221.0625 5449061 502880.0938 800302.0625 901865.5 229999.1094 95149.4141 229486.4531 255885.0313 226222.6406 449815.5313 300197.9063 1110965.75 459026.375 154217.1719 113589.1797 1623611.125 449266.3125 1157903.25 128624.75 231128.7656 445234.1875 88501.8359 1775745 3280701.5 120150.9063 1580881.875 308592.1563 200538.9219 343265.0313 396816.1563 99586.5859 67247.1797 684949.5 233846.2656 439428 175907.9063 266306.4375 1112158.375 179324.1094 237658.7031 177533.2813 6572930.5 72542.9297 59185.0313 155451.2031 78342.6094 244795.7188 483076.875 188516.9219 273160.5625 279922.4688 8823873 1159200.875 2203680.75 221130.75 378176.5625 139526.2188 1682396.375 1760564.875 578900.6875 1378889.75 1217976.75 489981.4375 277022.6563 133516.5156 351628.9688 201852.5313 335753.25 471166.8438 778621.75 508570.1875 3332044 497762.75 636526.375 119988.0234 752559.75 5373847.5 487856.5 141541.625 6184689 594905.3125 1681225.625 251761.5781 104768.5859 4440823.5 601373.625 439428 827625.8125 536237.875 146793.5469 194662.875 227560.7344 346193.0625 273585.4063 326651.2813 1235073.125 6172972.5 148527.2344 262747.9375 275773.9063 3050488.5 190736.9219 216013.3438 420943.375 291416.7188 84183.3594 585573.5 1163095.5 168047.7344 3027406.75 8120272 1425750.375 537010.1875 639842.6875 400711.5313 773540.5625 10089696 467522.375 268569.6875 676758.25 1025528.063 136760.7344 1994262.125 1983073.625
7-methylguanine 3515088.5 3044810.75 2963030.25 3274285.25 2711517 4025321.75 2949358.5 3243611 3497139.75 7231406 3399269.5 3840982.75 3491770.25 2955643.25 2804408.25 4440054.5 3443074 3470349.25 3334212 5339657 3184158 4164495.5 5444914.5 4617395 4211700 3249371.25 4992701.5 2878867.5 3688874.25 3268569 4182519 2385953.25 4632782 3879344 5290661.5 3077274 3141415 5287898 3527558.75 3751376.25 3339970.75 3885082.5 3407455.75 4307876 4179816.25 4599492 8026755.5 3306426.5 3208844.25 3379450.25 12951059 23526612 4055156.25 6920840 14710750 7846173.5 3530452 4149584 2319740.25 12652129 8016424 4893892.5 10022934 5149692 8584973 3619071.5 12720135 4832708.5 12270205 5994720 13846724 3921004 5221422 5256772.5 3479611 10037688 3705056.75 7577320 6182853.5 7871908.5 10799512 6727040 14338913 8426512 8065793 7630411.5 3623671.25 9725886 4946225 3692817.75 8447401 2582181.5 12721809 7045230.5 13141980 12411137 24410060 5304311 8129326 2506940.5 6486687.5 6876624 7405557 6739392 4442030 7111509.5 5900869.5 4181018.25 3431470.25 7054442.5 4711576.5 6654499 6173708.5 5285073 4453011.5 7395935 6383533.5 5414772.5 6755973 10125249 30994356 6774416.5 4515519 13109987 14135752 11101577 3868962 15100810 4627208.5 11721208 4940076.5 10910761 4170595.25 13035147 5435962.5 4493424.5 6117671 5211067 6177107.5 11365079 7282133.5 5555492.5 17330792 18718986 4650224.5 3906418.75 4690351 6337700 13168860 6496165.5 6371590.5 11043370 3106423.75 11784089 9258285 8250237 7985469 11682084 6524056 4566478.5 5083364.5 4502168 7963514 5267624.5 15798309 6483226.5 7549211 6305368.5 13910906 8365652 4701813 9958084 21082586 7033417.5 4413530.5 5105370.5 9853898 9651924 3502399.25 6142221.5 7706035.5 9125256 8038570 12074288 10846605 5398942 14497062 4916862 9590241 15164173 8058345.5 11976895 5016413.5 16036298 10497974 7098239.5 3741880.5 9980137 10055322 4116105.75 6498223.5 4511075.5 13122971 9253262 3500798.5 8088805.5 8332087 6918707.5 6383533.5 11292155 6783936.5 5560299 4187767.5 10402104 8808497 5568933.5 3467430.5 12189815 14489396 3300801.75 4225869 7016300 8660415 8110197 7133931.5 4575052 4389538.5 5418647 11105344 11922611 7210432 31682444 6739876 17263928 27199972 7469202.5 8524437 17398468 4986193 4788708.5 5905931.5 8523526 7519904.5 5208579 7299043 6395476.5 16417249 27230062 7354647 7116488 2408801.75 9222472 18447054 6898762 4771748 24734254 7978014.5 5864834.5 3299251.75 5434010 18425934 5551957.5 2910905.75 14385653 7373074.5 5901587 8787913 4956461.5 27228378 4328176.5 4538441.5 4307929 7841497.5 4755897.5 8818126 4789386.5 11201289 4936086.5 3709999 11453315 5172097.5 4350303 6399441 8048140.5 20797440 12478088 7243778.5 5022122.5 9275408 9801595 5283470 5343122 12683688 11442939 4482533 5066912 7757956.5 4601910 24057464 8912343
3-methylcytidine 154524.7969 268986.5938 294535.125 184882.5469 199199.9844 254321.8281 186585.7813 315387.6563 282456.9375 171551.8594 246220.1563 193174.4844 299129.1563 332134.625 259175.6094 387955.5938 198971.9844 234147.2656 325832.0313 415738.0938 168879.9844 288588.125 309782.0625 332593.4375 376324.8438 263406.1875 280783.2188 286937.9375 491950.875 288001.5 384587.0313 188516.0781 350428.9375 329355.625 303319.5625 282066.8125 388934.25 300250.6875 440126.25 247513.5469 219566.9063 169696.4375 203673.75 343031.1875 299273.0625 225918.5781 267101.0938 326810.7188 182102.2656 423743.3438 334250.0625 300593.8438 429447 268117.5938 582620.375 246096.3281 149094.2188 116302.4141 321330.0938 429385.125 78157.0469 248122.6875 47261 263134.7188 175979.8281 294544.9063 395300.7813 470908.25 599282.0625 204449.3594 314743.6563 478002.8125 156525.4844 435721.6563 195041.5625 171895.3906 223363.125 357012.75 356882.0938 466372.3438 672879.8125 518016.0313 391648.1875 188876.3906 302074.3438 229111.5469 47120.5742 104388.0781 43150.1328 44265.2344 635720.4375 122375.4844 337495.75 286915.8438 162961.7031 288456 340682.5 114603.7188 403597.2813 820695.0625 642059.9375 868532.125 121932.3047 291605.7813 126744.5469 210170.5938 177476.9531 256154.9375 267832.9688 337566.7188 372577.4063 669542.8125 275107.1875 313380.9063 66380.875 159018.4375 409529.125 400644.5313 361770.5938 131858.7813 242671.75 319286.375 563246.875 334892.5625 267386.0313 549921.4375 220429.2813 564654.125 425953 276264.4375 601694.5625 223291.1094 74396.3203 204592.4844 255656.1406 477021.8438 231610.9219 292143.0625 187390.9688 185037.2656 117827.7891 211501.6563 208608.3281 382495.2813 382778.2188 638684.5 233007.1719 821568.5 70660.7813 420205.5938 523522.1875 288456 236031.4844 257113.9375 412662.5 194114.1406 165113.9844 77393.125 442390.9063 430133.8125 538077.3125 278380.4688 140322.1875 245320.5469 360633.5 231296.5781 117148 487463.5313 347551.2813 171720.5781 387378.1875 260963.4219 1029338.563 296090.7813 181625.25 255622.0781 379311.1875 150377.4844 294357.9375 242749.4219 301462.25 355157.4063 590097.6875 440718.25 91998.6406 753095 169076.1094 473138.2813 550240.6875 336356.4688 261400.8906 1309781.125 687993 148298.8438 894400.9375 190205.7188 180505.3594 49289.9844 136430.4531 210111.5469 563575.625 414033.625 353224.0313 161371.9063 210967.1563 686014.3125 282956.0313 116592.6484 258922.7656 605419.6875 333261.4375 371702.5938 321792.875 158690.75 414623.25 438485.0938 564736.125 159250.2188 300692.7188 267808.0313 252958.3438 203065.5 714851.375 908851.875 173575.25 483371.75 303250.25 465686.875 282467.625 425903.1875 67569.6719 225523.0156 291369 572997 167074.8125 442295.6563 192406.1719 260880.8906 440101.3125 301003.0313 320233.8438 210202.3125 143560 330273.7813 524956.375 678825.8125 43633.1797 409594.9688 636810.4375 357886.4375 282201.7188 464235 363412.6875 371208.5938 334554.3438 209636.0781 513634.0938 215974.5938 308456.5625 193650.4688 250710.0625 480898.875 264342.8438 385472.9375 285543 229128.9063 84835.6016 248199.7031 53377.8477 213934.1719 565779.8125 671335.8125 324121.2813 129969.8203 221828.25 568644.1875 411499.625 214437 289442.75 278826.375 160392.1719 215264.7031 295413.625 200305.5313
N1-Methyl-2-pyridone-5-carboxamide 4317577.5 5737900 11059702 7495482.5 8912695 17320866 9181960 10402775 7638540.5 19415970 12732548 8230700 42698596 3980498.25 4350662 12725601 10717283 12129437 12004548 4730398 7560345 6540789 9543980 2920016.75 4834100 32118212 12726383 8379466.5 11311591 40386692 5696472.5 10830087 9700977 16049905 3186065.75 4805940 7673753 19888504 11293451 8634354 8026888.5 33696500 11378453 7449445 30332394 29193378 2320836.75 20525170 15394277 8865665 138134256 40194164 18974292 14771505 34802364 36770916 4326563.5 14823508 3172034 112946696 19812214 2568967.75 181496656 27163966 60836872 4691472 27086742 2548883 86637408 8215391 7714289.5 3538050 5567191.5 5682962 41091848 46807936 6881017 11606759 33140342 16831112 20836816 19384238 35876000 37524028 17153740 46963464 8343335 49232096 2805350.5 33248006 6049018.5 3300992.75 31564252 34578212 34501772 41810944 250749200 124181896 50388168 2263982.25 46269708 17449454 64348400 7388028 4495597.5 103943408 12628466 2377929.25 7375931 2514809 17648558 132575544 5380256.5 16555010 10161992 49275444 28394902 243943136 15790908 10922769 8548895 242420688 4514433 43809848 43809288 2847540.75 17310554 26097026 83291080 182838464 39727644 60727608 45562264 46963824 17959526 3279954 40129280 12589899 3253880.25 86567472 15610501 6599917.5 33546206 36042164 16489157 2203693.5 1554699.75 18988498 80130792 33308116 19847560 60874540 931023.5 280029376 86005064 9681346 11266530 13039551 2754331.75 3686866 3854993.5 7615801 26177450 18683410 132624456 29388402 155541168 27235758 3516593.75 20462752 3463512.5 14511157 94154808 11458423 5717734 3559968.25 19572172 9687436 2711104.25 10534324 39066740 143336848 1910998.5 61180260 39177560 1155295.125 125749976 15830204 12220906 76223288 15414358 4575140.5 6554103.5 5104687.5 38741600 326139264 5842165.5 28625166 35462452 617412.5 137553696 989671.3125 83277152 19143754 4954677.5 4554410.5 12680559 14661567 132366344 34648780 76930200 6936445.5 10777525 47746068 15647442 32502714 23339686 122481904 27563706 43344288 40003492 5833309.5 214275424 54431108 26426588 1077263.125 1504142.625 7045803.5 105932920 15371354 34304352 37227308 7506609.5 18841872 71348192 8366724.5 9157299 31500718 78848152 4238712 62567168 96064016 187406192 10847319 5029732.5 3188242 7646932 95545776 47625444 80093168 2916454.25 8231805 96499904 135456016 7846576.5 47281964 44369392 163157520 1433918.875 24783690 24494686 3025839.5 1488631.375 18884132 20924562 15830204 3784863.25 29998584 4574558 5922831.5 151399552 3671919.25 486448512 1361322 2341901.75 28575096 24598924 978675.125 2681137.25 18197362 15152014 2709093.75 19372674 183983040 6689196 3276649.5 18929300 1283663.375 44335980 6497888.5 2442011.75 27990494 3671479.25 54491332 468361.5625 16959106 3336687.5 17003324 57483696 83632288
N1-Methyl-4-pyridone-3-carboxamide 2878618.25 4262211 7734015.5 5003025.5 5434699 9551434 6066156.5 7329051.5 4620648.5 14764448 7373426.5 5016255 30024604 2246237.25 3503802.75 8073108.5 7263087.5 7574655.5 8276431.5 2931493 4237571.5 3871538.25 6782007.5 1883166.25 3804172.75 25604376 9331463 5989669 8193771 28652028 4165121.75 7804486 6096598 10359752 2633663.25 3790048.25 6612055.5 14594680 9713295 5944126.5 4493524 21030616 6767247 6058029 17227838 17411782 1652951.75 14642077 9589114 6637980 82001512 24699664 14242490 9370901 18977894 22785504 2676660.5 10427814 1857574.5 63469668 9639265 1742296 93757512 14967303 34254208 3268906.75 16911490 2075026 67202232 4264997.5 3311637.25 2496665.75 3684863 4097956.75 19664266 26847106 5194488 7236364 23329492 11035383 12409944 7768113 23091944 27302776 13943975 27410292 4453511 30718796 1680417.875 18798004 3940647.5 2359501 16467577 24014722 16108279 23854866 119161928 60346552 30346878 2006808.875 26494492 11204584 40549344 4266686.5 2559795.5 76018280 8745432 1399411.625 4750104.5 1513255.875 13189843 77003136 3183717.25 10390924 7842195 25382326 19368558 130159264 10850874 6745952 5285159.5 126615560 3052783.75 20988188 28490274 1418622.375 11711480 19660878 61457300 87727336 24573370 28340438 29399358 27450366 12894322 2124037.5 27236684 10270406 2514831 57043480 12748598 3297725.75 16221404 25739912 10422097 1396448.375 940424.1875 12759266 53015444 23091206 11868723 41245636 297914.9063 198704736 44108852 8265075 7277275 6596725 2063989.75 2715255.25 3216140.75 5865115 15185813 10338192 97313728 18645354 116521256 18966788 2488597.25 15624530 2177692 8642572 39652216 8508822 3452872.25 3069885.25 11275244 5460662 1316165 7642743.5 26386160 113355136 1742913.875 39405800 26967874 890878.8125 90788568 10282083 6199169.5 47109120 10476243 3088933.5 3428977.75 3310140.75 28191092 163642480 4276544.5 18854888 27526526 376163.8438 86061312 543759.5 61397788 13151995 3070883.25 2460980.25 7342064 8908707 82418944 18943976 48709988 4986683.5 6721062.5 36399076 11609034 22035416 16788558 72027136 24910014 26087418 31596822 3834548.5 138782768 34950136 17420356 793932.3125 1722131.375 4511443.5 87839864 11839175 24504710 13546812 5131928 9032732 47993136 5275110.5 5220458 23985550 47504520 3032199.25 45814392 70221896 118504648 10390924 3950212.25 2310804 3442303.25 31386600 29944968 46700836 1583819 6370297.5 54987152 86527840 5797342 26175496 31451694 93326048 969728.625 24427260 14521921 1834793.75 1068513.375 9711170 11591497 10624606 2770112.75 21347402 2210042.75 4295237 109654328 1670093.875 243018560 427220.0625 1266744.125 21024924 16654521 492617 1516430 12729103 10887523 1201193.625 14523055 80317608 4428165.5 2134720 11300338 858776.9375 21991042 4814562 1794588.375 17636924 865016.5 34244260 241472.0938 12462318 2500359 11918802 40991056 52863452
gamma-glutamylisoleucine* 1250864.625 763538.625 638481.875 931663.9375 398340.2188 1126476.75 687041.25 707529.75 727095.6875 1439480.25 964041.6875 649248.875 744884.25 542797.9375 657315.8125 867962.875 444426.8438 944868.8125 395027.3125 898024.5625 335299.75 1015799.5 835580.5625 720698.5 734967.9375 492689.3125 809770.6875 431899.875 632704 715557.8125 395976.8125 292669.9375 533160.9375 622860.125 754529.6875 423657.25 804238.75 1180372.125 416893.875 516661 350642.9688 1159741.375 360108.5625 594414.4375 1122517.375 678156.875 1018182.375 310089.5625 1072720.25 786262.8125 2045261 3084502.75 2225623.75 1232197.375 1280952 1475675.875 749445.9375 957026.5 745307.5 1497965.5 2653138 658956.6875 1975447.25 616008.9375 1373661 907284.4375 1853853.625 290360.2188 1780031.5 269548.2813 1797738.625 788325.8125 683377.4375 572057.0625 3066088.5 2276320.5 489940.7813 624226.125 332794.9063 760261.375 1097706 3790513.5 1930905.375 860245 326323.9375 803861.4375 581992.125 1104781.5 774813.0625 739744.4375 593456.25 747210.375 1422041.75 2589723.75 1130148.75 832422.5 1716390.125 2506118.5 1764898.125 319305.0625 427614 638567.125 2393816 1276895.125 461454 1147136.5 1250585.125 348760.25 473614.5 709285.125 1477748.25 1844254 1361102 913705.9375 357968.7813 787952 981759.75 693902.5 844751.5 1315425 2437531.5 1140763.625 300284.2813 4302104.5 1327830 795791.75 652578.1875 589853.875 1173662.75 3669272.5 706173.8125 3510158.75 755478.3125 1562465.625 920808 582997 924052.4375 1282303.125 255851.4688 622070.3125 719816.4375 881541.0625 3789308 974000.125 453867.0625 383078.0313 1290852 631562.75 1197043.875 967679.3125 1111362.5 734241.625 450298.9063 525471.4375 2001681.125 940972.125 1905550.5 1069616.5 594002.5625 820266.125 374214.5625 681916.125 872647.9375 1254266.125 1604752.625 841829.625 908253.375 1483141 520422 1345990.625 2014238.625 529294.6875 2137322.25 799653.3125 970026.375 941500.6875 1552408.75 1084458.625 1206957.375 948280.5 360254.4688 1522421.125 547673.1875 2034430.375 3497113.5 930226.75 722504.5625 1417210.75 774629.25 928307.9375 1302822.75 2247631.25 298202.9688 1106303.75 482859.8125 2391331 356250.9688 1258930.375 1882314.125 193801 1462580.375 500822.375 749714.8125 3268206.75 614998.5625 426171.0625 1335517.375 1065283.375 774513.375 1953687.75 549895.1875 1070934 626258.3125 1162579.5 1599522.25 721869.4375 506927.0313 2131757.5 993065 1247831.125 862391.25 807634.75 2912763 873618 1430735.625 455065.5 532838.125 929753.6875 290609.4063 540971.0625 576454.6875 1314974.625 833618.6875 1916491.625 860245 342459.9063 1406096.75 2387410.25 1134940 708961.4375 1240577.5 1253096.25 840601.3125 682178.5625 653051.5 263588.0625 938637.375 1596526.25 1882188.375 1607312.5 413623.9375 674443.9375 2190793 938333.125 1124887.25 4815915.5 433368.9375 2295187 578818.3125 699096.0625 1239422.625 691816.5 662637.1875 841559.5 595295.9375 684182.75 777761.375 1112019.375 1553461.25 639892.5 1406473.75 1282822.5 1672606.75 403582.0625 406485.3438 387312.875 1462947.875 645086.0625 1049801.625 716754.8125 962356.9375 654118.375 548441.625 2337751.25 989576.5625 1350873 1718595.25 357551 1067274.125 728470.875 518557.6563 1586607.75 697723.9375 1821667.125 858098.8125 707618.4375 680662.25 1319419.625 3233643 330493.4063
gamma-glutamyl-2-aminobutyrate 310625.7813 251683.75 390212.0938 177349.7813 77098.1484 282444.1875 196370.3594 150789.4375 280649.6875 288797.3125 200092.0781 151513.875 193496.9063 180926.6094 312692.2188 250778.0156 192637.3125 293347.875 173480.7344 148428.3594 241424.3438 284802.8125 251628.375 332731.4375 209270.6875 545549.9375 169727.8281 157472.5781 210977.6094 251278.9531 137359.6406 249559.8438 123928.2891 232532.0469 288350.3125 108846.0234 274189.6875 410340.3438 132710.0469 254372.6563 171673.9844 233240.75 92243.8906 134942.3281 210772.0781 188439.125 310996.8438 332593.5 129887.9063 986041.375 683815.75 201039.0938 409982.1875 476674.4063 298813.9063 84457.4063 689480.9375 504530.625 812203.625 3588842.75 1027023.938 360548.4375 126983.5625 628758.125 871642.6875 567749.625 82237.1641 506582.5 1650485.25 791678.375 195594.9375 774785.75 1245855.75 1983113.5 158932.2188 452310.875 389045.7188 426088.0625 4013117.75 254375.0781 162114.0469 23378.502 340140.5 472162.7188 337270.2813 153376.3594 835150.6875 313691.0625 374876.8125 544351.75 188170.9219 452255 769895.25 850198.6875 217974.625 66622.6172 109998.6797 596936.5625 710379.3125 434738.3438 400172.8438 136028.0313 354867.125 218928.1094 76051.5625 526662.625 518266.5313 161153.2656 622447.875 362640.7813 148478.5469 730838.25 293006.3125 223124.9688 265243.1563 1351601.75 1421487 429589.5938 131208.7344 2301431.25 227936.9688 693017.25 118559.1172 188998.1563 517285.5 582923.875 445005.9375 501683.7188 897956.0625 197560.8594 181903.9531 754098.625 161368.5469 913800.375 697195.5625 2111039.75 223729.5938 165981.625 142398.8281 1241809.25 273557.8125 494908.4063 215834.1719 480521.3438 299403.9063 765349.4375 160101.1406 515011.625 965162.6875 300776 254495.5469 152093.7031 76465.6641 252310.1563 838316.0625 941275.625 322759 380177.0313 128193.1563 142352.5625 2041905.875 333458.2813 641405.3125 391545.9688 347933.0313 339253.5625 1625349 1163653.75 546397.25 320696.5625 184797.9219 370194.8125 4397778 420317.6875 110450.6797 420740.6875 237377.6563 322759 311902.6563 1322825.875 129584.75 249699.8594 864219.375 603037.3125 335984.5938 273611.375 247700.75 1225554.5 196933.8594 369667.9375 466604.9063 1415883.25 48907.9063 729534.25 280032.4063 272706.2813 179968.8125 440093.0313 241744.7813 500437.0313 985448.5 234862.3125 256954.3281 624191.25 918088.375 242525.2031 618780.6875 461467.8125 236026.3125 371693.3438 239409.7031 175432.25 568901.375 902386 718523.375 1347325.375 2852167.5 241149.4531 448427.5938 190220.6094 171480.6719 82796.0156 460582.5 129305.9453 1397599.5 503065.5938 104947.0859 127669.9531 664291.6875 962478.0625 62552.1953 868391.6875 566785.375 326444.3438 136179.8906 477677.2813 287443.2813 422960.4375 1042589 484933.5313 953542.25 241051.2031 304817.375 584652 302946 322759 284075.6875 780554.6875 1295796.375 890778.6875 442517 229015.1875 234628.25 473628.75 315955.875 556425.0625 775241.5 423956.8438 278743.5 93819.1563 204766.4844 188460.7031 327274.75 725786.6875 145968.5313 734188.4375 488688.6563 266149.7188 61483.6094 727543.0625 321848.3125 570194.3125 223814.8125 829810.625 1009116.438 514031.5313 214824.875
2-methylbutyrylcarnitine (C5) 1220086.625 972195.25 1211740 934937.5625 921246.5625 1694086 659979.25 1325643.75 933855.6875 4412406.5 1607409.25 1552223.125 1292399.875 663738.0625 1224658.25 1435908.125 729290.5625 1491133 1016880.813 1078242.25 849735.1875 2115948.75 1894987.75 1273150.75 1925562.875 915289.6875 1412931.125 800501.3125 891300.75 828483.875 1019465.813 663445.625 1913781 1505468.875 1051878.375 529880.6875 1509781.25 2213112.25 1349813.375 1192450.5 985767.1875 1937566.75 513480.9375 1166189.75 1659551.375 1527727.5 1422365 650360.9375 847768.25 1039779.813 8457384 6488432 1757959.25 4323088 13907582 2623460.5 845834.5625 1934361.5 649552.5 6904949 3990652.25 5869044.5 73536984 1383389.625 11644202 797902.5625 5026326 1224303.875 7548994.5 1989732.125 13079397 1653202.25 3091804 1237914.125 12245193 8690924 2492814.5 3101855.75 7920583.5 3523374.75 5770734 14134741 14501401 6934148.5 786888.9375 6697167.5 1194131.125 11893332 8067750 1073070 1540116 979943.9375 32216054 7134560.5 4248253.5 7470290 15351892 8464687 12256482 1397114.5 2047493.75 16373236 6132881 2009087 1647902.625 2963155.5 3068391.5 1735341.5 830837.25 1316389.875 1331135.375 7069618.5 9258605 2431043 883708.9375 2788086 3660621.75 28884126 6768039.5 9444417 9561993 17620440 1194872.125 11344820 6932668.5 5240464 4215201 4097152.75 2629502 30017288 15040347 5241768 2139602.5 11555866 3942534.75 995086.25 7205213 3133211.25 1556100 16885468 898828.75 1995386.25 34654732 15137224 647762.9375 751024.125 1329592.75 1320867 14577538 3066571.5 2831544.25 6682932 762181.0625 1581781.375 16044243 2663340 7118895 3430946.25 3186024.75 1924705.625 373986.25 1112968.375 4279746 2278329 22230698 4566968.5 4510805.5 4227982 5266236.5 3784129.5 1263962.5 919192.875 4801602.5 2516355.75 1798572.375 967443.8125 2771276.75 3412271.75 1374868.875 2015253.5 10129525 5691801 4893163 12027822 19711748 1078269 7637437 3312121 21628792 6420034.5 5264153.5 15053282 2262489.5 11178920 1810333 3665036.75 614483.125 7072375.5 14384684 323790.9688 15194177 648030.875 23185988 5624193.5 1071195.875 4773150 3020431.75 6003811.5 5792235.5 6756706.5 25153780 963233.875 1603543 4577334.5 7237698 3813075.5 2027227.5 10355657 8200366.5 6826440.5 2129537.25 6678672 24350302 15013934 2657804.75 959240 654096.3125 4802460.5 798346.4375 2044829.75 7944733 7471307.5 1329732.875 10331039 4329203.5 3229655.5 2543216.5 14135942 2164537.75 1006379.938 5115635 3228648.25 6563679 1373827 1200423.25 1066129.125 3619135.5 6574406 982649.625 4041217 830537.3125 2617184.5 6134568.5 3167153.5 6028928.5 104625360 28179676 3134846.5 1750870.625 954870.5625 29064794 1395994.875 1183466.75 23097516 2576299 1751515.375 4279232.5 6438120.5 3424209 1167988.5 4614092.5 4871662 6281364.5 997373.75 497499.5313 374236.8438 2623460.5 2423598.5 3211454 2524824.5 1130361.125 497454.0313 1228689 2523722.5 959049.9375 5305627.5 5269417 1677435.75 2581733.25 2187279.5 710567 2783332.75 2189305.75 2207532.75 703545.6875 1556278 2629736.5 1424231.625 5608895.5 3126640
malonylcarnitine 64332.0039 44693.1953 35587.7383 52780.0352 71236.6875 100327.1875 35967.7813 89391.875 49197.9609 86721.5391 65199.8828 58054.9258 70350.5391 140682.7969 46272.7422 78891.4063 109278.6797 68108.7109 125944.4141 80313.7109 53652.2188 52038.6016 60267.2109 62018.7578 102676.6797 57281.1367 80356.2813 163494.0469 29097.0859 65718.0547 463477.4375 475235.875 179219.5156 151138.5 333011.9375 329421.625 42952.8672 64508.3203 53548.3359 632677.9375 276595.9063 66587.5859 557049.8125 58623.1641 428019.4375 294286.0938 71108.7969 186603.8125 144086.7344 54531.3281 132367.5781 278013.75 150235.9063 110528.0078 253993.5156 276250.5625 298484.8125 566609.25 286080.5 79433.1563 400138.5 54512.1406 96611.7422 1149864.5 371250.8125 410396.875 156847.3281 473466.3125 521851.1875 73020.875 160419.375 102069.3516 664649.8125 130318.4609 69007.6016 311636.4063 100376.5234 27015.8047 75203.3672 106974.2578 88529.4766 502979.7813 164828.2031 116246.8906 87569.3203 433668.875 192309.9219 743811.625 108350.9922 61020.3438 1157255.25 43770.5 341114.25 90049.6406 124901.0547 140813.4375 269482.9375 894772 402661.75 61989.957 628796.1875 139263.7969 80880.1094 1590425.25 157099.1406 305703.5 199444.125 47565.957 67309.4766 534286.9375 103392.7734 128807.7734 285145.5938 204202.6563 778594 113319.2188 104018.7188 172677.5781 142057.8438 103342.9531 78334.0547 72852.0938 77987.4688 444792.4063 79845.875 171572.9531 101200.8438 22416.2773 71688.9922 220375.6563 96716.2969 43297.9961 152389.3125 74556.6797 149887.6875 204357.5469 66792.9063 3908199.5 183144.4219 217572.9531 151138.5 607535.375 350905.3438 185924.3906 219528.7813 182822.7813 126623.4375 696784.6875 105695.1484 285582.0313 681460.6875 79462.5078 702327.25 112208.0938 83719.0234 555653.9375 446342.0313 232056.5156 63508.2734 821324.6875 346533.9375 81547.2109 1388939.75 106438.0703 136859.75 176123.5625 1266329.625 327166.7813 76920.7891 20671.1289 132928.5 285462 210554.6406 98189.4531 211590.625 349896.6875 351376.1563 55934.0234 109913.2969 459508.2813 236504.25 285794.2813 187734.7813 141181.7344 289817.0938 121283.4531 90907.2734 317736.3438 173983.8906 344637.875 527443.125 576501.9375 573093.875 382696.8438 85515.1953 834766.25 165252.7813 69175.4297 111908.1172 1251964.375 46698.5078 1127741.75 268908.3125 47718.9102 351571.7813 668617.4375 163861.1563 338024.5625 535324.25 77537.7734 45402.7031 368956.0313 68627.5625 120203.5234 70109.3594 170710.6094 511286.7813 202025.6406 618480.3125 362062.2188 796046.3125 175617.3438 47792.9063 244504.375 1013896.125 61759.2891 218485.8906 33553.4844 925326.9375 377145.5625
glutamine_degradant* 56410396 34911292 58103792 26445394 35776960 68316952 17210700 47511992 61441524 146974352 100226344 19681410 145327376 41244248 56071564 38551208 74635640 20279524 41743860 253256752 44362920 193314880 60254896 109535608 172240080 52481412 122149880 67164952 224256128 52640984 76667480 25649792 108914184 166809984 116536576 59447820 44452068 50225776 72485912 90303416 26289920 28611082 46396856 161530592 258674928 109224896 69387472 24091420 39318472 56767172 975856064 243983968 225080160 208938112 209881696 261662688 169774352 355896224 59664684 667357952 541864192 28966802 190288208 158819424 311096448 7606965.5 79312808 343942432 121267472 135337056 62236460 70260248 48507232 12636749 342568864 100817792 77823080 55110332 40723844 131262352 86482168 59172268 43980588 29965708 31955830 20284954 108872368 34040332 4914785 22173868 17669008 8400036 32582304 116957776 253751360 422843840 180782928 857073472 523750272 79314232 15442606 102448872 327393088 81185696 21382478 174500624 60237396 125422240 49039792 38828972 114677320 203449840 131847328 44424164 124250744 37798084 88520720 652012224 268080048 33532250 346596256 237265168 170360096 271706016 115791296 77422832 175665840 469260192 234465232 532842976 81134040 138110352 80502200 55143404 13714708 4296702 55228948 74015568 46652364 741588416 112278024 11872105 424380768 241858528 91930752 142954368 125660472 73312624 376008800 56605320 170637936 27445532 12125233 74777232 640504256 224232064 14964298 14250101 101208832 100478392 12610095 91303136 119679688 39346968 1306519808 103422784 297050528 22400312 719204160 42905688 8483546 93772832 386905408 331407168 111215760 93514040 61532080 39631448 68610056 209590512 7506239 441937408 147977856 251124784 113501352 136603616 640521728 117870576 547716224 327740288 145655504 310447872 60222388 231909424 40943700 208317536 45405732 337674816 551783424 13274233 241408880 13892695 12782757 300402432 340450592 91839616 58050216 8443738 512656480 35734800 9912050 36135500 9075879 532966528 305106016 132459504 41576136 240544128 229841920 476874880 196600288 99755072 593672576 240085616 202239200 56955268 236018752 56212364 131639248 367080544 168969312 1404180096 217047808 354198880 907317568 109846264 402669344 336980096 683266240 49462392 236350912 530594432 92995032 39274636 62216940 95339408 470970528 298019104 143124528 162889648 31474936 499495232 205155920 135875472 57181552 227963904 52622500 135706192 11833229 111569768 325249504 332920320 81932456 28439708 158891200 26663518 124581720 287729216 99761664 60057484 96697624 22704678 149929312 8172190 142644720 70839304 136734192 18746158 128053968 43575796 95770392 120248464 129228832 109224896 61813868 373886752 307539552 64789960 522567872 525622272 134357536 177505008 337716416 190318640 495565440 21967698 177679584 42788388 141060416 508664832
homostachydrine* 1409632.25 1130454.25 284324.1875 1723620 466687.7813 938283 1139553.25 361104.0313 509556.0938 4429149.5 1954250.75 4299659 2280055.25 2934855.25 240499.8594 2697330.25 1238700 869297.25 805205.625 7681979 5670198 102793552 337120.8438 1168648.875 5426477.5 4063749.25 2022129.125 937512.875 4507575.5 780876.1875 710166.375 2088155.375 1402506.625 3988799.75 1051308.25 855104.3125 1912088.875 1827877.25 2611580.25 1816146.375 875343.5625 783734.4375 1358354.25 764674.4375 2951030.5 1066505.375 5166514.5 25687460 804684.0625 393535.625 6197977.5 1225638.25 354626.875 635917.8125 463953.1563 281620.6875 1367448.75 326048.9688 200138.6406 6555480.5 399261.25 233017.0625 3286095.5 2208461.5 8253712.5 183335.1719 1470636.625 1407001.5 218432.4375 2404299.75 3543236.5 124736.4766 3275274 49953.1367 354208.1563 107623.9844 334551.5313 206508.2969 182547.3906 113740.1953 879380.5 1812448.5 156370.625 446633.875 282410.6875 191417.4844 431877.3438 1177982.5 114036.6328 459073.0938 214625.4375 575636.0625 172955.4688 340804.0938 2022561.5 11032189 489577.8125 393262.8438 1308627.75 673863.0625 144597.6875 231920.25 212769.0156 84955.5391 1774730 280177.0313 224391.5313 190485.9531 650757.3125 2012720.5 713482.4375 430344.75 5767605.5 468801.375 421728.0938 1398297.375 47510.5078 186664.8906 322956.4375 2849858.75 519744.5938 249720.4844 528473.125 243786.5781 641651.5625 292150.0938 2692368.75 2658641.75 927361.625 141530.3125 727041.4375 784499.5625 123547.375 773113.9375 570748.125 254601.9219 154636.2969 223930.0313 325878.8438 207382.7188 2390250 360225.5313 1863723.75 553244.625 1726769.875 1023659.375 1058608.5 345709.6563 752160.6875 130514.2734 1615395 543670.625 451961.4688 368771.4688 663263.375 329470.0313 428567.3438 113775.0781 72369.2813 3874078 561035.625 209612.8594 638268.75 1019581.5 194800.7188 97080.8984 415114.875 6330198.5 1693252.875 2012056.625 674890.25 634072.9375 218261.3125 110758.4844 266462.4688 182514.5781 683815.6875 245272.3594 249556.0625 2511628.5 5595177.5 1522535.625 215082.4688 1064726.5 1336038.625 249289.125 303747.5313 457829.5625 120783.7734 494186.2813 1056828 97619.0469 402476.0625 477183.375 282631.375 3617882 130362.0469 511658.75 617308.0625 151367.7813 109930.9531 130559.4609 745684.6875 178740.2188 826234.5 72256.7266 626376.875 3779159 543495 154035.9688 656690 2141207.5 370279.7813 85282.0547 175050.2813 126639 2001962.75 925321.0625 70734.4922 9254869 111400.5781 3315019.25 316322.9688 3127686 879822.9375 299072.5625 1164621.375 1479854.375 374543.7188 471864.1563 318603.25 1245120.625 2325292.5 614104.9375 1702928.75 638791.125 146500.9219 131472.2969 126990.5625 229896.7344 447633.8438 1284706.125 1968931.875 686019.125 69106.6016 1493652.875 1112448.375 3954814.25 1577633 432876.7813 2482005.25 675800.375 2033984.375 19862118 427554.3438 1005241.5 1131235.375 496795.3125 52816.7109 395402.375 984778.25 1361002.625 167583.8438 171637.0625 271297.1563 407139.9063 276920 248018.1875 1043020.375 2446589.25 867813.3125 1088103.875 993665.375 1013435.438 909968.25 855448.5 301091.3125 629250.1875 5387238.5 10356556 256877.1875 488839.6563 185256.0781 620752.125 2877506 260343.25 2255671.75 375195.9375 408821.2188 149616.1406 229113.1094 632584 1171455.25
N-acetylcitrulline 503199.6563 523215.5938 204241.4375 402137.7188 548530.4375 334201.7813 77030.6016 119228.1719 286203.9688 504737.9688 211997.0469 385990.75 232050.0469 306009.5313 340275.4375 226564.8594 418309.6563 149826.1719 394071.6563 344092.5313 276711.875 173224.0313 408935.0938 792018.3125 164703.8125 241701.1719 168456.7656 56707.2305 185482.5625 187488.7344 855528.25 361913.1875 259600.7813 633238.5625 183557.2969 338809.9688 591064.625 451394 1585299.875 451394 1309955 608466.0625 700994 233390.9688 892048.4375 801580.5625 187712.7031 191034.0156 2621392.75 359165.4063 680416.5 526596.25 522719.7813 1640870.625 165725.6719 1681782.875 458472.1563 698658.6875 537923.375 113395.4844 123133.3125 176954.5625 106278.3828 477775.5 246202.7031 318652.5938 206466.4531 3998842.25 1793028.375 1021983.75 65312.4023 601918.875 932817 410407.6563 1163985.75 733152.5625 1388004 368312.9375 116680.6563 58257.3945 273859.3125 487455.875 643667.9375 59309.2031 9208985 359986.2813 67547.3047 5556364 120029.3281 640277.9375 120414.5313 187264.6719 1306450 134769.7188 3201325 352821.875 341142.625 109552.0547 197582.5313 463977.4063 4302835.5 468642.0938 123363.4766 196986.1875 78948.3828 1005265.875 3429399 494091.5938 363636.7188 110668.8906 591281.75 235089.7656 618104.8125 373441.8125 668704.75 3639469.5 574511.875 1912751.375 2823965.75 176851.1719 1511749.875 1044845.188 130487.6406 160690.6719 4628372 400356.625 2807821.5 180540.375 457533.1563 1956003.875 1158272.125 77489.3203 291803.125 762113.0625 191144.2969 1026208.625 3218418.75 1264659.625 1551326.25 219209.25 253013.4844 2362939 1984235.25 195420.375 409174.6563 300004.8125 414006.1875 696256.9375 1679160.25 237907.75 2739325.25 47318.5469 540572.375 11015879 4924137 191780.2969 970378.4375 1298388.25 3979989.25 2187131.75 177564.8906 12747508 308228.0625 1310888.125 1211460.875 254614.625 1079951.25 508321.9063 107378.8594 63705.4961 299086.125 860166.9375 361269.9688 1006340 1800349.375 637740.75 532928.4375 516115.1563 63683.2539 451394 914746.1875 751706.1875 2332358.5 337331.5 176129.8906 3723256.75 660802.4375
glutarylcarnitine (C5-DC) 1360436.75 1280909.625 1737077.375 875528.125 1627529.625 2444329.5 1046856.813 1251890.75 2089025.625 3215110.5 1744043.875 1592274.75 3434694.5 541035.1875 1447182.125 2326126.75 1680420.25 1167600.5 1179276.75 1154360.5 2245094.25 1511120 1790010.375 2214160.75 3115668.25 1450092.125 993394 2213718 2582858.75 789456.8125 1520338.875 1508318 2663946.75 2575744 2324455 932053.3125 1098040.75 2080146.5 834676.25 749347 1489362.5 1071242.5 1000006.375 2105968.25 2497308 5679301.5 1605095.5 958434.75 1252944.5 1043703.75 14090424 5178757.5 1038298.563 3137926.75 7762378 8354012.5 2182965.25 2044870 607182.375 14789962 3561373.75 1862884.875 5392025.5 832446.3125 12090310 579511.0625 5323139 1188258.125 1605599.125 1206903.75 4033706.5 1104954.625 1768326 426149.4688 7685975.5 2623095.75 728751.3125 1313443.25 2041430.25 5788797.5 4114684 2455842.75 7736319 3581557.75 183216.8281 1578273.375 900982.5625 5051916 1528633 857425.75 1096916.5 538131.375 6392345 4421970 4432073 2574362 6829457 4879803 11164271 469788.2188 2051942.375 815188.5625 4295134 1348441.875 1602828.25 3846983.75 1775800.5 1224452.375 1446112.625 1031746.875 1803723.625 2497308 2764029 1525683.375 1446133 1884667.25 2816229 7481134.5 3088868.75 2347350.75 16461177 6758851.5 894921.5625 5042385.5 2839411.5 3327748.5 1257986.25 3823412 3289982.75 8565133 1681325 23247752 4869452 4300711 737960.9375 538546 2439985.5 911539.5625 2022767.625 9212999 1598615.125 1297384.75 13464315 5110801 801100.5 1703508.25 1255612.625 1663988.625 5381634.5 1656969.75 3078828 2769645.75 216599.125 2593079.75 12376774 3199295 2632517.5 976172.75 3980541.25 1187028.5 1183961.75 1221822.125 5808437 928784.875 12528259 1634999.875 6542989 2084867.25 3496185.25 2159809.5 1175833 2040493.75 7316020.5 1900994.625 2588819 2451552.75 5402084.5 1827603.625 926803.875 3039861.25 1242925.625 9131051 14544787 7953007.5 6125235 2711158 9710087 1760059.625 8169192.5 8743958 1819453.125 7605719.5 877964.875 2543063.25 5707385 7541582.5 2036507.875 7717072 10477486 1024544 19223424 401311.1875 2912362.25 2338148.25 802259.375 1616123.5 670130.9375 630172.6875 11728722 3395216 3897642.5 1315113.125 1115923.5 6982186 4780404.5 644543.5 1220484.375 10429430 3358629.75 2003935.5 4721688 648913.1875 12502811 6424972.5 2913126.5 2440550.25 1636223.875 3918260.25 2610832.5 5369197.5 5902989 6943834 1439210.625 17375120 13858265 5584128 2806031 9846944 8154519 2955074.25 4466099 4480016.5 1878461.75 3344327.75 3846355.75 1173798.625 4824320 13203681 3579770.5 10241535 514550.4375 5448583 39752576 9376230 1675485 7399699 5628533 16196581 634433.875 1089027.75 17697450 1521835.375 1062742.375 13654475 3560281 1090473.75 3356843.25 2881378.75 6711632 1374753 2343441.25 1724165.875 13246244 3530582.75 985185.8125 694380.875 2589389 3012684 3427919 4717144 3390312.5 745474.625 8988318 5155797 6890036.5 9948800 7957649 2221708.75 8174181.5 5623171.5 2552085 5340568 3045744.25 7647340 968096.3125 3276037.5 4252555 821771.1875 12968121 12246655
beta-hydroxyisovaleroylcarnitine 1062227.25 1257253.5 1738457 790870.8125 1455263.25 2732266 1353007 1481666 1956511.125 3668721.25 1105694.875 2263145.25 1297674.25 990505.6875 1195308.625 1565414.875 2081591.875 2526655.25 1526566.25 1138544.125 1900380.375 1852755.375 2381059 2277468 1209103 732865.6875 832751.875 946019.9375 1462838.25 1418627 1709560.75 2143448.75 1337502.875 1891198.625 1558538.5 489095.6875 1608115.375 2261748.75 2045851 1299182.25 1249123.625 1891861.125 1538842.5 1167090.25 2335574.25 1635468.375 1596459.5 961315.1875 1715753.125 895400.6875 10976834 6766348 1486363.375 3177014.25 18161734 2311927.25 1161307.5 2081371.625 1390402.75 3416701.75 7654476.5 7733993 43710188 1940652.625 11624040 2034479.25 12039733 1480885.375 7124798 1161685.25 15564272 1505583 2042416.875 3291456 9751074 5806289.5 2569746.75 2718457.5 7181017 6130114 12598881 15855263 10013016 8558781 1270180.75 5546493 2283135.75 14287443 5188195 1094827.5 2386878.5 1041770.813 27213052 6509718.5 3165616.5 4855611.5 15237623 3533534 8606052 944411.875 2672155.75 4069391.5 10093669 3104305.75 2426716.75 2637211.5 2865080.5 1945094.75 1398011.75 2139931 2699310.5 6596674.5 2933930.5 5046039 1326136.875 2686243 3277623.25 162289568 5675643 3669069.5 28675084 104591992 2917890 8091577.5 22508636 10362531 22435632 3668616 3924457 30136136 6724272 3428613.5 2442604.75 21274232 2590761.25 5104258.5 11057351 8342656.5 1960258.75 30902442 2674934.75 2702599.25 27126020 5677328 1038922.125 1958274.5 1929989.375 1844596.125 11182227 4292749 1793485.25 4027204 985274.875 2909311.25 8799760 2198598.25 4050243.5 3701906.25 5621456 1582275.375 2361946 3119733.75 4118340 2302653 5009972 3838045.5 8606475 3338019 3152416 2459595.25 1805101.125 1010311.25 16553443 1219179.125 1782023.875 2734315.75 2698985 2196452.75 1695317.125 5366675 3781806.25 8743555 2126465.5 10081239 21389104 741730.125 12592683 4546844 6052645.5 4649529 4426366 8844684 2328295.5 4375729.5 2944586 3080195.25 859701.8125 9420690 4437106 2856343 7078779.5 621322.5 16875444 5672962.5 1212255.625 2911449.75 2416153.75 2665902.25 7197427 10086026 7699835 1341027 2995898.75 12567286 6384860.5 2595543.75 3130526.5 6072036.5 9840975 10865453 1865486.625 3360228.75 29036834 11803797 2842258.25 1596687.125 869539.6875 4743523 921938.0625 1285686 5089382.5 9032585 1643637.125 7594206 3539464.5 3298832.75 2604490.5 15323132 3620536.5 1094578.75 8267807 5447742.5 3081460.75 2027150.25 1440376.375 1678793 3326418 6238625 1917429.125 3367502.25 885885.125 9546931 12715232 2477827 3029163.25 29463498 6987015.5 2555752.75 1096643.125 700137.625 23046336 2076478.5 1074166 43422528 3689447.5 1001959.563 2208899.25 8759406 9466692 2321296.5 9351076 1733877 10593248 6401935.5 612700.3125 1320295.75 2408609.75 2718457.5 1671911.625 4118470.5 1358067.5 749994.0625 1023295.25 1566598.625 2047640.5 3884859 2663602 1026292.563 3992142 1760327.125 991032.6875 2260452.25 2228333.25 1501216.375 1566717.125 7566770.5 6278740.5 1535131 7772694 2974567.25
2-methylmalonylcarnitine (C4-DC) 51848.1602 400094.5313 269449.5938 144485 158179.1563 169865.7969 213724.0469 292854.875 137003.625 170296.9531 383545 120279.9688 185991.625 122490.9531 331691.9063 103578.5625 131580.3906 2977124.75 776539.75 378298.6875 484080.2188 1808927 1666079.875 151695.75 46193.6719 4970266 627701.5625 1217148.25 2969574.5 517806.0938 378938.75 120630.4766 707034.8125 292799.6563 2464935 599364.3125 78246.6875 431908.3125 1766422.375 2289357.5 724120.375 724298.25 1196194.25 1655712.375 55862.543 2322379 925901.4375 249955.0469 251767.625 2073816.125 2090001.625 112010.0313 459481.3125 700032 108360.3438 248394 227577.0313 432859.2188 466461 202082.4063 3604808.75 4374016.5 814798.0625 346559.25 191169.4844 1124649.125 2268869.75 4477195.5 1430071.25 118314.5078 78260.7813 139198.0469 3783820.25 326252.25 243750.3438 1902640.25 417187.5938 207226.2656 1155925.625 387849.5 3890351.25 185730.2656 130492.7188 496872.625 277175.0938 2465661.5 488536.0938 536753.375 217270.0625 396013.6563 2171005.75 742303.3125 399870.625 4556740.5 7570490 883176.375 2106116.5 2058858.25 836322.125 560012.9375 1585259.625 649768.1875 823285.875 4915336.5 197181.1719 2922212.5 5928762.5 3922027 242497.6719 1684804 295561.875 783640.0625 614956.625 785107.375 156359.2031 7053707 343973.0938 147416.8125 920215.25 7595493.5 1790179.875 68267.1563 49756.1055 275119.75 1233039.5 1474607.125 113097.2969 540375 2651382 798234.3125 416567.1563 391842.4688 5223862.5 1208483.5 1080030.25 465825.0625 826704.6875 188972.8125 102411.2813 562410.0625 1297947.125 892133.3125 5135646.5 2657308 12872219 4955765 1928904 657760.6875 6503521.5 403545.5 2530572.25 32725.6191 1927432 1513332.5 1126909.5 1296302.25 89437.125 3612679.75 1589080.75 3140518.25 106303.7266 219814.125 410417.125 3880736.75 1180192 3173799.5 3567233.25 1593344.625 970208.9375 2367093.5 4804395.5 5634346 3498284.25
tiglyl carnitine (C5) 446184.8438 318669.25 1036266.75 492410.4375 405324.4688 2306776.75 528374.5625 535304.9375 646148.5625 2237873 525056.1875 1056663.125 449720.5313 473513.2188 462985.0313 857772.5625 525175.625 784851.5625 730007 373794.875 720688.125 1061744.875 1328474.75 760689.25 870800.4375 617888.875 834180.8125 379151.5625 899465.625 451754.5938 546664.8125 741099.875 947862.625 1571573.25 533320.3125 174149.6563 794053.75 953800.6875 557842.9375 545236.125 280923.125 952844.75 490253.6875 575245.375 1521642.5 404848.625 2058756.5 286788.4063 517506.5 314276.7813 9711635 5260508.5 947119.5625 1776165.875 21222590 2417880.75 522256.9688 857153.1875 453970.3125 6680003 4022470.75 5810812.5 13984215 679613.5625 16716481 431670.4063 6560851.5 442787.7188 3575624.5 1173239 33501246 522201.2813 821275.875 834819 7622874.5 2502519.25 973147.875 1519990.5 6458769 3001782 4640093.5 5275333.5 5711461.5 4083140 243417.9375 3780648.25 398375.75 3822646.5 1378985.75 373014.6563 633626.875 458381.75 22104004 4651163 1843401.625 3204684.25 29495272 5749853.5 13938609 670438.875 1389299 2226817.75 2572056.75 1608446.625 657633.6875 2269348.5 2556770.75 599497.875 299950.3438 876715.125 404215.4375 2896985.25 2798133 1998770.875 298027.6875 1164955.875 1437558 7110227.5 4533464.5 2244481 16634753 13242270 684003.5 5087385 6579103 2387570 1229218 1337239.375 1560533.25 11072968 5380695.5 2195262.75 1026814.875 5965603.5 980805.1875 485472.5938 2910745.25 1450418.75 1597188.75 10991004 1446344.75 1143979 36521444 3954027 296087.1563 320088.7813 818516.5625 447669.6875 8164831 1082791.125 2511761.75 3656192.25 594500.625 1028009.063 11013915 1159562.75 1848746.375 2307979 5218793 601075 708679.375 913411.5 3861931.5 1198325 5642153 3285438.75 1760736.75 1547704.25 4759880 1865039.375 1043859.313 525471.3125 16030222 1549180.125 1018435.063 614216.125 3489147.75 945584.0625 655655.875 1436345.625 1906387.625 11620400 1067188.875 2248563 8500374 649043.4375 4386279.5 1568945.25 8211709.5 5056009.5 1955132.75 5087785 760614.1875 3084434 1746731.125 3115876.5 558776.0625 12548275 7722819 479455.0625 10326866 245275.7813 5853725 2260744.75 588470 1100503.25 908570.75 427791.2188 2156030 4258576.5 6449958.5 390236.0938 1714163.25 3145242.25 7142935 1110849.375 1385140.5 3224693.5 7331793 2515073.25 930304.75 721983.625 12614644 8042806.5 890338.6875 1226558.125 375708.7813 3273187 670489.8125 1023308.75 3012828.5 5047228.5 1630168.25 7731575 2994135.75 5694516.5 2357868.25 16998724 5128791 930480.9375 2028455.625 2644222.75 2559883.75 1297933.25 638366.75 1149068.875 1978510 14665231 1499061.5 2689195.5 334424.875 1772610.875 5219270.5 1971928 3263657 20095390 3438077.5 2394191 513858.2188 965295.25 14101421 955715.0625 768405.5 33287304 2070609.25 776927.5625 2394300.5 2379786 2724726.25 421987.75 3358805.5 1986152.375 4795749 1169653 277409.2188 168564.6719 1499061.5 2252311.75 2487219 2941208.25 473377.875 267821.25 628392.25 1119022.5 756787.5625 2485504.25 4829745.5 902854.875 1687794.875 1494587.125 593430.4375 1264560.375 1098565.625 1149813.75 505934.1563 822060.9375 3329437.75 699345.8125 5944432 2151436.25
N-acetyl-aspartyl-glutamate (NAAG) 121758.8672 102152.8594 190231.6563 137078.6719 107059.5 141199.5 173598.5938 146292.0781 170675.5625 157193.5469 140460.6719 108953.0703 249968.5938 128178.4141 154484.8125 203453.375 147609.2656 105981.0938 149360.9219 134766.2656 177032.4688 128710.7578 96980.0781 114936.2422 55716.4336 182746.2031 129361.3984 109598.7578 189290.9688 97443.0547 265810.4688 96452.9453 230702.6875 194450.7813 159301.5 68666.7891 142883.2969 148423.1563 150231.6094 144049.5469 217221.4688 115119.5313 185620.2969 247873.25 115580.25 159209.6563 189690.75 108492.1641 115875.8672 79847.1875 1619724.875 1079508 192428.5938 354916.3125 1858254.875 1153619.375 113898.8516 120916.3125 83361.0313 1290058 1918341 821902.5 2340521.75 207285.5156 3989357.5 195035.5469 1243508.5 154420.2344 775048.625 272492.75 3544765.25 208366.8594 725559.5 311606.9063 2919763.75 700151.4375 303880.9688 588115.8125 1976971.25 1071988.5 556603.3125 1989494.125 3268017.75 1022274.313 245389.7813 991136.625 183862.0313 1013777.125 864636.4375 175057.6719 757485.9375 121902.7266 3397635.5 1286258.25 683599.5625 1109307 2501731.25 562838.875 2166012 445338.8438 222025.0156 1050065.125 584942.25 521358.4688 364859.7188 455865.5 480948.6875 183953.0469 164506.5469 322692.375 235387.625 1021676.375 460531.4375 397825.4375 467977.5 311309.4375 291195.5313 3854094 1070430.625 741040.75 2476608.75 2980115 235421.8906 1346632.25 2843928.75 1168241.375 596331.0625 431797.125 843556.6875 3260547 1278415.875 673608.1875 173606.2188 2352171.75 521914.375 231331.5 1166114.375 175650.5938 242176.2656 2359465 485581.5 692153.4375 654241.125 1875694.75 99664.1328 289350.9375 184963.3125 294452.5 1309960.125 655189.8125 569589.5625 1703821 184621.7656 746131.5 2702132.5 420704.4063 423329.2188 1517370.125 1388600 169205.5156 293747.6563 468960.9688 932781.875 148644.2813 1842457.625 995771.3125 1397380 522607.3438 675380.875 544311.75 778682.625 87934.875 1756596.75 158672.6875 114731.9141 336808.9063 647839.5625 608482.0625 261792.8125 565108.875 886117.5625 1020820.375 413679.8438 1520455.875 1170152.625 272848.8125 814438 935900.5625 1300096.5 362517.125 460953.25 1519142 423925.4375 2410994.75 677741.125 1738068.125 97684.8984 1848883 4524588 466835.625 4401847 269247.7188 1305228.625 1228101.125 167451.375 621277.6875 816127.1875 970958.5625 455865.5 2095112 1770071.25 287142.6875 323689.7188 482760.875 998128.1875 308331.75 211778.125 5299639.5 964966.75 1958466 271365.1563 323135.9688 5629182 1238626 369043.125 350545.9063 258199.5 896016.875 349844.2813 347877.3125 824094.5 1326479 247759.5625 2046775.5 1585927.25 1103857 508428 1644326.75 2433027 133089.8438 450777.75 346157.5313 510220.625 342173.4375 269765.8438 234231.7188 1200765.125 1000146.438 329421.1563 548314.6875 71947.7578 464187.0938 1876468.75 522076.25 487781.875 8522991 1515741.25 342252.0313 191012.5469 143369.9688 2341601.75 951777.0625 85248.8516 6434055.5 634929.5 314762.875 200071.3594 180847.9844 1180240.875 245992.5625 295554.1563 216696.0781 2404761.5 391540.625 328814.9688 127456.6641 301950.2188 945336.1875 206584.8594 359660.5 189475.2188 171929.125 119488.5469 749440 837916.0625 826823.75 966969.3125 168492.3281 1528125.125 581432.0625 229200.9844 228743.0156 642365.8125 516991.5 209632.0625 557038.9375 280406.4063 58159.6211 1424546.875 637494.25
glycerophosphoethanolamine 3678325.5 3194740.25 6696574.5 3900901.25 4777640 4859918.5 7291491 3668897.25 8041452.5 3818224.75 5350904.5 4913540 5044151.5 4417008 5685203 5284755.5 5247719 5388256.5 6558781.5 4404570 4652923.5 4436218 7059264.5 6284887.5 5148508.5 6732487 4701363 6634369.5 4770848.5 4232829.5 6589809.5 7962763.5 4040175 6524819 8386729 4115259.75 5956827 5358459 8290354 4413269.5 4985711.5 4551061.5 5219648.5 6142316 3843116.25 8395702 7218968.5 6881968.5 6462487.5 5126082.5 2618990 4306021.5 3684796.5 1311920.5 2979601.25 1403630.875 4486888.5 1191411.125 2513854.5 1939333.125 2852534 1177216.5 5475227.5 1674707.625 4096569.25 2035895.625 1430976.125 4210057.5 4599211 1013947.063 1818813.75 2464308.5 2011682.5 1661502.875 6519360.5 2119032.5 2830281.25 1644003.625 1234412.875 2127814.5 1701141.5 2786501.5 2900514.5 1661046.25 3733167.75 2107312 2384361.75 2696491 1104565.5 3409570.75 1618268.25 2710121.5 10022368 3045960.75 1586578.875 1692276.25 2219045.75 1757726.125 2235634.5 2491259.5 842408.125 1312849.125 1357708.125 1065228.375 1457855.875 2054167.375 1852149.125 1620591.125 2203438.75 3387250 4303405.5 1962481.25 1352268.375 3245806.75 1867169.5 2758820.5 1851493.125 6380875.5 1923855.125 2701248.75 2698861 3891038 1429877.875 1837901.125 3030872.75 2154035.5 2645983.25 1500678 1793934.75 1582120 3752490.5 2467148.25 1487856.5 2480836 2586849.25 1756431.375 1362162.375 1571324.5 1632154.125 3702171.75 2225447.75 2466615.25 3208795 2724470.25 2765738.5 2154147.5 1541596.875 2799548.25 899158.75 2384738.25 2149749.75 1467383.75 2313398.25 2208142.75 5915417 1935909.25 12796075 3823730 2081852.5 1575574.875 3229513.25 1898381.875 2546524.5 2310132.25 1579516.125 1498860.5 1665019.875 1021318.063 2804340.25 2995331.25 1718771.125 1878034.875 3495030.75 1147099.875 3722248.5 2191767.75 2128940.75 2217362.25 3358314.5 1995150.875 1165513.5 2398629.25 2828727.5 2769363 2676742.5 3125846 1611245 1531480.125 11551043 1040877.25 2101751 2018883.25 1824188.375 2346188.25 2130189.5 2734712.75 1304416.875 1908331.75 5339336.5 1916339.625 3713873.5 3358224.75 6493802 2214920.5 3902917.25 1872092.75 2574576.5 1900077.125 2373331.25 2858312.25 4262347.5 3190020.5 2986784.5 1176154.625 2105881.25 1401854 1199489.375 4777596 2316931 3712117 2204181 2645437.25 3895012.75 7577747 2444188.25 2191713 2298156 2202887.5 1528775 1315573.5 1862376 4027722.75 972542.8125 3566099.5 1906784.625 3465201.25 1109769.625 3615085.75 1460740.875 2982485.75 5989178 1425554.25 1115831.875 1451213.75 2689464 1521799.5 1504815.125 1316772.75 1553057.5 2251984 2668946.5 1060373.625 1155156.375 1659465.625 1916714.125 13430985 10551456 2462001.75 3042702 1171004.375 12776231 1278094.25 3793940.75 5604932 1249393.625 1522073.875 2537704.75 1595512.5 5729983.5 1407434.75 876858.6875 2376223 2005201.375 1986780.5 1245939.375 2464308.5 1975376 2847660 3583655.25 1191185.5 3784460.75 2781685.25 1365447 3256651.75 3665568.25 1449177.5 1436847.125 1682045 2751615.5 1488215 1568467.75 3570218.75 916900.8125 2084853.25 1926323.5 2815552.25 1143542.375 2654514.5 1591427 1009658.625
glycerophosphoinositol* 16130.1865 90394.1875 32619.4707 29150.416 46626.8047 46102.3555 48487.4336 62800.418 22558.8789 71144.0234 21217.6875 19387.957 36870.1914 114768.625 23400.9766 45800.4453 123690.1563 49236.6797 29718.9844 216905.3281 73436.6172 60349.4609 185703 43769.8047 84719.2109 36721.293 54899.2188 25018.6797 75576.7422 104430.2109 104801.6016 48119.3711 34278.4688 850240 875515.4375 94759.3125 190455.6094 701869.8125 458891.5 119321.625 1174657.5 284222.8125 92654.8281 1237356.125 80830.4844 1036968.5 42265.0156 807050.5 91589.2266 301773.5313 62463.0273 345214.375 109873.1641 112796.8984 932556.9375 241602.875 68565.1953 255981.8438 303832.9063 893447.8125 228195.1563 499043.6563 370637.6875 369773.3438 121872.8984 180950.375 51481.3086 461037.7188 72871.8672 98086.4063 96005.2969 26087.2246 769030.375 210879.9531 333780.875 290026 1562368.25 470081.9688 1348044.375 159726.0156 228636.1094 199006.3281 34096.7852 41503.3906 254064.4219 102580.9766 39600.1719 104137.6172 28284.4043 199666.9063 109332.8516 148495.4219 53566.5859 226398.8281 104775.6406 2242925.25 128285.7188 118763.7656 287549.9063 1454231.25 58090.3867 473587.8125 583261.375 118855.625 143538.2031 491844.1875 107852.1953 781168.6875 324224.6875 422082.25 109406.0938 1009814.313 445074.8438 56140.8633 349655.0938 134237.2188 46959.4961 1882934.25 182716.875 158640.7344 823213.1875 1421916 41940.6914 128918.6719 699494.375 253802.6719 94202.3672 553904 840362.5625 2712119.5 126569.8828 539262.875 1189221.875 181881.0938 53463.6875 53038.1211 87568.25 230176.625 158987.5313 647390.25 440950.5 300245.6563 199874.5313 481910.8125 87065.9609 72707.2266 135294.9844 964814.875 71984.9844 100602.2109 465191 108722.7344 24874.0879 182085.7031 175042.3906 1207923.25 121442.6328 931511.375 233354.0469 65750.8672 393609.0625 155759.7656 782195.1875 544084.25 166845.1406 360886.5625 67473.5859 762226.3125 224504.125 1856911.375 41566.2773 582324.8125 2645213.75 894378.75 49623.3711 1021109.188 203460.125 245396.6094 213901.4219 74728.8125 742444.1875 604662.875 661742.8125 65119.6797 241053.0469 808337.8125 200975.875 93583.4531 6350119 459498.0313 630530.6875 154368.7031 259632.7031 2747956.25 1214579.75 144427.5938 342882.75 69090.4766 194552.6719 494981.5938 47916 384010.25 446005.8125 90061.2891 182179.8125 212565.7969 1025700.438 36551.5586 122662.0469 252823.75 245972.6719 145141.5469 170430.125 20625.5957 258166.75 282277 155082.7813 470782.6563 233690.5938 431996.875 342105.4063 106795.4141 1028274.313 830398.6875 745360.3125 42055.2656 259903.7969 1885003.375 95000.2813 491898.4688 255321.2656 129475.75 81607.9688 117648.8906 949828.75 68488.3984 589226.9375 41365.7695 637424 63537.3398 76490.3516 162491.8438 72610.1797 39575.1211 80129.8203 38383.4141 74910.375 254875.3125 219445.7031 716495.125 699892.25 433456.5 194353.9219 710921.5625 409475.6875 52439.6719 93195.7422 482606.4063 355351.125
ectoine 760324 189874 623209 1804773.125 534364 1499451.125 1043946 290610 1395989 172703 403419 2680452 413881 543439 285109 419935 578572 469358.0313 456332 380287.4063 1236836.625 320456.9375 270428.875 381051.1875 385235.5313 354861.875 310260.4375 1190905 100696.3984 1019453.563 3558091.25 400989.1563 168102.7031 2419578.25 928779 133776.2813 615269.5625 391615.6563 839536.75 264229.7188 4403584 2495894 440944.0313 470827.9688 732464 2521862 454317 4179587 1049633 68131 155578 3061087 1881337 536445 275860 592812 394747 6472116 341984 251271.0156 703873 931017.0625 541191 452565 697988 235478 663576 864062.0625 217402 10063692 1658038 290036 652147 315951 1415356 1112996 292991 304842 578271 653528 370222.9688 449177 148174 1399616 3973401 742562 750289 163563 866074 1646347 5640376 432751.0313 3888226 135932.125 207302.2344 740020.9375 275749.375 225562.1094 284416.5 1091077.625 76581 388892.7813 696231.125 3626805 5698017 149772.75 603512.875 573204.4375 6070886 481916.2188 392602.125 2721614.25 917046 1174473.75 818436.625 330108.8438 467225.8125 9698194 2705952 2251612.5 209181.8281 6743816.5 1113765.5 360433.7813 2079064.125 1436409.5 544795.9375 2015150.875 545414.4375 2435603 3882145.5 5312923 421230.75 87078.2891 4225429.5 998612.0625 713776.9375 944726.375 14528460 201725.9844 1075910.5 1595167.75 129434.6094 253851 773310 1782254.875 2642944 832936 575772.4375 106359.6563 1769703.375 1115706.875 278950.75 940512.4375 999777.4375 112596.1953 1875469.5 1511124.875 507944.25 317259.3438 81590.0703 1966405.25 718126 834860 2946402 1156092.875 6231292.5 3982527.75 1018349.625 2737874.25 323245.9375 1264886.75 853169 187988 3489350 983737 5026059 152504.3438 197037.9063 722475.125 569910.875 443340 355867 144941 4447622 3784058 1965067.875 4756885 9654111 2117232 1690745 2876128 260216 1913671 929690.0625 4160123 200842.9844 3997407.5 6963308.5
deoxycarnitine 34970472 26392560 43258108 24592738 27124496 110351856 22814068 39941188 55952744 53377916 38583772 28314622 46739248 25608910 53834504 39683720 41026676 28587916 42557908 71825720 50565444 50258828 47459676 43644968 46142508 31423524 46880260 29544780 44467088 33454740 31660662 33200872 48831920 47394228 68165976 32794678 28228910 44775076 58316516 30226568 28772730 32809722 42697408 39860836 38810972 37411920 28291228 30236284 25941774 44920616 157446064 54854364 41543104 106235096 168373056 112949728 41197144 57727880 18166312 58472320 69068040 76019992 310193312 76308216 216569136 36076072 64768612 68646056 94132264 94770992 166671184 50281512 85581168 23174058 138860112 110445936 60377640 30606870 117366240 53292200 100713616 236051152 118065184 78845600 61744632 78847616 35431024 165240032 44368636 30866570 80539536 32458268 258938928 73351440 54262768 102592536 204617440 208864784 132497648 33817444 59605224 75044496 57938552 58323476 61398252 106360160 54107572 37670108 27224304 58653416 28437562 85021504 72369944 57821840 46526120 65725288 61561232 142957728 79199176 104036976 127840888 117492856 58006016 130410832 91613016 110614744 61477752 52926572 81525352 163818784 48103956 40008440 43528752 145748848 35537420 19517288 83614944 71207912 24304838 298756672 45672876 40557492 304124128 115345296 71993608 31883606 47631896 65986848 156902240 54836296 48068868 98291520 30375900 116619344 170781728 43117168 41974996 40520032 71488976 44346356 24198750 59147992 71075376 55371836 152721648 106307688 145555360 86053976 145104368 52847884 38375084 73012976 83834168 76302512 44799704 31715808 84017232 57446624 49668592 71230696 52762496 175319856 57440972 161185056 139792720 33018548 82090184 75625360 226054240 86884944 69693648 151460624 42248104 99870320 45232400 253220080 22482236 138435744 168102336 26311350 110134872 42041200 55945180 108627312 33645984 82524496 61744632 62343964 71156088 86462264 65555732 19059594 16215000 137555040 102257352 79681600 42192312 215084272 113991448 112218072 44971664 80477856 335363200 99748352 103750440 41892676 45127272 96515464 55439956 68290360 68796520 428002656 80186416 140976688 113412648 46542652 100958880 150583504 83363720 45608176 77831544 154815824 98464160 42030732 31242378 65190192 153559664 125883928 53414356 89253408 26760842 88258120 96986208 110479568 63410676 288484224 44182376 107522704 29719712 33148458 335981952 55212344 38734404 166096128 49064068 93734184 66290616 70037032 75202800 37638604 95677584 60078596 217332048 29896934 51460276 19257852 83253320 38829448 63639072 78019296 52294940 31049480 73369296 66836952 38133932 107788432 94195808 60293828 83503024 77208152 50849672 54815100 177681280 64194048 81547416 29801154 174109184 44912636 121089448 111358264
1-ribosyl-imidazoleacetate* 1630328.25 195572.4219 1584939.5 1705031.375 2489789.5 3369339.25 1538247.75 1264575.75 1075946.75 11435019 631277.625 1263039.5 1410892.75 3727932.5 1217194.625 1797389.25 3020619.75 1908020 725647.25 2833863.5 1357782.375 2732562.75 4101898.75 279323.4063 4704680.5 602215.3125 1653747.375 533016.875 3695673.75 3278690 1076997.125 955760.875 7818778.5 1173428.5 1921858.25 716769.75 1884367.5 3720881.75 1994499 2290871 2380822.25 4895415 2909363 1189086.25 3320432.25 639449.625 1403248.125 1635559.75 2060429.75 4914104 11408397 2776654 6697377 4175412.75 6633264.5 10445845 2309540 523987.9375 1221377.25 23359206 2195721.5 611533.75 4861493.5 2139902.25 13613017 190405.5781 5829771.5 1035001.125 1733431 1923574.25 3173158.25 894524.375 943006.8125 363703.9688 35051564 2736602.75 711185.5 1714409 2780208 4701108.5 7243290.5 3015354.25 5974605 5486778 801962.25 1176250.75 575217.125 3929614.75 358090.7813 952277 1757206.875 729844.75 1665127.25 5351391.5 3944876.5 1383525.875 15949039 6636031 8298068 399724.8438 1534891.75 1100207.75 3128483.5 1460304.875 710965.375 5370871.5 2398082.5 679180.75 987826.9375 604428.375 418856 4907711 2681154 1731636 702970 2031769 905990.25 4235307.5 1013575.75 945285.25 4484864.5 20643924 1181734.625 3952464.5 5275131 2019899.125 864400.1875 4565843.5 8462266 9698184 661560.3125 39080108 2277318.75 6480308 642722.3125 464847.5313 1781018 1317945.125 759346.75 6426387.5 2446260.5 614107.375 1835250 3254596.25 1421661.25 736555 1376877.125 1129663.75 4958688.5 964259.25 3219851 3024433.5 482293.0625 5049113 11368267 2163732 285719.3125 1880574.75 2768715.5 1358243.875 747707.0625 1045642.188 3340107.5 986562.375 18377682 1957343.625 2760317.75 564225.0625 926563.4375 2040776.25 659380.3125 3585161.25 28417716 1087773.75 2788922.25 2304423.25 3131824 1348040 719466.5625 3681442.75 279302.9063 16516408 861455.6875 17072712 3826426.5 1562247 5699546 1162185.125 4183750.75 6320586.5 3117375.25 8131892.5 772616.4375 3310432.25 1844664.125 31063098 3090439 15741924 14838560 479248.8438 41565352 498598.3438 1798437.75 2823090.75 1232888 903805.9375 892465.625 615876.125 7302134.5 1982513.625 3709967 1232743.375 307336.7813 3123179 4307866.5 2241834.5 1715263 19135166 3371589.75 1055793.125 1119918.25 568848.5625 14918043 9640190 743125.6875 1602987.875 2926738.75 6235508 11581489 2830620.25 4000938.25 2929567.5 892978.8125 10211710 16233990 188429.2031 2648424.25 11577953 20543708 4227292.5 2878347.25 4427571 3224999.5 5664767 2634770 1218965.625 5331415 6221334.5 10269314 31259550 1352516 7581163 51731916 20661588 950694.0625 5943649 17195934 62778364 727881.875 2731719.75 6416885 2201157.25 760986.5 4367720 5426794 907837.25 1141029.25 7911011.5 4623849.5 2057487.125 12428653 535778.4375 14494021 401675.4063 1169423.625 595699.6875 7841657 742921.5 1687274.625 1646699.5 1472662.5 378507.25 5995532 30936308 4099756.25 10413737 33060130 1732341.125 5361489.5 3372166.75 1233286 20472802 2290871 106043568 259823.9688 4393580.5 4314017.5 969832.0625 30976286 12991969
tryptophan betaine 2883824.5 8396673 6143155.5 30849854 21025332 22410780 13895802 7793287 15333380 5777169.5 14850896 10875283 12510428 9218883 7358382.5 15591629 15996566 6922238.5 11743583 9764998 23810492 10930100 6600059.5 33672824 7274903.5 24111892 3974687.25 20647990 6570718 2708690 106070688 33712728 7946729 12493252 1752568.625 29515800 19304292 10375243 9215195 14585246 3226511.25 8051904.5 6347780 1095092.875 32135844 28803846 26390332 54947580 87384728 7506401 20551078 19307254 2820303.5 38734072 4335209.5 53697.4648 14464584 43795000 2774239.75 20069960 8231973 4769882 51248828 770187.0625 3476686 5749394.5 3817892.25 6936734.5 17370452 7604865 32480156 3149130.75 35051248 5463479 12632543 2964628.75 6655067 3674849.5 2052486.875 1541732.5 30363688 3919238 8139978.5 12718766 3730694.5 3986210 11623210 1975067 4571613.5 3047836.25 309437.125 2903862.75 1864542.5 4765621 1624865 26621614 6139218 4448081.5 704694.5 12529664 12234336 25368912 1571940.375 2919278.25 810789.6875 190080320 1362770.125 738802.4375 7434597 1514491.25 185068912 37009388 4914985.5 10256655 4121497.75 2410241.75 12952887 10763294 4859630.5 5327720.5 25796638 5339010 9780845 759002.25 1515150.125 15539133 36669640 1188298.25 19282564 2323803.75 5157774.5 1245663.25 5467582 910511.75 588378.75 10431220 1378707 1111120.25 2508767 4873444 6114118 2883323.5 9373966 2832093.5 2099128.25 28068772 9033084 10310023 32127594 2988484.5 4691757 7572018 8821401 3154362.5 93623992 2624717.5 6573365 273773.0938 5678060 2979239.25 1051882.875 2094309.375 8930876 2871758 1188184.75 6618248.5 16227548 3320359.5 15715555 10870926 8513036 88171304 11479956 7832331.5 18721358 7209897 2697392.5 7515339.5 509162.4063 2204579.5 1311674.25 6930285.5 526070.8125 54177820 10506816 2784918 8100449.5 5765218.5 91521096 62784112 33683096 42211828 5973322.5 1673198 7787033 132536616 14550642 16748417 37761296 11357242 54268684 3001801.5 6338440 2100459.75 6059624 929176 3126631.25 15366898 92125832 36412528 1260348.25 557710.25 2884180.5 11473270 7676922.5 9893091 7613042.5 62129216 4596235.5 943868.5 57686324 2152312.5 26890524 15854468 13522409 23271148 39739348 45946220 20679972 6671035.5 44693552 2884400 16692806 9293308 6391124.5 12044003 17503560 9129712 36384848 9377268 27309206 75838800 2035397.75 11173932 15378672 14281949 9147636 12494386 3995251.5 3256760.75 4847875.5 33188060 15041710 6621829.5 7058045.5 2552528.75 2146837.25 44779528 3331123.25 18897296 7787033 6641351.5 34505972 7017994 2615595.25 2693088.25 5236457.5 20266536 4190786 31154566 12895931 40843404 6549626.5 5759715 21395172 1658801.5 2866248.25 23001660 5408144 13760640 7127738.5 7787033 24446318 97892856 54769696 68862160 1708507.25 12852666 1134394.625 20602924 14378474 21522746 1896615.875 13025305 14292684 2792993 5450540 144118.0938 13475174
N6-carboxymethyllysine 222448.7031 496086.0938 392976.1563 481968.2813 160274.4063 516895.125 297305.7813 200852.6875 432408 988071.8125 335833.1563 569907 527881.4375 377253.5625 294783.6875 347464.7188 193279.9844 439330.5 268805.1875 340431.9375 170705.0625 537449.9375 795692.875 464480.9375 773324.8125 539749.0625 544784.125 203411.4531 849214.3125 546289.5 324789.7188 540943.125 458697.1563 570262.8125 628626.125 343159.1563 368263.4063 1055404.125 380762.3438 521507.2188 252972.7656 442837.9063 355993.1875 461346.5625 876170.6875 398787.4063 420682.75 187577.2969 624977.6875 288004.875 3289964.5 2128997.25 794493.9375 1064977.625 1863110.75 3379619.75 834329.625 1084506.375 529121 4570510 1730999.125 682891.875 2430038 746239.125 5935067 251596.6875 2429145.75 346270.9688 1008139.688 357742.125 1096880.375 697771.625 610455.875 184189.8594 6555165.5 1061762.375 395333.5625 674582.3125 844539.6875 3789176.5 2961063.75 1823025.875 2218225.5 1557235.5 397307.8438 967615.8125 342724.875 2603876 520310.9063 551903.625 446790.0313 336555 2202563.75 1715251.375 1670016.375 1207039.625 4169760.75 1491204.25 2260678 306843.4688 465961.4063 651383.625 1437664 576595.3125 329061.75 3736958.75 541569.625 316774.2813 370694.1563 363913.4375 795896.125 2120932.5 676189.1875 1269531.75 416351.6563 860268.75 510622.8438 1883111.25 901276 622790.625 9834627 347622.9688 1557995.25 687861.5625 920498.875 569435.8125 901109.125 1273159.625 2870440.5 585551.5 8480955 606673.25 2796350 507134.9375 475541.5 1239660.625 476541.0938 614780.75 11045501 1381638.75 747014.6875 2350963.75 1127978 648979.125 563746 473790.4375 516490.4375 2473281.25 712753.25 914061.6875 1853338 371906.0313 2544092.25 3630270 1034512.5 377739.75 561130.625 1730971.75 699723.625 477618.2813 592558.5625 986236.25 560806.125 5855451 805147 1119911.75 367099.5938 610029.5 905545.5 187449.875 683953.8125 6111250 650543.625 1371009 1490184.375 1334247.875 486629.625 320466.6563 1149454.125 782481.9375 8085477.5 657030.1875 5550905 1117410.125 468210.25 2583965.25 760487.125 1689797 2289305.75 795195 1597264.125 324276.0938 903479.3125 514320.3438 13681339 568130.8125 3046627 4647994.5 243609.0469 14436549 367751.125 1605688.125 940275.9375 351524.1875 370689.2188 359888.6875 4282913 1030779.5 1083881.625 565763.6875 416699.1875 1159982.375 1293963.625 737353.125 565990.9375 7817778.5 1852288.375 1545414.5 1580637.875 593090.5625 6633788 1325993.125 437533.6875 526346.125 304386.5313 1218870.875 1165274.75 1319924.25 661938.1875 2687770.25 456871.2188 4728194.5 3911969 999347.375 750324.9375 5435021.5 12041988 515697 1343544.25 1733881 1114834 1224466.625 1837654.75 357611.4063 1286167.375 2533687.25 1529938 5305559 348577.5 1731062.375 19223380 8880655 653712 4437545 3126542.75 11509284 579098.0625 846851.125 3742892 403714.1563 3528870.5 1157526.5 461442.8125 520646.0625 1324972 2289528.75 909528.4375 3399290 661022.25 5684766 224824.5625 428299.7188 331651.4688 2703220.25 785243 993059.4375 726446.9375 892255.3125 339097.8438 723404.25 6480521 991597.125 1958844.25 4234339.5 671255.3125 1380991.375 1099161.25 826279.3125 3610302.75 714899.9375 14353143 391629.8125 1387958.375 991595.75 457135.25 22796650 4517328
dimethylarginine (ADMA + SDMA) 46057236 33478874 59989924 56028952 46999312 65442344 41839624 53907268 65123844 79592768 57291976 58896624 56254816 37838944 39618368 56724528 45416784 69913872 52731104 77793584 47282960 79095496 74035704 64628356 76609272 57363168 81581904 48809456 80453832 59966516 59188172 45268444 82168864 70104144 92451864 55952700 76248048 91182640 66164096 50937172 48550160 69784400 43085756 57360336 75640896 65547268 79017704 54060284 55683636 67163144 370256288 151826096 64574000 186285648 148621200 199964384 55834348 66736412 40669536 206196000 103919736 54754208 199877264 50390820 139467520 58965424 167548064 49489052 202788592 50088604 204382208 40835176 59537844 58217688 368924416 127865064 46360296 84382328 58331392 87510800 111495472 215577728 115297016 126975248 61997764 149742752 30713474 83418992 98027408 50823108 71855848 28517898 136736992 149393200 94358520 181783744 282626400 278160192 127682688 37138024 86813104 106708640 171589024 84563832 39828504 135801328 58858304 47650620 60240640 45298296 130503808 127174528 84597288 75240992 47817008 80191640 121620320 88485880 81069944 111402016 308747488 260471760 39120692 142659504 193253536 118843960 44580868 99881872 145764048 139348720 75336336 130693640 80249392 146708144 62604120 45234120 104350480 57250404 44526768 232482096 46572348 123828656 244365392 94069832 41273416 65629436 79200832 73426888 171339600 76018192 65019396 130933984 36994592 144803648 219727712 82627464 59417092 112015336 94141400 73326960 51399788 63164852 95358784 76091960 211317744 108097608 210923968 112615192 106097536 80562640 94917968 135360064 126197112 100857160 71083984 71578096 226019232 138994720 46392760 71169488 90319752 251746688 74049920 272842720 201900800 66879612 125513392 100760384 250333792 175569072 103601832 273404672 33165844 116765168 70028040 441709888 52718596 311859296 219605344 48548680 225238320 63084736 117619744 88182120 55258968 58536468 83418992 95430992 101447944 100684176 74656752 74874992 47733592 181620688 203894080 82567184 62943760 398450912 141667296 58548892 100041072 68314832 362586016 108581232 94734520 64827848 64477376 85183296 89377760 111762720 80691176 239046176 99425304 215010496 210283376 90033368 149658096 406156960 168454832 76771680 66667588 222137168 173687728 133703624 82173568 92604864 80027032 249847152 77067936 188841696 34485624 116973656 615615936 149518496 127436784 160204272 51187000 184310160 45199252 64751348 139435840 74596496 50606724 124964256 94393760 74244680 82432984 114276544 88188936 76344192 234082224 60496384 235805440 45965504 85312696 57809100 140334304 65443724 58022428 132754784 65262932 54745648 119334904 201567040 123718792 117730224 208599088 74624264 106247008 143449616 66813060 53551172 204655088 414166688 78133136 84210512 117308224 66386364 248533360 241019520
gamma-glutamylalanine 5952217 2619177.75 2468809.25 3229259.75 1060705.75 2191294.75 2642588.25 2878289 2265260 2558345 2316995.75 1326965.375 2189379.5 2304997 3272862.75 2488791.5 2679926.5 3223232.75 2084411.25 3071088 1591531.875 3150787.5 2935365.25 3020078.75 3596968.75 2045297 3208076.25 1616131.875 4430575.5 3022389.25 3133927.5 2892492 2397035 2907127.5 4007202.5 1978543.125 2490572 2181006 2789052.25 2479876.75 2089322.75 1720946.375 2029107.25 1260426.625 1877716 2411416 1935239 2500055.25 2273153.5 3680995.5 1726565.125 7141143 1110585.875 252836.8594 686723.5 1437360.875 1286773.75 1183135.125 5244935 6564559 2394368.5 453561.9688 649302 697374.5 435602.5 1001644.813 805734.25 433266.9063 1761326.625 2650074 963861.4375 659411.9375 2782776.25 2636248.5 1332918 964052 477290.5 3691686 747188.25 4971862.5 399074.375 319178.2188 916868.5 318517.4063 788062.375 422508.375 748942.5625 590877.4375 868942.8125 726248.0625 321775.1875 337787.9688 741128 1728893.625 1597217.875 1543046.75 531714.25 560150.8125 2753020.5 515570.3438 385778.3125 561462.8125 1177926.375 375341.4375 1154413.625 358679.1875 1334971.25 770548.8125 734837.9375 1320052 861121.3125 889929.3125 2242641.75 799320.9375 1049245.25 757383.875 3714288.75 734175.375 550314.4375 3871465.5 350142.625 2895249.5 255388.375 604366.6875 392537.8125 1860188.375 1032583 1089420.5 1424492.375 507480.0313 424122.9063 301954.75 651564.0625 593412 1716131.375 721413.25 11134388 119876.6484 1348409.875 631345.8125 1402413.5 1119874.25 962465.1875 381449.0938 449731.625 318200.4688 3111622 354982.0625 1328504.5 4795404 1184264.5 1914508.25 238127.6719 1620232 1077025.75 1528746.875 611437.9375 263974.9063 899469.1875 801984.25 2222217.25 2946078.75 444447.4375 2086760.625 1166170 2074535.875 1791395.75 582860.125 1741951.375 623800.8125 700542.125 1025552 1760003.5 1049672.125 241225.4688 602449.6875 1479729.625 445888.9063 264914.625 1055299.875 212452.7969 1143457.25 307750.1563 338149.625 571085.1875 1616332.5 1884105.25 800211.0625 1759059 1317023.5 1809342.625 606086.5 1049522.5 438630.4375 1837375.875 820174.9375 140259.3125 1734077.125 141376.0313 1010552.938 508564.9688 909506.375 1660197.5 594344.5625 621499.5 1076665.625 760492.25 387585.6563 383624.875 182928.1094 1317359.75 952200 1480236 1677238.25 1180775 441975.6563 5697398 702408.5625 4185445.5 1375176.375 2135946.25 2211941.5 218855 2885664.75 417119.7813 888168.3125 983230.0625 531971.125 1071913.5 2548215 555094.4375 11559112 1635065.125 1441214.125 1019359.5 5823894 749380.75 1068483.125 1992482.125 884179.75 1213250.75 1266194.375 1159784.375 1370206 1469728.5 865609.4375 1092645.625 853539.3125 255397.1094 1455368.5 489081.375 3199081 821732.6875 278086.1563 2912009 1033521.875 471412.1875 1399392 378474.25 1970479.625 436244.9063 2559973.5 3818228.75 759230.875 594283 789152.4375 571531.6875 668370.6875 1819756.5 3231475.25 2492538.75 2681240.5 2092358.75 506074.9063 1007031.938 7638885.5 1557843.875 2047120.875 1127702.625 4494074.5 1138119.875 1600449.25 601995.875
cyclo(gly-pro) 1174007.375 430059.5625 256190.3438 238802.5313 85971.0469 850327.75 615758.375 91830.7969 138220.7813 1391280.125 1231019.875 295944.9688 561921.6875 110917.6172 323938.4375 327739.1563 268151.8438 675295.125 347428 408729.2188 476406.9063 573248.4375 1136918.75 288077.3125 990754 384852 122303.625 186661.625 372897.625 165852.0469 131813.1563 822249.5 385971.25 1228727.5 373868.5625 86179.8594 479152.2188 817203.0625 773225.75 415647.9375 211519.7031 411153.0625 326982.5 46461.8516 113404.3438 124236.7891 124061.3125 108847.7422 180710.5469 64495.6602 3038762.75 91392.4063 139872.1875 328891.6563 315249 409241 169154.0625 43262.7422 117579.7578 1028252.625 234069.4844 80739.1328 312674.1875 291702.875 888407.1875 508204.0313 219983.4844 230098.2031 111684.3125 722311.9375 40142.4375 138702.8125 490739.875 194478.5 139339.5625 85319.4141 194080.7969 133355.8438 518612.3438 264137.875 1840692.375 227871.5313 174741.0625 105291.9453 72794.5547 121200.9375 244979.6563 2213491.5 215023.3438 455104.3438 624308 171621.7344 103622.6953 299414.4063 630718.25 382115.375 649312.0625 897257.25 391391.9688 328943.2188 170809.4375 341328.25 103791.3047 162328.2656 227293.2969 299191.25 79110.5469 1276212.75 1531952.75 421922.5625 126955.5469 128438.3359 1136274.125 520781.5 398829.75 792361.0625 98764.3125 280477.9375 53747.2656 74018.9688 2170600.75 354052.1875 160081.2969 462070.8438 366469.3125 84767.3594 112815.2578 56032.2656 257372.7344 327577.7188 64796.375 48642.5469 382267.375 129119.4375 56544.7539 1004851.5 272141.0625 72020.9141 1358984.125 134749.3594 685434.375 88116.5078 295843.9688 123487.4141 279172.375 119436.25 5780528 626972.0625 106576.5156 546317.25 336878.6563 359722.3125 160534.4844 100730.3438 302920.2813 553994.9375 202881.0938 235780.6719 68826.3594 1451517.25 265250.5938 250451.0313 815293.9375 548232.6875 42243.9102 965794.75 136288.9219 481268.1563 659144.125 255676.5781 303515.5 2785318.75 82573.4219 2912631.5 109946.8281 42228.7852 411342.3438 639734.3125 395621.5938 440929.0313 115036.6953 488944.6563 574996.0625 5106829.5 414347.9375 2194013 291206.2188 645163.6875 214869.7656 537106.3125 220236.7188 998614.875 698610.6875 112874.5547 1073983.875 482648.5313 211379.4531 633747.3125 638977.3125 208687.8438 10571263 1017289.875 904289.4375 78240.7031 1100929.5 893744.125 1054174.875 4048474.75 863548.9375 41790.7227 546589.3125 540585.4375 340741.0938 44115.7188 234944.2969 507797.4375 245000.4844 128984.9688 1190152.5 792570.5625 596056.125 123212.375 167623.6719 206180.1563 55288.7109 527333.5625 1394180.375 313369.4688 869200.3125 937162.6875 72940.3516 1166231.375 403322.7188 57639.3516 1270741.75 99844.8047 683453.1875 153105.5938 1105411.625
succinylcarnitine (C4-DC) 459700.625 616552 686361.1875 732677.5625 574678.25 623418.4375 451530.8125 891843.4375 649646.875 1618340.75 587250.0625 753245.875 706782.875 551993.9375 488048.2813 765734.3125 811114.25 778938.875 1216531.125 812234.5625 586465.9375 768404.4375 1010893.438 542110.1875 918917.3125 473140.9063 915341 325710.125 1085946.375 822699.8125 818307.875 688531.4375 1108054.25 902961.375 770903.5 542162.625 538562.4375 1264384.25 820572.25 590054.75 599956.9375 798096.875 711731.25 965211.8125 1012900 838457.0625 585089.5 557776.25 712683.8125 506862.9688 3171941.25 1219181.75 1320537.625 1014277.125 7189600 1760468.75 1094248.125 612030.125 429335.8438 8240778.5 1710430 886479 4363642.5 791279.8125 4991066.5 489142.7188 3626453 775764.0625 549528.0625 1199817.375 3743107.5 607042.375 1535736.25 413174.4375 2760370.75 1705867.5 710418.5625 752102.8125 1983338.875 3545494 2718772.5 1597456.625 2852717.5 2038470 936526.6875 352512.0625 565511.1875 3906169.25 364608.4375 407269.625 570371.75 281439.1875 5543983.5 2740504.75 2464020.25 1352614.25 8733963 1468406.75 2682544.75 573864.0625 790054.1875 846485.375 1664522.625 514319.6875 826976.6875 1781351.375 692555.1875 542008.75 565931.625 574658 461701.5625 3081419.5 1093605 879398 665584.6875 764434.9375 712548.3125 5188938.5 394129.9063 798065.1875 2475046.25 4933972.5 682627.5 2242219.25 2089982.125 782790.0625 607880 1031153.813 2266073.5 7793595 1198297.625 15176238 611655.5625 2545364 426812.3438 438133.2188 1228718.25 530887.375 893464.5625 5159492 1493803.75 267605.4375 2859644 2959572.25 702344.875 907067.0625 452808 767598.75 2331498.75 2304783.5 1146420.375 1980848.25 100927.6953 1617436 3795643 790044.3125 552646.25 1674987.5 2102493.5 698027.125 358027.8438 707721.3125 1630771.5 336047.6563 4936220 1095303 2006298.875 674312.9375 1913115.625 1599530.625 376043.9063 1242838.625 4000877.25 540934.0625 1284905.375 925488.0625 1318371.875 782207.3125 479677.4688 1673364.125 957666.6875 5896298.5 927414.8125 3195164.5 1054211.625 625132.5 2047143.75 910272 4586976 1952497 1411998.75 2806227.75 323474.2188 2644018.25 1928685.875 6070520 741664.6875 2471971 7672037.5 509546.0313 5105294.5 767712.8125 1689066.625 2033459 490867.1875 1091041.625 734661.5625 674013.8125 2921690.5 2263591.25 2501350 947361 137204.1563 3273562 2026418.75 763017.375 534730.625 4111128.25 1612936.875 1465898.375 1537361.5 571180.25 5691122.5 2149277.25 323328.1875 418831.3125 711324.25 1847153 2509726.5 1328113.625 1876305.75 3313800.25 298312.4375 4383201 2139682.25 4374534.5 654754.625 2934975 3443729.5 425274.5625 2117494.25 2069772.25 887087.75 1818521.5 1805185.375 757270.25 2474661 2629402 5760881.5 6272852 552546.4375 2560586.5 11794512 5192196 481815.2813 3084782.25 2653936 8509432 653042.3125 542793.5 7050916.5 652430.8125 463147.875 5925260 2354717.25 725496.0625 759955.9375 1555982.125 5030499.5 675834.75 3085590 429910.625 3216407.5 343755.7188 624060.875 256877.9375 7440336.5 425338.7188 1027831.688 898472.4375 881182.5625 524974.8125 1492591.375 5451434.5 2278425 4225605 3347433.75 1012900 2582056.75 1803662.125 420525.2188 2585308.5 906856.9375 3545556.25 1014906.563 1082562.875 712977.9375 347106.2188 6417013.5 2404610.25
N-methylproline 3116934.5 17388780 3523457.75 6636451.5 10982987 5329976.5 27994778 1146143.5 26511648 5626372 2243273.25 24343344 8935579 7131520.5 10377386 11522237 10049747 3865161.25 4583647 18317278 4686212.5 31307300 8451588 6422895 2130053.5 26196390 79175904 3789004 15551379 3275732.25 39438856 176844960 15518342 22982234 76877288 12912932 122665192 140279648 26406774 33570604 87594560 75206840 5415279.5 6250039 9058038 7773687.5 43540644 5518783.5 3886827.25 7969761 14739718 7437336.5 2787931.75 44361240 4113298 2818467.25 8657738 6199460.5 6280390 9605808 2061048.875 2115198.25 6823731.5 23191368 7421872 22306246 26479094 6343732 6896435 2533836.25 48206784 2426687 5431990 1601363.25 3732570 2578787.75 5302600.5 14516783 2119372.5 2852975 2312906 2692915 2013384.25 28897276 3778170.75 6124477 1486745.375 111097376 1342958.125 91658312 2380475 2253843.75 19388286 5792484.5 2647965.25 4050770.75 4454353 28078916 2356371.5 43286848 6451325 3708186.5 5434748.5 10561519 28677020 10469042 8362123 8446759 1865424.75 1003981.188 67596912 6789496.5 2898730.5 13390720 2348674 1386204.125 11871715 2497215 4347562 2446136.5 11024483 9910778 166779040 36759316 15160072 2957198.5 3514356 5318973 3230991.5 4493994.5 1092524.625 8238973 2375803.75 2899934.75 1174415.125 5471687 1920805 14016071 1788774.5 5066398.5 43152388 7167509.5 3801452.5 4868690 7547210 3844447.75 994879.75 2234552 22089366 3898567 3831843 1863707.125 1700506.875 4406814 13379665 5897394 1510942.875 1745296 2790552.75 2401624 1806820 23259970 2803782.5 871253.4375 6089329 2787997.75 5736234 26886358 13491267 11940057 2670938.25 25036858 16733257 5974869 3256096.25 4537463.5 6112485 2963159 49058848 4950004.5 1102098.5 6780901.5 106573656 7589677 31259478 5700999.5 29003814 2047525.25 5640165 6252534.5 2036497 2018947.25 1195468.25 2685856 4869720 5892592.5 2823970 6468675.5 6358115.5 7156992 29589322 1227127.375 5624931.5 7153936.5 112956144 1756479.125 1381726.375 1520787.375 6049803.5 2607242.5 2041736 3627782.25 3381547 10786374 4229500 4591692.5 119135840 5109716 15878298 24822574 5147171.5 1211550.875 10660515 3530052 3559827.5 2666028 9399000 46316476 3692814.5 3143508.5 4295231 9377325 10295043 28623426 28917542 17669168 16866044 10939766 5374643 18037062 16239154 9456784 7663349.5 4894067 3466814.5 5365775 2176896.25 2529140.25 38387568 8763574 7829590 10781344 3940314.75 5464568 1941970.25 3007334.75 4817304.5 6445615.5 1394143.75 6598672 5792484.5 2270989 5883969 16994720 5968271.5 1724191.875 4596675 2030784 51907048 2178726.75 4528016.5 1640151.125 7175097 1769285 12378429 14181375 16716966 3843234.5 6369654.5 3578079 5283383 36343912 40009692 1755277.125 3452306.75 15859087 5844762 1893924 13172003 4098546 2519345 17855884 3309957 6683644 4571198 7703666.5 12768678 28296758 4586312 50564768
2-hydroxyglutarate 1014504.313 1712621.5 756955.8125 1250200.5 964901.1875 1102487.5 1284811.375 690396.4375 737417.0625 1101658 1075619.375 1122533.625 904121.4375 1266836.5 1118497.375 907011.8125 637270.125 918165.5625 827513.375 803118.5 774714 867659.75 835662.8125 1151278.25 616208.4375 616903.3125 666575.8125 965033.375 2465417 850950.375 1081862.375 1232423 1365879.5 1312758 729735.6875 804851.9375 1250776.625 1212650.125 935493.4375 673924.25 800824.375 683195.125 703159.3125 731622.8125 576647.5625 1703696 2082913.125 910774 655921.375 1432030.375 2997961.25 4480447 901694.8125 971783.0625 4271709 2459342.5 1101628.625 2407477 631160.6875 3047718.25 3492011.5 2382859.75 2694670 659337.1875 3215604.5 1472251.625 1774116.625 1073174.625 1415222.125 931736.4375 2067383.875 2211697.25 4828145.5 1093557.125 3263265.75 1279511.375 1141334 1730462.375 2380575.75 3779562.75 1045070.375 2384511.25 2511247.75 1415240.25 1360914 1573784 629052.375 1409112.75 1154008 1130514.875 1591599 521247.25 2855493.75 1381202.375 1319083.875 2576914 1808263.75 1937694.25 3484436.25 955056.6875 2385175.25 4124172 1685297.375 1151504.375 960435.4375 1921555.125 996687.25 851953.9375 1064974 823970.3125 3639345.5 3581400 1926462.5 1241127.625 1556306.125 3560614.5 766852.5 2177526.25 2059725.875 3482737 1148974.125 3706571 960921 3621625.25 4532447 1381534.875 2043835.625 4389429 1171560 2135123.25 2413008.75 4726184 695692.125 1421276.75 3560231.25 1358718.375 2312331.5 1387975.875 1334982.375 4143053.5 1331189.875 967275.5 2525605.25 3069477 896758.3125 947699.6875 489557.5313 1058620.125 1783268 1600341.125 1547077.375 1197510.875 3321649 8788847 1761459.25 10579233 3442533.75 1280739.125 1135824 893688.25 2047134.375 1310478.375 820522.5 2738859.5 1831023.5 1170521.25 1126897.125 2357899.75 635654.1875 555024.5625 1184692.875 2185544.75 1777914.125 664314.375 1137468.875 1131555.125 2002657.5 963989 1503555.25 1181317 1869853 6856415 5492642.5 1682298.625 1789958.875 3232556.75 2724437.75 5387629 1922953.25 2307798.5 2954744.75 1165056.25 5265234.5 3661290 1919374.125 1070896.5 2720669.25 13377552 1831229.75 3091512.25 1110338.625 3911505.5 1917213.25 785490.5625 2532392.5 1143526.75 2174514 1414273 2466964 1204803.125 1785044.75 457173.3438 5336028 1456831.25 1031794.688 673249.375 19931164 1333113 4296624 1410114.875 3320569 1834076.25 1154735.5 1163784.25 957856.8125 1022876.938 1290934 3649777.25 1634066.625 2402393.75 3812343.25 607719.4375 3075734.25 1771025.875 973907.4375 1414273 2422726.75 845952.0625 553209.125 1699325.5 870758.375 2565011.75 1186861.625 1865902.375 1721046.875 1978853.25 1336445.875 1494361.5 1984723.375 716707.75 2106007 1624836 2156199.75 1772977.875 8269609 2453280.75 1916300 536046.125 2293241.5 3101982 2111659.75 870769 5760131 894916.5 1414273 3951653.75 983533.5 8709208 1184773.125 602306.5625 1997274 2688387.5 999602.25 2562618.5 423030.9375 1107361.25 1063596.75 1110624.625 1127570.375 1296560.75 864430.25 1061289.375 1531901.5 6583262.5 5012917 4952057 2052154.125 4892768 2825097 1010439.563 2111692 1256853.375 514986.0313 3939194.5 586092.4375 1410135.125 962648 1424550 2757890.5
cysteine sulfinic acid 172958.5313 118265.6094 163881.9531 122966.5703 140557.3438 112286 108687.0313 192583.6094 143152.2656 221587.875 115885.8359 131966.1719 118028.5938 88136.625 75161.9844 180264.9219 165879.5469 50423.1328 119947.4609 87655.5938 135645.6094 132074.625 119496.4063 173433.9375 145469.125 176959.5938 296842.625 142695.5156 104727.7734 130958.6328 178315.1719 141543.875 200653.7656 107667.5938 167847.8125 72447.5313 128094.2578 204230.125 105805.1563 239642.9844 136426.8594 93905.1641 94151.0313 99708.5547 74499.0781 191804.8906 143559.5469 118567.5547 265310.4063 133753.4688 90951.0781 61560.2539 139543.6875 178629.4219 143199.4844 158467.3438 61513.0234 91423.3594 106601.1172 274159.0313 285424.6875 175703.0156 31246.7227 182419.9219 184672 95981.7578 40926.7617 45980.1797 90581.125 326354.0625 209358.375 73167.8984 24751.0918 43658.125 78371.75 128323.4766 130356.9219 31820.459 57472.3828 114408.6484 37688.1289 62065.7656 66816.5781 59710.4766 74807.7656 164606.125 295623.3438 143258.9688 29600.7324 111449.0078 105256.8594 86595.5859 50692.5078 117733.8672 103305.0156 81354.2188 52986.2695 47855.1445 90834.9531 123676.2813 106614.9609 112276.5313 37680.1211 153540.0781 96701.625 161685.2656 147608.5625 68603.6094 78078.4531 75904.8281 81323.5703 82842.9922 163712.7344 151526.3281 102266.5313 180217.6875 50252.7344 171103.5313 179473.8906 33458.9922 163231.7969 85051.9766 270266.4063 373330.9688 68334.8516 111458.4688 53396.9648 145984.2344 45640.2617 254756.3281 46656.3477 55124.5313 212008.6719 60343.8672 228387.4375 55142.2148 62479.6133 85797.8516 110529.6172 86095.1719 56674.5977 343120.5938 120513.3359 136640.0156 73530.8594 70959.9453 123554.875 94322.5938 100083.4766 131648.2031 350311.0313 190547.1094 179693.5625 196831.0625 81911.7656 71727.4375 61071.3555 48115.6484 102314.8594 136619.0156 37674.2266 131457.25 97008.0938 129404.9766 38868.9102 58757.4609 74314.5 94892.8828 146992.6094 128453.7734 43850.9609 75683.8047 124026.4453 183163.9844 161461.3906 177625.375 76956.6563 92602.3203 57350.8164 45489.5313 198896.4531 102582.4375
"N1,N12-diacetylspermine" 62180.4102 133873.125 3200807.5 7709347.5 1283454 18102384 1026803.5 135946.7813 83239 2184707.75 3641793 1997486.125 7506521.5 241549.6719 18234842 384508.9688 7774204.5 227308.0313 2851032.25 1214922.125 7152563.5 220720.75 298443.4688 868861.125 1514144.125 2967859 234926.8281 2905057.75 8387248 1909228 1318769.5 7605977 14509429 7357221 807942.5625 5535887 240957.6719 10522089 3479814.75 374506.3125 1034599.313 27320.5664 45712008 1339924.125 2882878.75 8174841.5 10450771 1392181.375 6387972.5 114901.2891 494317.6563 6590922 2985644.25 538190.1875 149824.0313 327077.6875 959588.4375 296322 169143.25 267309.1875 76220.9375 5083275.5 1914994.125 390153.2813 1190135.625 944351.75 1015348.875 12919777 1880397.875 9790840 10938248 26893044 469637.8438 1331978.875 8539602 5268733.5 1310445 2949280.5 1107026.25 3560770.25 2493624 802323.5 829167.4375 10144820 397326.7188 365134.5625 1942548.375 774823.6875 1136715.25 4974059 875035.875 5381471.5 5655851.5 4050096 909102.6875 494569.625 659136.125 1814250.375 1598960.25 917654.6875 7809396 284003.2813 7721219 6047100.5 1105355.125 2598656.25 14306500 7022900.5 486197.8125 594883.0625 534199 3731040.25 337593.8438 14234492 938660.1875 4050475.5 482246.0938 6035869.5 1232560.75 4865510.5 409741.4375 9292153 853207 604263.9375 561503.875 2828448.25 5031831.5 115637.4688 1741270.625 5787075.5 3359987 886577.25 4307958 6899247.5 218711.1406 3928574.5 1228279.125 5475350.5 3549972.75 922196 3968458.75 446516.0938 15288574 2379463.25 3018634 348544.5 6173669.5 3986979 859477.25 3161946.75 107366.9219 51168420 2161276.25 315932.9063 886696.9375 1976131.125 1188192.5 1278268.125 12580754 20836034 479963.2188 752986.375 1373704 1219011.5 905113.1875 534796.4375 4893330.5 9005716 1973058.625 262163.2188 2610440 5067004 19777848 616875.5625 84817.4453 60775.5117 1319993.125 1061549.25 291850.6563 513778.375 6911741.5 988369.375 10068234 1879737.125 1419411.25 987460.375 11101410 2812849.5 96360.6641 227426.6875 1410090.5 3156366.25 1095067.125 526919.6875 383218.6875 2207076.75 3107879.5 1947420.75 377439.5313 109222.9766 1131774.375 1155495.875 392284.7188 2573219.5 22102116 8859737 380348.375 125590.1641 606047.3125 21814520 1221234 110684.4922 9865848 670000.8125 818003.75 573097.1875 500229.1563 2598911 797470.3125 4271500.5 318859.9688 26070660 3257357.75 1390750.375 102869.2656 611528.5 1784071.625 71657.1016 532358.5625 327572.5 276342.7813 2269259.5 1463071.75 3303588.75 2687582.25 380817.7813 11830419 2195840 84277.5938 699812 1789687.875 263389.2188 383243.1875 1600136.125 1112424.25 97857.0156 1188110.75 6235931.5
betonicine 3311440 560119.3125 1228733 769177.9375 649138.5 840854.625 502681.9688 907977.0625 872667.9375 1624190.5 881167.0625 278296.75 1680774.125 651062.6875 5696499.5 5822454.5 591368 276127.4375 1362084.375 362618.9375 17381082 603026.375 1281001.375 969581.25 173635.8906 42137404 327220.0938 6390356.5 290872.6875 138625.0469 353016.1563 54648.5039 11030802 420347.6875 120056.4297 389812.5938 1586797.125 2313603 163524.0469 549893.875 3863949.75 924530.75 11634074 19127006 87055.8594 436186.5938 171619.0625 138399.25 10800938 588588.5 424068.2188 184415.4844 10337572 876313.0625 215458.0781 2070825 962428 329764.4688 504585.7188 3836016.25 899477.875 222133.4219 1938569 1132545.75 1005924.938 4015393.75 1345899.25 904887.6875 491695.1563 95539.125 961439.6875 1085522.875 5597583.5 23034.8164 9839311 6687495.5 484623.9375 875757.25 278159.5938 2048279 1600169.125 940885.9375 1102887.625 1487543.125 1262703 480664.1563 486413.8438 2963656.75 253369.1719 1891805.25 653331.875 394572.875 3863753.25 212546.0313 3600875.75 2407437.5
ergothioneine 1919362 5495330 40930052 7659308.5 10430110 13860255 24422934 5189141 6870946 5325549 7906350 10872737 10597978 6107112.5 4488225.5 34676748 17266642 10868025 23009232 4606370 6111762 11082758 5565216 28471372 7418656.5 5340138.5 7356611 5464550 6591757.5 2197209 8372224 44452204 6819996.5 5447461.5 7652981.5 9135303 22617076 16491539 10856483 1328248 29254856 21814756 13667006 6562918 3221477.25 5100924 2892707.5 27497632 3052993 10918785 7944441.5 10251794 17828002 7014911 3156636.5 8892670 40000736 7583232.5 39447564 4235286 25116210 17353002 17190004 3449582.5 11817280 40911232 7599372 3275021.75 6386925 10106358 13318635 57815420 34215016 5570449.5 15245874 23373936 22425110 7048925 19463258 6530661 4950609.5 8748434 35675536 34928544 13859732 15489608 26399486 15801845 33930340 30195800 39864280 14114735 22590104 12196098 3480952.5 7770413 4541115.5 23468330 4723664.5 12162669 1797958.125 39077204 16050316 11980312 10665714 7130306 4265956 14916512 14063690 26669174 21547568 15905325 15209104 17649718 6498822.5 28034298 1701707.875 21550242 17900934 2777812.25 3613850.25 21743654 9121376 23187836 48247676 17203400 19098270 1263702.5 8075029 13372643 11015429 3407998.25 4850625.5 22482014 7566782 22786710 5409448 7545833 12524057 66010312 5936051 25737552 3078717 6456298 15034663 3598686 10316248 4572645.5 42532208 5702435.5 15570231 25496718 78440152 39555104 64071528 7555563 7041894.5 7882824.5 10228233 4666964 20729978 8757869 25837826 57562620 2597642 10548230 15073120 46255000 21503436 13398185 3943178.25 7376013.5 9766889 4445294.5 14681946 17230846 11032204 12973346 15921688 15301556 5878598 44708404 8167776 15718865 5832453.5 5383029 5355844 43717260 37968496 12244837 4449935.5 17039754 1039356.938 21973496 14877115 14440376 11785115 37457200 38181384 6988462.5 16474121 6324971.5 18240590 11175829 22858062 43797524 11082758 1999886.375 13210312 4902459 5748354 77927272 24373150 18530084 17354870 39011912 14409841 16714481 13146961 77384520 78310232 30385950 14974255 15170605 11791456 4506598 13536083 16993834 8100245.5 1500852.625 2545384.75 1153239 1777095.875 2962337 5263485.5 19201814 40884252 2668353 44222816 18015388 25429814 3091546 17952022 19490724 16284783 24055562 11133312 1783121.25 1395391.375 7799012 11560047 1762353.5 2479302.25 1825304.125 9953409 6133068 20911166 621644.75 4006759.75 4133653.25 43416780 4560319 6621870 7728426 21548148 4786464 32686710 13534703 7546681.5 8947918 33748768 31604958 43714664 12448754 3243950.25 1821487.25 7093444.5 4309188 32693910 9572566 11462345 10947920 19624380 2953095.75 11532713 7895833.5 6212977.5 14630450 14425409 33318718 3810074.5 10382150 4958288 5542109 6381009 8643795 5679976 33023012 758864.625 13289197
S-methylmethionine 123424.9609 42214.1719 303070.6875 917268.8125 2116028 72517.3203 128924.2109 295181.2188 629639.4375 127735.8906 458018.75 376171.25 379218.5313 200663.8906 50386.9453 318192.5 76544.1875 1009936.188 2164962 224055.6875 286461.5313 461763.3125 790280 126493.5156 428313.5 271926.4375 2834163.5 1100112.25 221156.9531 926413.4375 181651.6094 1288793.375 532523.625 2251883.75 510629.2188 1929255.125 87043.7266 303684.6875 82529.375 254703.3281 30607.9434 319349.7188 576413.125 1243947.5 186523.9375 524317.1875 423293.9063 348571 152086.9375 200712.875 522981.9688 282628.9688 107952.7578 75883.3359 668252.4375 96248.2031 121400.2266 659349.5 316629.6875 1364952 99601.3359 37672.1797 327650.6875 101330.0469 71561.1953 88384.3828 39220.0391 65073.1914 48195.6875 275759.0313 89676.6719 113121.2031 206530.1094 30819.3164 779902 183420.75
7-methylurate 86483.6484 81403.7891 106397.1563 66404.4531 229797.4375 85391.0938 157724.9688 388731.8125 96047.8359 132383.6719 175511.3594 80757.6484 44017.7461 72042.0938 102974.0781 51175.9336 82694.2344 78610.2813 64645.5117 151980.5625 148278.0625 224083.1875 85038.7422 108736.0391 67628.6172 374839.875 127351.375 97326.4219 114403.0156 143177.9844 289385.5625 126367.8125 43788.5273 267881.3125 150354.9531 137873.3281 110423.6484 61442.8398 93143.8594 94831.7188 58306.3594 184902.4219 46343.8828 130276.0938 519494.6563 280578.5 211710.0469 283308.5 324368.875 97850.9688 97869.375 82398.7734 73230.3672 724325.4375 568553.5625 133547.0938 188097.3125 99444.2266 1683998.375 517859.9688 149473.2969 474682.5313 214516.4375 327970.5313 85031.2031 73335.2969 424111.3438 111162.2266 101372.5313 158185.1719 234779.7031 183964.6094 274095 144631.8438 216484.3125 31389.4395 92231.7266 203833.9219 212726.2031 202773.5781 88851.9141 587396.625 627057.0625 88009.7188 214544.0469 88180.9141 109441.0234 80161.2109 961384.0625 65379.0977 81702.0078 353626.625 533080.1875 158435.5469 402868.7188 99124.8438 151086.8125 405202.0313 219946.9844 40993.2109 194675.6406 1955003.5 51418.0039 173369.5313 94111.2578 217208.7031 332365.5938 145496.125 2567433 2159970.5 189487.7813 228871.0313 70259.6328 67627.5469 373357.625 172328.0625 250396.5781 56000.5469 67522.0469 334357.9688 68532.2656 148028.7031 157382.7344 54999.9297 296451.6875 650237 230383.1563 77604.9688 68667.5938 86428.3047 90233.6484 84021.0703 1507070.375 81452.8281 191214.9063 222865.1719 147196.4531 174770.4844 503560.5938 281618.25 177397.2344 68762.4375 176515.9531 91612.5547 156538.75 77599.6328 557394.6875 185293.5 484570.125 143494.4844 316922.2813 134261.5938 502184.8438 442396.0625 67158.6797 423845.6875 106436.4219 122393.0391 368408.875 82013.4375 799340.9375 312519.125 1431587.125 131505.1719 171788.875 73041.9688 873588.0625 80435.2969 98720.25 102538.3828 280974.2813 462627.3125 93420.9219 108250.1094 311557.9375 85632.2891 56552.125 422871.7188 2078063.5 253795.9219 274007.5625 117258.2422 170894.4844 406752 267248.8125 268390.1563 138771.4531 729266.75 341833.3125 149583.6563 573786.1875 132973.5938 151410.9844 507522.5625 14922284 208933.2344 665828.6875 607152.875 201682.7188 237958.6094 118111.3672 136509.3281 298872.9688 442585.2813 157101.8281 1289350 1070523.5 6862960 171935.9219 167916.4063 103609.3281 1332435.125 47831.4922 311740.1563 444059.375 278122.2813 99237.0859 135333.6563 95963.1563 43659.6992 191752.3594 397658.1563 275767.4063 181240.9375 483347.875 474648.0313 24961.2461 172132 181669.0781 433155.375 205470.4531 46652.9375 191721.9844 149228.4688 329300.5625 94867.8438 282134.0313 857978.3125 628422.9375 140620.6094 640706.125 375399.4063 110877.8125 732954.4375 332252.375 260366.5469 211944.6875 110394.1484 116901.8984 486013 977882.6875
N-acetyl-cadaverine 328448.375 516297.2188 272791.9375 189929.5 103241.2813 396506.8125 424113.9375 158773.7656 455064.375 846046.9375 119306.3516 400909 148577.2344 204546.3906 151008.5313 227150.4063 128532.4219 146104.9063 394830.4375 123924.9141 126402.7734 668866.0625 106239.7344 85585.6172 264188.2188 103763.8359 625981.75 139243.9844 325227.7813 281497.5 182203.2344 202173.2188 415011.2813 308800.9375 1232440.25 192202.3125 236850.5156 567329.9375 90715.3438 155320.2188 192887.5469 80235.5 1055563.25 156135 184047.625 82879.625 310656.5 900744.25 210546.0156 722977.1875 107255.7656 245026.8906 725705.375 602778.5625 191276.625 105719.9375 242600.3438 370269.7188 60188.9414 765088.3125 352823.5625 3125043.25 723211.75 281749.5313 6303983.5 157680.1094 101981.8203 65200.7383 76982.0547 179928.8125 115048.6563 224543.8281 206837.1094 384141.1875 849052.25 311658.4375 236413.5781 2453006.5 7013467.5 90055.2109 443449.6563 71135.6172 357848.7813 484873.8125 414819.9688 401873.1563 166124.4531 264859.2813 73835.3672 132232.6406 262435.125 1461088.5 213778.7656 344244.1875 156192.4531 99445.5234 249699.9375 141361.5781 428006.8438 603882.4375 295146.4375 188084.1406 206677.6094 1314640.125 163674.2188 246069.2031 103508.1719 6093129 145326.3281 953016.0625 347542.5313 3796109.75 284504.5625 434135.9688 229898.3125 1174303.375 575079.8125 95901.6484 569656.625 120227.0703 768474.1875 414563.375 3942194.75 1206494 86751.9688 336054.1563 66021.9688 115291.5234 282644.25 86328.5078 2734314 1395439.625 1686162.625 214531.9219 95211.3906 156789.4688 476568.5625 777214.75 140524.1563 261188.5 823424.6875 146988.6719 866108.5 47668.7305 246120.1406 134235.8906 403958.4688 359333.5313 1495589.375 2936705.5 97557.5625 161079.1563 397950.4688 647485.1875 197757.4688 2677438 179193.7344 453574.375 530064.125 159918.9063 301170.0313 44760.8008 367320.5313 139773.9219 180701.5469 271760.3125 1654617.25 289917.75 200749.8438 1934176.125 196559.3125 65881.2188 447278.75 415150.8125 709878.375 451561.125 884324.6875 299880.0938 156264.4219 238169.8438 1957608.5 346413.0625 578386.4375 76094.4609 141616.9219 111430.7734 148563.0625 290267.3438 1236721.375 432143.0938 148119.125 373533.7813 147102.5 259998.8906 989705.3125 222648.6563 515853.125 213270.0938 202201.375 288500.5 1466120.875 62623.2578 58004.0313 307004.375 405176.9688 1767774.625 43421.0977 247077.5781 15887008 195965.7188 6553072 10915268 1936948.25 788547.875 1094165.5 380520.0313 135600.5156 166361.6875 708992.3125 266820.5313 288500.5 238495.3906 1599774.25 605858.125 341386.5313 58851.3047 132450.5781 295390.9375 219861.8906 200447.5625 710082.75 5593150 802055.8125 64892.3281 169877.5938 39477508 9362410 525047.125 717557.125 156919.7031 917970.625 643628.5625 787085.3125 1160783.5 183795.5 3722650.75 765201.3125 79276.3125 487168.1875 1286955.875 87292.1953 170700.375 592580.5 924023.9375 40820.8359 246955.9688 342784.9688 505663.25 393477 538851.5 35607.6836 301052.9063 1122431.75 183997.7813 6805230 292496.4375 102233.9922 58367.8477 262808.9063 1558995.875 82117.1563 856657.75
5-(galactosylhydroxy)-L-lysine 435746.4688 289715.4063 396841.7188 338081.5313 293863 641089 244144.9063 450025.7188 452720.5625 1017189.688 395213.75 347603.5938 401549.6563 338369.6563 251170.7969 350707.8438 411377.25 439963.0625 343734.2813 621501.25 377107.625 779743.0625 638630.4375 411971.75 749524.6875 405331.75 774417.5 294098.2188 573848.0625 555451.0625 402914.5938 332009.0938 963428.4375 590044.8125 579464.625 185292.2813 774700.1875 757585.0625 380624.7188 306364.5938 366826.1875 840913.5625 433647.0625 608003.25 799374 582634.8125 769299.375 410784.5 431956 358896.75 6372076 3468718 1001992.875 2235123.75 9656254 6398451.5 387454.6563 496083.7813 206484.4063 6523786.5 2357943.5 711775.5 9685953 690575.8125 11768227 506462.6563 4957210.5 262947.8438 4594473.5 850922.5625 6064113 486823.3438 657928.0625 1017640.063 7744148.5 2621049.75 359298.7188 1628685.125 2489954 3510219 4832399 6732348 5833249 3194399.5 503158.1875 2390326.5 296728.4063 3771564.75 597347.3125 480553.4375 1263378.75 284475.1563 4219695.5 6119298 2345382.5 5289007 9695257 4448463 4476404.5 274081.1563 839986.375 1361665.5 5917033 917831.5625 341345.7813 2847809.75 1177090.5 342618.125 415357.2813 529783.1875 1041266.188 3243499 1099034.5 1009247.063 745182.3125 1423257 1215322 8763595 833645.1875 1009901.375 3110062.25 8137181 377146.3125 4652276.5 4775535 2141799.75 861566 3213234.25 3661664.75 7964808 2045938 5368595 921926.9375 4499150.5 627786.125 440262.375 1991335.75 736489.3125 733594.5625 4952325.5 1216475.25 773644.5 5194600 3952482.75 426255.5313 341998.5313 615280.25 769813.9375 6805270.5 1226333.125 1239537 5910747.5 389761.5 7373898.5 7539052.5 1214168.75 726094.9375 1872494.25 1170571 457907.1563 839267.9375 555539.9375 1059580.875 541538.8125 12430862 1715188.375 3454265 863864.1875 1835273.375 1378956.125 1274972.875 1053694.25 7997534 1483674.25 660754.1875 666863.375 3811876.5 1683637.875 389565.3438 1279343.5 1273604.5 8355170 809340.125 8565371 5752346.5 622850.1875 2716885 1215322 3433948.25 4869325 1912479.625 3260161.5 313713.625 3892277.5 1343327.375 16320926 960195.5625 5130958.5 6883220 735272.0625 12355921 524899 4889311 2603192.75 404719.0625 858092.5 1089303.25 820941.5 3814411.25 3997350.5 2796572 798522.25 548341.5625 2262727.25 2484465.25 1190263.625 696787.8125 6598032.5 4085089 2357019.75 2239878.25 466997.75 17793800 3364313 721637.9375 459598.5938 594595.6875 3718065.25 1861766.5 1466636.75 1764190.25 5001771 871074.1875 4579586 7980572.5 2537312 1146540 11464940 14986593 420390.8438 1784502.5 2730435.5 3668691.5 2069931.25 1342521.5 623791.6875 2475256 5221006 4652265 5737627 276481 1990207.375 13997240 5570663.5 1515142.375 7110676.5 4348329.5 6346264 307089.7813 1067410.5 2834984 854867.8125 260721.7188 6071061 2840313.75 804517.9375 1086948.875 2489753 3127452.5 1693086.25 6220328.5 423469.1563 7190450 625726.25 1346801.875 468107.5938 3308885.75 779390.6875 405447 1108625.625 379261.0625 421995.6875 1551354 4583444.5 4678182.5 2768940 4805471.5 607015 10175746 2092726.25 551639.625 1897587.5 2119386 7633643.5 365781.3438 2088493.25 1544033.125 723473.625 17086410 4900365.5
cysteinylglycine disulfide* 43876960 44028700 43758380 47924104 24553292 59349084 31877290 43013852 49543800 42927412 43852344 58203100 34681764 35180572 46298068 53982552 33315234 32462986 42176388 49972848 31953460 45053860 71405072 48898568 59722356 32730628 53793044 28157018 35008916 40873936 42022344 33620100 57678808 61679752 49772200 44936356 36079804 84037896 45748796 35840636 25321354 31471608 33806880 38500348 34522536 46245832 78538816 35216392 36490968 40918972 36240416 15149391 25368504 34055132 96262720 47219156 29183368 22365650 34455500 45485828 43407032 35375784 44923172 36242536 277161696 27107964 162848624 33841208 17339620 97864776 211775648 37254764 31873744 33780560 61456496 89060280 58249436 72010784 51709704 42175920 60478304 150884240 102029728 23213858 29345130 12660367 36356592 57323908 39538952 24750186 35877252 8106338.5 91598776 27021130 20279866 59381288 104651664 11328530 126593840 24193400 18481672 37603928 33691948 57426564 31353242 22242786 28529104 47662628 38693796 29699496 30000546 95458048 67851256 45725676 28503824 36979812 63282648 13368823 45942148 42780860 151409856 79019336 36125012 53344460 81456000 78204536 13514364 43761592 36666344 55367208 23837988 72046944 38960396 36544628 16480017 24278722 41403380 31590992 43610940 37646104 33930096 53007936 4768634.5 61454680 46208820 25924890 50786760 39291904 36552588 59308628 44585692 67680872 32991730 39725160 173702832 30976780 4097323.25 113980880 56178144 78510216 36704880 29309868 83829464 24091098 175813232 38091748 28010944 42516756 19843900 31921540 63842916 49208620 107943392 50806020 44427864 40419796 53736724 33962916 25917578 64153468 61455140 35993772 59529584 40073464 115060112 46337516 30720456 28581204 40368260 60142176 34223372 137910048 26701022 22161438 93129200 59347656 20500336 132692440 174589904 44301144 134508832 40080624 14487644 61262212 47596928 19960476 31360686 44014816 22253066 101884856 19750700 67779792 22244738 61777160 43761592 17857072 38106076 285943136 19905640 12416659 31824444 16276677 48067332 58907504 27850100 27815128 39503676 125007800 46236748 68283456 45728056 19553670 43912248 97324144 149784688 166725424 109772800 67793160 40168008 24360258 33142170 56866048 35395032 51901904 71191352 72862136 74605376 62321208 82663016 56656652 35410812 53017316 150232304 45867548 37098884 202009344 65913808 77965480 30383576 34260980 86993336 45072288 27096346 166198576 75054568 39304320 63627212 38246532 53365808 27807712 20932884 72260936 143002096 47063320 47217552 29345188 62097044 46415828 67203016 72296264 63631412 12289167 22393512 46917336 26242968 63665324 172331328 55360196 33527824 100399512 64491584 37810028 177304656 55303356 64447744 33166516 40026764 12075657 103486392 54882260
formiminoglutamate 1205713.75 375442.7813 1162768.25 1705659.875 413216.875 876221.875 910043.5 966426 1118248.125 2287096.75 1187070 603086.8125 1072135.75 295623.0625 617725 938229.875 469317.75 2268661.75 1109849.875 836511.875 320344.3125 763581.9375 1219378.75 731744.875 777261.5 334984.0313 637726.1875 587162.75 694388.3125 762067 288641.8125 300144.4688 898345.4375 832401.4375 446615.8438 675176.25 1131593.5 298038.7813 199872.5938 313078.1875 424786.9688 124568.8672 333967.0938 942259.5 875584.5 1351216.375 241206.4063 2873262 500302.4375 13057610 326402304 2593717.5 1610483.25 6742931.5 3399684.75 648549.25 2567346 1246411.5 24337078 18694396 1270669.875 32247322 1651413.125 4803511 1217774.125 3097329.5 1760540.75 6877776.5 716207.25 9992760 2474362.25 24888830 1802378.5 4272331.5 4479797.5 2497609.5 1659804.625 1502483 8411893 9249895 5155823 8173891 5486285 2135026.5 8854045 1020109.5 12814727 1288852.875 1632252.375 5535579.5 951519 3263403.75 5313190 3513791 2776455.5 289297728 16002598 4890640.5 8367007.5 18349536 9357988 2314728.75 3953028.75 2700201.5 4315430.5 3172967.5 1157450 2416826.75 4350290 1759933.25 1899771.75 2150767.5 1642616 3290332.75 4512589 1796889.125 12058492 3927986.75 4367944.5 13648135 4243805.5 2193319.25 15024315 5387771.5 2183103.25 2819042.75 4443431.5 3081291.25 17737072 4501851.5 1638734.5 1638974.625 26190964 828193 2780315.25 3491987.25 2421005.5 613330.5 23609174 17909314 845117.375 50323380 7628909 4801852 1587409.5 1348626.625 1609166.125 3843386.75 3761273 972642.375 6531726 420891.8438 4539181.5 11803916 1671052.125 86403872 8284864 2210157.5 917444.375 1737858 32250118 2567346 2384821.75 8857614 4546827.5 4579404 4921737.5 12869680 3026763.25 1765362.125 2179636.75 7886859 1076394.5 1557787 3162023.25 5378827 1782491.125 4063013.75 4561866.5 1716800 7008752.5 671355.5 3285199.25 8161762 2739041.5 7322213.5 1380416.625 1576316.25 2168913.25 5517676.5 2526201.25 3362106.75 20942858 4624476 4315718.5 905479.1875 4034310.25 9776953 1790334.375 6818626.5 3160656.5 16832824 8010845 1080291 13586838 5787550.5 9959643 2347123.75 15461810 7762346.5 1073030.25 457163.625 23380430 3082485.5 5002225.5 859655.5625 13729110 16403139 16220390 1408607.625 6611495.5 17565302 5778235.5 3717374.25 871479.6875 843155.5 4900872 875835.875 1146115.375 9095329 66470056 37431236 21414666 2968740.5 1606477.875 4782923.5 10226918 7693250 956275.875 9450709 4801868.5 3744368.5 1075124.125 2567346 1094209.375 10597819 23023862 2722983.5 3956290 606826.625 3171778.5 17974300 2869386.75 2417802.75 394984704 2471406.75 4125083.75 307563.625 485110.9063 49067372 2132993 1006152.563 56422372 2597689.75 1261047.625 1533714 1737849.875 157547920 1706177.125 10216950 1127816 5350076.5 1301697.875 548110.25 255908.6094 3601083.5 1488920 1175535.5 2482007.25 2517623.75 1220814.75 1940565 3104295.25 7515401.5 6300141.5 1505146.5 1145992.25 19105266 3254043.5 2633376.25 1904063.125 3803587.75 2588219 1441248 953404.625 2080637.25 543396.5625 3098702.75 1366059.625
4-hydroxyglutamate 995045.625 261623.875 411638.9375 529656.0625 172307.3594 1108106 1149664 744307.1875 531741.1875 1707540.125 1397525.25 554649.0625 321485.5 547772.4375 401918.1563 1062247.375 692898.125 2780752.75 780908.4375 562953.5 140236.3281 245135.7031 639531.75 819456.375 735286.5 230622.3438 685343.875 475196.9375 490862.6875 260677.5781 608250.75 200459.8125 882541.5625 518832.9688 478508.5938 1519984.25 1169850.25 252220.2344 602440.4375 633743 731259.9375 1334605.125 34994.1055 637000.4375 537449.5625 635349.5625 274167.2813 557798.6875 297970.625 279003.0938 1420899.5 527692.5625 350347.625 159347.2813 116211.3125 230240.5938 190021.9063 387920.7188 134724.75 235393.0781 246155 145044.9375 83997.7813 135037.2813 292991.9375 288274.5313 203036.125 102831.3594 256379.2344 172106.9219 269430.5313 149487.8281 127317.0938 335638.7188 235937.4219 145000.2969 153282.8438 195442.2813 245512.8281 83200.7813 193713.375 317337.0938 446178.875 236140.6875 128119.8047 92796.1563 103303.4844 523892.75 264767.25 130593.4531 200242.3438 239955.6719 214998.75 93776.5 78460.5625 306108.7813 310602.9688 143325.5313 153291.3906 298617.5313 197498.9063 23163.416 546261.125 299139.625 302650.6875 176766.7969 155104.1563 357030.5313 323164.5938 76813.7188 799347.3125 270015.5 208596.3281 115141.1328 170576.6094 266345.5313 147086.0313 139480.875 178251.6094 245031.0469 65898.8906 1160770.5 595025.1875 166768.9688 360166.0938 214681.9531 273578.25 210045.7031 159410.7813 479924.5938 228958.4063 372888.625 76445.3125 310528.125 174427.7656 336318.2813 224991.8594 303786.3125 171145.4375 140639.7656 140415.0781 124368.7422 176523.8906 210654 264192.75 521201.3438 78620.375 208822.0313 352639.875 270630.9063 95269.9453 243399.5 287981.875 455086.875 210627.6875 173972.2969 124071.6094 84362.5313 84113.1328 161376.1563 172842.4375 661199.4375 259126 641693.0625 440458.5625 479904.3438 200082.2813 137422.4688 178579.5313 327754.5938 328547.125 150506.0313 252539.5781 191151.375 278072.1563 1188833.125 745411.875 274718.9063 360830.9063 219653.8594 85611.1719 495355.5313 115120.8906 200285.7031 267642.0625 62371.6133 260200.0469 250571.2969 317658.5938 337725.7188 658139.6875 607840.1875 270949.4688 128488.1094 323647.375 257671.5625 181022.8281 164307.4688 260580.4375 248951.0313 304469.5313 275129.5938 62156.0313 471067.375 119395.5234 96472.4375 457447.0938 1149514 173583.6563 236412.75 118146.125 208747.0469 127653.7109 808388.8125 292702.2188 240766.9219 299493.375 249406.6563 420331.8438 490851.8438 212335.125 60167.5078 352730.0938 167561.4375 256628.125 556260.1875 111630.6797 529851.0625 222222.6719 159965.4219 255529.9063
gamma-carboxyglutamate 697299.375 501501.625 426906.5 899658.75 564394.6875 1117256.125 633527.875 603377.3125 563382.6875 1725272 717582.4375 770625.1875 562678.5 505148.9063 513581.9063 815469.625 675244.125 835537.8125 878496.375 859016.75 632023.875 905548.5625 970870 519105.3438 969676.1875 494287.8125 484443.7813 530604.4375 853914.8125 772829 663843.5 484657.6875 880509.4375 762289.25 835375.1875 495654.4688 827120.3125 1101631.875 560990 624468.625 575691.6875 1203800.25 636021 711135.1875 1070014.75 794662.375 959301.75 564292.5625 855833.5 676346.25 5488343.5 2540547.5 800034.5625 1693478.375 4248202.5 3986088.5 542188.6875 542856.75 320748.875 3488047 2095920.25 401880.1875 2294527.25 663634.25 6702091 397667.75 2089502.125 465203.9063 1129086.375 512080.5625 839528.125 725338.375 478329.625 474396.1563 12790338 1474831.875 414556.3125 855833.5 975979.9375 2267552 2597104 2177786.5 2674068 1839991.875 489608.1875 1150050.125 417673.6563 3045332.75 506994.1875 293576.625 555356.875 296905.2188 2126626.75 2442877.25 1543620.125 876348.5625 3468831 4417754.5 2812246.75 428333.8125 512944.5 642151.375 2870403 514196.6875 342713.8125 1906068.125 547999.125 442652.125 492398.75 466396.5313 603878.375 2904648.5 1187040.375 1060924.625 511696.8438 1369438.875 923702.75 6900426 654955.6875 785635.9375 721420.25 17338190 483501.75 1434010.25 1533913.375 485536.5938 811475.625 1165755.25 2354454.75 4640422 709365.25 9964839 646382 2561970.25 415515.0313 334177.5 1214169.5 555496.5 579767.375 4853255.5 857752.125 563747 1032449.188 1081580.75 454814.4375 444059.6875 574527.6875 626543.75 2362746.25 555810.875 1329470.625 1754733.5 308992.6875 3390146 4642819 960612.125 470799.125 552072.875 959747.9375 493835.125 922651.3125 683320.9375 905576.625 566741.6875 6085731.5 643222.5625 1671914.25 369606.0938 492658.6563 763565.125 692509.1875 616030 8876297 761676.6875 891161.625 697108.1875 1288077.625 805210 398470.5313 1405621.5 369574.75 4913875.5 603227.9375 6896399 1449119.125 901672.1875 2522524 813846.625 3328328 1839904.125 1580832.75 2732326.5 308652.375 928728.125 683838.375 12761136 636897.75 3327601 5562789.5 402952.8438 7573165.5 479549.875 1267551.125 1365655.5 458555.6875 557762.125 726254.625 378645.375 3938187.75 1030589.938 640272.6875 685336.875 466760.9063 1352640.25 2439082 689380.5625 666057.125 14344081 853660.9375 1606612.125 1736622.75 342863.4063 7526906.5 1450200.5 462297.9375 593148.6875 751442.625 1757306.75 1893829.75 815452.5 986994.875 1569789.5 603545.5625 3185869.75 2695070.75 926526.4375 779105.8125 6642588 11569397 423734.2188 2167860 1116522.5 1875302.375 1749659.25 1686030 601374.0625 2174762.25 1625016.875 2761476.5 8549056 403006.875 1499863.625 14252967 6909733 988241.8125 3450125.25 3488997.75 12636667 354635.875 1089478.125 2720432.5 668704.4375 267903.125 2043876.875 1534110.125 686520.0625 806017.375 2177237.5 3070637 1003321.125 2554924.25 445115.1875 8503597 242186.0625 527876.75 380478.8125 2184760.5 733404.875 572216.5 537614.25 852648.4375 300533.5313 1219681.75 10356698 2129703.5 2436924.25 4886576.5 714891.1875 4190637.75 1117282.375 439781.25 4132335.5 505076.6563 10774859 286336.9063 1360960.375 613773.125 446715.1563 18805798 3043435.5
norcotinine 55841.7578 326055.4688 169197.7188 443923.9375 53625.3203 980877.6875 75100.3672 99541.7422 516201.9688 273929.9375 96150.625 328935.4063 76540.6953 80515.6484 118623 303437.8125 204033.8281 170184.1719 288448.1875 187109 422923.9688 94134.2188 213760.5313 187109 180329.1563 252679.2656
hydroxycotinine 496791.1563 1179175.75 1561256.75 2688469 1955497.375 693521.5 3867566 2905455.75 542617.9375 554841.1875 50411.5195 627361.3125 665231.375 7682053 480915.7188 901825.6875 332966.375 1891914.125 291501.125 555268.6875 2666434.75 68765.9063 923800.5625 1249672.375 97414.9688 79825.1641 1257719.5 1089077.125 2184001.5 513969 499592.6875 762485.5 60694.3125 41812.4648 76074.1094 6091812 135452 501705.2188 374011.4375 3188352.75 88960.1328 266482.4375 1261175.375 2689418.5 518394.2188 1656849.125 6290821.5 2002202.125 777761.625 1239600.75 233973.5469 2012241.125 319943.25 1357918 1164255.75 5266923.5 2093084.25 80435.5859 831449.4375 78330.875 1014381.313 440432.9063 234809.4063 762485.5 712664.1875 1727219.875
cotinine N-oxide 160708.5625 325091.75 186706.1875 344304 159458.1094 186717.2031 258651.5625 431219.0625 99957.7188 77201.7031 194728.25 1590332.25 89289.9531 135745.9375 612683.4375 250031.9063 63146.6367 390496.5938 52061.0195 164405.4531 105356.3516 130891.6172 123819.3359 119638.9297 67427.0469 93744.4219 361854.0938 395185.3125 119623.0313 205388.8906 799327.9375 62855.6602 472727.5313 706319.3125 349832.7813 245613.6406 397903.875 152000.4375 123228.7734 79749.6328 879309.8125 89837.3047 1147360.75 33126.2773 182423.5 255143.8906 137099.6406 553081.9375 110074.0859 182423.5 105987.6484 730061.25
argininate* 957039.3125 1650914.25 2027015.625 942791.8125 944513.0625 2488823 1703205.625 1716642 2461351.5 5251781.5 2604168 1243837.625 3000403.25 1333286.125 2018799.875 1507883.625 1546717 1106493.875 2312977 2536148.25 1227534.125 1838217.125 1932390.75 1851327.875 3514403.5 459924.2813 1830020 1209836 2428831.75 1244091.625 1777310.875 1764120.25 1709686.375 1689912.75 2359209.25 1471333.125 1939323.125 3168455.25 2118786.5 965560.875 499768.2188 2992409 1660391.5 1520228.125 1117436.375 2534470 1186056.75 800198.625 1266525.625 1839974 7770977 7565801 2794554 1915830 6363663.5 1381298.25 1145885.25 1351711.375 307129.5625 5785284.5 5252078 2645420.5 34963032 1821812.25 6707891.5 632242.625 16451482 509572.625 10280717 2350272 12910470 1061356.25 2108219 1920479.75 6645471.5 4244415.5 1071734 2635458.75 4987269 4105065 7877521.5 10853647 12870311 15592595 668073.4375 7589536.5 587939.0625 25747488 809813.5625 683885.75 2409619.75 536992 4924301.5 14023250 2360842.75 4686338.5 36226112 3473706.75 7755727 727512.5625 2087931.625 2666958 5160314 1573880.375 1112389.375 2175566.5 2558559.25 729188 504596.375 1467047.25 1229891 1620453.875 1974703 1295602.375 1012831.938 2723978 1016714.313 15177203 2534470 2473052.75 11572633 15538495 1657525.625 14643024 4958942 2533116.5 1287386.625 6115713 2903148.5 13518470 2676824 4629642.5 1178076.25 8612985 1896740 334571.125 5801941 1320528.625 1747837.75 24213784 3385803.25 2192317.25 15564589 10581537 1416776.625 656678.3125 1077056.25 1239492.625 10069964 2613217.5 1664638.875 11336693 521017 4916273 8187027.5 1777065.5 521705.25 1638456.25 4331717.5 453396.0938 641198.625 2896718.75 5500194 1983351.875 8976348 12836673 4189225 5200403 6788832.5 5678972.5 3341043.25 2692103.75 3709829 1705794.375 1389015.375 1212460.375 8228621 2487328 886225.0625 1751850.125 592294 12489671 452957.9375 6121111.5 24856510 909313.75 8293217 1301067.625 8925442 7351063.5 2973700.25 8716857 728907.625 5029066.5 9648590 5787798.5 864488.25 8445151 26577810 829420.5625 5718716 927082.4375 3318700 8605185 1254413.75 3855769.75 2219249 2593680 6078621 13026962 4794170.5 744779.9375 848374.625 4753750 5888699.5 2106444 1625832.125 21290250 5870904.5 3316739 2581612 2019333.25 13672684 10201283 3111737 695816.5625 641897.0625 5509893.5 2875699 2924452.25 3706033.25 8343826.5 3133267 10233182 6229324 3703705 4160172 21977474 6204775 1282967.375 4100264 3420980.5 3195529.25 4168508.75 1592287 1227486.75 4091601 13325192 5786635.5 6532412.5 555781.3125 2077300.375 5531720 3916445.75 2666458.25 21346156 2476884.25 7624731.5 1323263.875 1322907.625 13859342 1147108.25 1165419.5 16940480 4326128 2323013.5 3470855.25 2721069.75 6268832.5 882281.5 8879395 2024681.25 5505004.5 650415.9375 1050848 228404.1719 2435204.75 1949651.875 1073851.375 2561243.75 1180007.625 615010 2429504.5 3647823.25 1781725.75 3180614.5 4937175 1013335.813 7636805.5 2865827 1581520.75 6487400 4483526 2612228 2036765.375 1578740 3531720 1085502.875 4727569.5 2719185.75
2-oxoarginine* 732808.75 797554.875 1454950.25 818291.625 1205827.625 568578.125 1896830.5 1291923.625 1586570.375 4840108.5 1852313.125 943503.25 2382234.75 507258.5313 1217821 1208637.5 1351958.375 1031701.25 1579728.375 1140134.5 615472.6875 855683.5 1110674.5 1026279.313 1781847.375 586540.5625 1035531.625 640255.1875 1235051.75 610038.0625 2012080 1391999.875 755602.125 1712541 1242730.125 1820696.125 1249239.875 2480054.25 1159049 576947.125 692438.875 712717 1118301.25 1037019.813 1257080.125 2770442.25 453719.3125 563261.625 670048 1328588.25 5682298.5 8089181.5 1002116.938 941041.1875 4668318 439375.7813 795795.0625 1349116.25 234323.1563 5042422 619455.1875 2216849 11393256 1056554.875 10835146 401569.8125 9695727 350881.4063 4277073.5 918393.75 13417234 310075.9375 1238891 794396.125 2555470.25 1341302.25 472653.5625 1009700.75 2217168.5 1831314.875 2236875.5 2157882 6003678.5 3316313.25 501593.6563 3723495.5 300689.0938 5067768 552026.1875 351753 951761.6875 550899.625 3584477.75 2908536.5 620354.375 2724367.25 61970248 996495.25 2589170.5 434426.0313 792848.9375 1438298.125 708418.9375 343138.3438 506246.125 884850.875 1330794.5 387069.4063 299846.0625 597971.9375 442025.5625 721894.0625 398106.4375 618154.6875 607396.5 1579676.875 388062.5 13048646 1558498.375 1793085.625 14721486 6925537.5 771446.6875 6106325.5 3842174.5 2049284.125 433589.4375 3099467.25 691332.3125 5596671.5 4686941.5 2342164.75 855913 8170929 1143447.375 819130.1875 2912727.75 740605.5625 683183.0625 6434375.5 704858.4375 1329574.5 13444545 5113206 951932.75 533994.625 496058.5313 679549.8125 2232968 798229.125 320390.625 5787474 343592.6875 1784018.75 8326226.5 420165.5313 855913 2101128.75 1820537 326902.5938 155464.2969 736725.25 7110083.5 1544551.5 2644954.25 10532855 1226503 2099753.5 6334168 1405073.25 1052896.125 1867749.375 4514336 705485.625 947543.875 338917.125 2008022.75 915916.5625 603755.6875 553553.5625 1430132.625 3374637.25 449188.7188 3998572.25 3381917 216006.0313 4794731 368026.75 3722158.75 2417935.5 1220262.875 1405328.125 624398.625 6429406.5 3855068.75 2323476.25 205097.5 2378155.5 18755380 292607.4375 5272172 627947.3125 3205164.75 2864894.75 367872.1875 3923733.25 1542959.125 2734843.25 1941814.5 7202155.5 7274774.5 329850.4688 638608.8125 2651814 1238891 1058943.5 784991 15745818 1360824 2374242.75 973390.6875 1942502.375 5683717 6818033 4867250 426358.0938 213935.1406 1323898 1366897.75 2596658 1590586.875 2989794.75 1167313.875 5619870.5 8615421 3474188.25 2354922.5 3613358.75 1435729.75 1028362.875 1004772 2369430.5 1504080.375 1026445.375 2384703.5 391440.0313 2067882.5 7737071.5 1215404.125 2627457 249815.7188 2091259.125 2050855.125 1155642 1090523.5 16624725 680316.4375 4801839.5 841590.875 736534.125 16693253 530657 647477.75 9452206 1377065.875 1217004.625 1420932.625 521476.375 10497230 297819 1154174.625 1664047.875 2086686.5 407647.75 926319.3125 130436.9844 603523.1875 1173111.375 767448.625 1631513.875 1215227.375 571427.5625 739847.6875 637486.125 1912346.875 1555600.125 2287313.5 444225.2188 1994305.875 1067922.375 921520.1875 1955899.75 3827218.5 703906.25 819415.75 249809.1094 1177032.875 503599.6563 2054993.625 613056.3125
1-methyl-5-imidazoleacetate 547979.6875 413370.875 1354102 2775419 547998.9375 4591461 3014914 3018237.75 2220132.75 61161036 1219689.375 2366968 3866686.25 4194164.75 1273381.375 745906.5 1475024 2244487.5 2692445.75 1494564.75 2202099 3585351.75 3346555.75 489172.9688 9146309 1013549.125 5819848.5 1692676.75 3503766.25 4680487 401198.6563 997000.1875 10699875 7312746 3674343.25 996561.5625 1182260.125 7673018 868669.9375 4188127.75 422837.1875 3682770 1762315 1380724.25 1048477.563 1837154.625 959540.375 402088.4063 5408798 1264594.75 118617440 1446033.375 23786768 2067012.125 17134900 5898736 3772917.25 286746.3438 2190077.5 51915176 12839040 351503.7188 3017918.75 2570020.5 223698032 3287312.75 2692275.75 3216283.75 1164485.25 4189583 633566.6875 932960.5 389441.8125 171971040 3598419.75 1032599.375 609140.25 2407117.75 947881.8125 11099832 1369680 15096092 3832882.75 498358.125 650184 977078.3125 8828835 690040.375 1103547 348316.6875 911346.4375 3539446.25 18641610 858843.375 4949784.5 112842424 20959404 519635.1563 877893.8125 562922 3645066 3028874 654082.875 16220439 2265412.5 558431.25 6871402 212168.6406 1615385.25 19229398 5720515 3270077.25 1166978.75 681622.75 897946.8125 3157755.75 446528.4063 586683.875 1664804.5 187814512 1264524.25 6342531.5 2130393 328771.5313 1349860 3613024.75 29125880 4038798.25 292043.5 36249560 2579588.25 8160038.5 496004.8438 136985.6406 717096.375 1242475 2346806.5 20930746 5083364.5 296521.4688 719504.375 1990552.875 621422.4375 1722710.625 647728.25 377900.4063 39834500 658715.9375 30277288 1306599.625 3612747.5 1888316.625 133903992 2510099.25 966315.8125 1630166.75 1769919.25 12199634 532764.75 6010418 3255003 2211069.5 456148160 355188.6563 21036120 519957.6875 700232.5625 4779012 1233635.375 898358.6875 94599328 2405915.75 6361122.5 5366136 1148942.25 1122593.875 630812.1875 4451620 466047.9375 198009104 421200.625 90597240 1127666.875 4303652 7418462.5 1966177.375 14132083 14884558 4288851.5 62583820 1305009.875 2909525.25 11017072 147669680 5915864.5 59462604 377997280 1341456.25 181043632 711013.9375 406466.9688 810792.75 1927985 304748.75 1232191 59719.125 65623852 618960.4375 4309924.5 319442.9375 431605.25 3956241 22891788 19262602 569708.875 92542648 1162013.375 2686639 6278449.5 238549.4375 106817216 5185789.5 565972.5625 2589654.75 1846137.75 51908292 2272510.75 3046535.75 3640625.25 4843528 1579318.125 4445909 12994557 219782.375 3251082.5 25812346 108772184 1133710.75 40563416 35959504 2281667 8070711 8398708 1364091.625 3091903 1723978.625 16493747 97543768 449690.0625 3440736.25 300522880 480572576 489793.1563 2548018.5 32568840 303232480 912842.0625 1007303.063 2366968 4806045 1409352.875 2981523.5 77686016 176314.4063 524832.5 3222568.25 1105684.25 3430374 2106362 1187026.375 21472660 201638.2188 657021.75 966435.75 6712200.5 274622.4688 399798.8125 3279150.5 773812.375 134639.4531 9281476 68805536 2328528.25 5570982.5 19008514 597396.375 8687305 3994324 1601555 21337896 842080.75 366277856 2366968 1541361.75 717971 128882048 111181064
S-methylcysteine sulfoxide 4883377.5 3984882.5 9381656 7315712.5 9175774 4294193 7494443 3759924.75 3485330.25 6278045.5 3854340.25 3911713.25 10416074 3410325.75 7800510 11977332 8537385 6306061.5 5963205 9188146 15695607 9657309 9986922 8206802.5 10519192 8587343 11946029 18539304 12848969 11065349 27573736 8993410 14397564 6201531 6873552 9181962 12321397 28635150 19292394 24046142 16748552 9848896 3323585.5 3180134.75 6250617 7405029 16108639 5422948 9531460 6512455.5 3273003.75 1130893.75 4306971 2163353.25 2271193.5 3812621.75 3656997.5 1051607.375 3153911.75 1348252.375 3265603 748818.25 210140.2969 1500156.5 1104573.125 956117.6875 1369087.75 2426539.5 1416943.375 1617899.125 2340932.25 1320167.75 1221715.5 517314.875 952728.5625 1052454.625 2757450 1288155.375 182208.9531 2442547 1019353.625 738951.0625 962647.1875 404179.4063 1284325.625 254820.0156 1661646.125 985459.75 596573.8125 1547283.875 1328384.875 1092768.375 616647.125 739108.875 2592537.5 1189926.875 922332.6875 4401916 541161.125 2248108.75 303482.5625 1489040.25 1526550.625 2324603 892186.3125 4568312 665509.5625 1018894.313 2346283 3991821.5 5629963.5 2729580.25 2944263 3884441.25 916669 2491215.5 2877228.75 504760.625 593118.5 1151494 2714308 1388291.25 978396 2819281.25 279970 1939319.5 475920.625 927700.1875 3237933.25 1255979.75 797208.625 2860957 2690730.25 1689841.75 877240.875 1232636.125 649403 2056961.75 1315257.25 539905.875 2115974.25 620493.4375 3769426.25 646217.0625 1072961.625 5972867.5 1497602 3801605.5 1007784.875 764194.875 2236342.75 473241.875 2489207.25 1177780.75 1635972.25 1480132 501705.8125 1332692.125 1782939.75 1644417.625 1189515.25 938707.1875 1641058.125 2342436.5 940411.875 1345184.5 2220976.75 888102.5 399623.3438 2094534 584692.5 5542720 5773288.5 5472241 8077589 3021993.75 2541421 751552.1875 2310249 3935561 1086365.5 1493869.75 2685634.75 1544909.25 3205468.5 5331781 1494213.375 2306192.75 3701294.5 2066308.125 1290912.875 2807386 476000.3438 2130136 1559784.625 1595779.875 2887112.75 4888765 259501.125 805972.9375 2918709 2681417 1828074.875 1807170 2393827 1851323.25 1356085.625 163167.2344 1929814.5 1727373.75 488948.9688 2994996.25 850566.5 1028469.5 2346283 1540246.875 1547841.25 1119197.875 1486833.875 497124.2188 3209225.25 721574.1875 702500.25 1175584.375 2786869.75 3579474.5 3339384 1294262.375 4350859.5 3768482.25 922109.4375 4393107 2392193.75 5587736 5163398 1840913 5770685.5 4603348.5 2305676.5 7452888.5 3074613.75 2799186 2026653.5 2636875.5 5691425 2377129 4196415 8189933 1932822.125 3283123 1369613.375 4795202 3027910.25 6646599 2162383 496345.4375 1098204.5 13107807 2386201 3406214.5 2140906.5 2255335.5 3543582 809215.375 2980092.25 1800276.5 3663648.75 2061681.625 6149437 1409119 3228026 2350129.5 1404394.25 889004.9375 3163982.75 2880285 5416450 1919083 3791755.5 2590243 10549828 3023060.5 3848766.75 2872620 2786219.75 3230126.5 5346725.5 1948779.5 2420273.5 2238372 4987877.5 2642349.5 6500735.5 7822939.5 6913012 1847248.25 1453632.5 1691909.375 4340271.5 4107274.75
2-oxindole-3-acetate 45774 169888 102693 305201 54799 39208 190130 49743 53930 30542 134381 168417 76649 117007 143398 61212.7422 41408.8398 40496.9688 64391.0469 69488.6406 33140.5039 245901.8906 104517.2266 150574.3438 256281.5313 59995.3359 144560.1406 39392.8398 173533.3594 217565.7969 50973.6602 72666.8438 206143.7813 94943.5 39077.1328 56392.5859 114624.4297 85117 34665 96654 647582 574221 33263 434787.9688 55903.9961 38646 250733.0156 143624 128111.0078 80404 133151 58286 71708 94903 60151.0039 817558 38393 84510 63526 122861.0078 113218 1130489 263066.6563 74274.0781 147312.7813 33674.9531 189076.3594 117961.6641 49583.5313 230256.2813 92725.3125 49965.6875 89809.9688 43159.75 312286.9688 121728.3281 127311.1875 406617.5 107322.8359 27311.7109 27774.2695 89907.3906 56733.1172 342824.2813 190993 110675.9922 154195.6406 36105.0352 587306.375 574018.9375 174841.1094 71658.7109 132719.1406 90348 191542 562719 846770.875 411377.375 60683.9688 1105826.75 100868.7813 227204.3594 59727.9258 82149.8594 165799 55918.0039 56469.8711 178522.9063 40634 444085.0313 86995 222924 75388 414359 593282.6875 64737.2578 662680.5625
leucylglycine 93231.8125 59699.4766 94447.7656 63232.9102 92365.3203 117753.5703 254609.9844 139653 355257.4688 77061.7188 140888.9375 197927.0469 165721.125 84015.5703 112458.4375 1247499.875 239068.3438 192409.1094 217671.6719 154404.3281 58148.3594 81398.9453 167568.3594 92777.6172 283038.5938 235158.6406 93189.9219 143701.7188 419191.3438 93658.3906 105295.1172 133507.5625 1749762.125 93749.8047 548805.375 214430.4063 20372.1133 132444.9219 76087.6328 81272.3047 118889.5391 58579.7031 321083.375 134252.1719 94045.9375 60792.5938 111789.0547 344217.75 111906.1719 224229.4063 122823.9844 455788.75 72555.4375 47042.2773 61969.4805 290457.625 36054.1016 100372.3203 46805.4492 284688.5 94158.9297 170356.875 66614.1094 356560.875 49105.2539 64900.5117 86021.5391 40987.4297 66681.6406 288960.3125 122985.7734 101243.3125 285550.7188 80966.8594 177202.4688 62550.793 106481.9766 1698457.25 154166.2344 242596.2031 113655.4063 142030.125 100930.1484 198415.4844 40315.1016 446410.8438 348225.7813 96936.3125 301884.2188 144775.8125 35141.9219 45602.6992 42331.2227 149316.8906 301945.875 175468.3125 129777.5391 69613.6875 101327.3359 335754.6875 197686.1563 131047.1016 619989.4375 152857.7813 134530.1875 227415.5313 208690.2188 120583.2031 360474.4688 139653 130310.8984 108909.6484 230678.1406 90238.5 67394.0859 581452.1875 302993.6563 212070.8906 152269.6406 359672.9375 229748.6094 142636.875 157191.2188 653113.25 330128.2188 278560.4375 120303.5391 88110.9375 65555.2188 170121.0156 348570.1875 107417.1094 85108.1328 541349.375 95001.3594 165721.125 81815.0547 114508.5078 355175.5625 119985.5078 494314.375 599131.5625 121669.9375 372871.0938 273937.5625 159076.7344 156933.3594 335298.9375 341856.7813 163870.4375
valylleucine 68359.3906 108958.9453 61678.2031 86257.5781 46550.1484 174679.1094 105575.1875 90745.125 53987.9219 59700.8633 91627.9688 105896.3906 106265.8594 61719.9805 66628.9844 94788 93909.7969 64372.043 59597.2969 41189.6406 180535.3594 95213.4453 87106.0703 60422.1133 83009.1094 95904.7891 142688.7813 53901.8008 139148.6406 172146.3594 62455.9805 70435.2266 54055.6328 79372.7422 73382.4453 112252.6641 66453.5313 175130.2656 165260.2656 67520.1797 92417.9766 733193.625 39633.1641 1196223.875 31594.7637 99311.75 57746.7305 41591.9414 329793.6563 39072.457 61667.9961 86334.6328 85521.4141 240503.2344 104201.2656 108374.0938 56423.8594 79839.1094 221230.1875 432113.2188 168727.2656 53098.8789 138553.2344 48542.0703 114376.0469 105607.5703 46950.832 32530.6504 99457.4297 331927.9688 47895.5625 67115.5234 211288.1406 78606.6172 220953.375 56118.6836 205897.1094 70498.1953 211288.1406 107187.3359 47734.9766 46919.6211 164088.7188 101691.9844 125766.3594 271502.75 111385.5703 54135.375 103027.7969 102132.0781 110407.3359 86751.5313 72604.5469 199276.0781 69674.0156 88485.7188 94788 42304.3398 125166.6484 143747.1719 59672.3711 647893.5 112952.6875 86537.7656 98222.8203 144309.2031 38383.6016 58795.6758 122438.5859 122935.875 115781.6719 76723.4063 101090.2891 190546.4063 184076.0938 152601.7813 91018.9844 146384.5469 120045.9844 62541.5508 1141306.75 188939.1719 163924.4063 112757.6719 77062.4766 112287.4219 48165.6328 43999.8516 159771.0938 87230.1563
carboxyethyl-GABA 83037.2813 68136.8203 141606.4219 97318.125 153698.2969 206243.9219 142322.5469 131437.75 79920.5703 354122.7188 52573.5742 128973.6719 165210.3125 119365.3594 150785.5781 179965.1875 194068.2656 207147.9688 153953.0781 203798.4688 98448.1641 128781.5156 161072.2031 74564.9844 367757.0938 118187.2734 244034.2031 128662.6328 183059.8906 146639.4844 117732.8281 144395.1719 220474.9375 127581.125 246493.4688 100005.4688 120923.8984 83829.6328 134082.4219 129984.3125 111528.0859 153568.625 147416.1406 162042.3594 172412.3438 210849.3125 362416.375 135090.4219 211175.0313 141928.0781 561894.5625 717681.0625 254846.7031 295752.5 245230.7813 447898.3438 158017 177537.5 134440.1875 856338.3125 268667.0625 166990.4375 571566.3125 143926.6094 1124122.625 399135.5938 122784.2656 116445.0156 235988.125 108784.4453 144344.7656 617297.875 197223.0781 174050.0313 105854.7969 353034.1563 625889.5625 498540.3125 389382.5313 588962.1875 301070.9063 341835.3125 60886.7813 458460.6563 150329.3281 135560.9219 142751.7031 77271.1094 853533.1875 590291.1875 300651.0313 466575.7813 1899782.75 633785.4375 307085.9063 118926.8828 231536.5469 123441.9609 210354.3906 101651.2188 115350.5391 559528.625 241233.7344 95957 143172.4063 107911.7266 144805.25 531282.6875 208162.0469 196033.7656 70384.2031 187916.9531 245291.7188 609941.1875 225099.1094 124217.3359 1336648.125 105004.1016 83467.2891 192087.5313 347094.4688 120918.6328 133427.7969 428266.0938 197475.3125 747630.9375 206970.0156 819827.1875 118959.1406 117141.3984 255843.9063 111936.5703 213638.3906 900376.625 215918.3438 232166.5625 382441.5313 119444.7578 101798.6953 91517.1406 224249.6406 377704.5 231287.7813 179788.6406 508980.125 190659.4063 418068.875 804604.8125 379426.4688 179683.9531 277663.4063 349499.5625 195836.375 141566.0938 150149.0938 180119.4375 135780.9844 646558.75 170622.6563 334522.5 132977.5156 226246.6719 162196.0469 193705.6719 892573.375 204002.8281 180744.2813 236709.7969 121686.8516 62659.4883 208340 878306.5625 100817.4297 1061959 203493.8125 185655.0625 236874.625 191346.875 880741.3125 140827.6406 380868.8125 216505.3125 70608.7344 255317.0625 269354.375 2720658.5 116341.6953 565319.875 1150450 68471.3438 813167.75 78703.8984 424161.4375 163558.2344 150270.5 128348.4219 102157.0938 94375.9766 607170.3125 438836.1875 622374.6875 155488.6875 216136 264424.6875 356870.5313 149219.0781 139657.0313 1940176.375 132219.0156 186011.7344 244882.9219 132233.5 990467 372511.9375 284473.2188 103334.0078 188683 284441.9375 339188.4063 223402.7813 217196.4375 65200.082 218912.5625 358939.9063 243130.8906 719438.5625 1264811.25 123914.4766 220283.3594 457775.5313 457446.4688 334574.5625 205313.1563 170527.3281 355060.8125 275466.7813 291633.5625 632712.125 132934.3125 573535.3125 1256966.75 843566.9375 153363.5469 974148.625 469832.0313 826178.125 140692.875 241572.6719 438884.625 130788.3516 121768.1563 778638.125 235519.2031 176575.9063 140831.0469 317193.6563 926336.5625 182221.2031 851719.9375 168647.2188 644603.4375 94843.375 120229.4688 1142855 318203.5 207655 132724.375 223829.4063 213425.4063 109673.2422 259493 1245649 217926.9375 458596.0938 688747.8125 267523.4688 289368.4063 310992.375 161083.7656 293501.7188 722130.625 139756.1563 280229.625 191489.2031 142663.2031 2390356.5 702495.375
trimethylamine N-oxide 38830616 33805740 21806674 22161574 22305600 44726216 16301023 19440862 14457140 94904440 13891128 55585536 11175786 6842127 6093081 16762275 10973699 10519450 13837075 24905500 26329494 70577216 18516492 6470783 23108428 19957478 21625528 12788075 42656168 21680978 15546604 50129200 37549020 19832616 22406740 11252309 130564456 35283456 109859552 36867344 15799872 20672620 10560386 8198743 32790040 9618910 23628296 10755423 34723160 26466630 206737584 59287556 19487060 37787804 100950696 133806704 5550290 70505648 6852549 36117896 3667279.5 30137416 71823328 26350204 142854896 929713.8125 108563264 7720947 120023192 23972968 16622054 15189384 7695457.5 4779123 179075408 16887880 5117711.5 31512126 29938452 99786048 97367256 34728860 16464684 130677184 18680122 9766860 5467804 82311680 2808101.5 13839149 13021697 8985656 2289425 49590384 5548220.5 46154932 233066448 45153464 70234520 16552655 6201638 12895724 5587421 20821620 4123647 49957716 44266612 5697640 13650324 759132.625 33515556 30723738 4195169.5 48444084 13200500 50641100 43162628 192040944 17676636 28677038 31694544 178474016 4114444.75 44529732 28160846 28536912 22674562 55264136 72547784 261119296 3591830.5 259736464 31910194 107495912 8890131 6598496.5 13573357 11508092 6407082 185735440 13568665 7280201 16471334 89641344 33374084 5380962 2116336 11806008 28291618 26469224 23378804 29504126 4428914 30366002 150126176 60522688 2101454.25 69806792 30392152 21411534 743808.8125 7815135 39194228 11957960 189232352 36113456 36658892 22383790 3856713.5 6915021 16250677 15024858 286463776 8015567 57598876 25157416 28262000 13991596 2083407 15012122 6935184.5 69223408 26210052 190425328 70420472 16719387 65664972 13565549 46932024 90751704 27254140 52418812 11539410 25389894 39791400 201486032 42072184 255233088 188475040 13433013 360810176 19909884 4333785.5 53349808 1122505.625 10505998 9620028 3430840.5 100121000 3105752 177880960 25315982 1968024.875 29300804 30692608 20691602 21756588 105221064 4720546 66288180 49804616 13567379 143077120 120901384 1514666.25 9169293 22598470 118005104 58287204 22915922 26338342 103176792 11407888 114570680 70488144 72012376 20704010 182363184 186458976 22167928 78302640 81944936 34442772 37415524 26338342 22515056 151416432 75072560 84309544 182648336 7577750.5 41512164 304793024 293687136 20896344 66151480 110169528 364021056 13387533 32529018 249579040 7564853 7409720.5 102101008 73815664 8616911 25462978 81384624 93848672 29056332 74854784 12183431 121140696 2514685.75 12831185 10684678 56743196 11990822 7751560 26144888 17343004 6618143.5 51992632 95176224 169458592 104036600 145897904 2479610.75 88641008 28160642 4310438 175261856 7069893.5 117118608 1420015.25 28079838 34615308 6179146.5 92362064 111112240
N6-methyllysine 57875820 47250248 60605972 27923730 31066556 27631530 28525188 30807608 29550938 64136512 19866378 47357768 16316415 28226572 27633736 21051732 33394920 64283948 226146512 47527112 21423860 56199160 49782916 43029304 28502444 19037794 64851336 115442832 211586624 39664992 42097832 30778362 54094872 57840504 37790200 38321100 41001220 219090880 56563520 37896628 46682040 57968312 73966328 28629070 36684924 38856400 53863876 36896428 25896012 152484192 51866772 35828712 31267774 56008072 50785436 33181150 62588664 112602656 40146156 67730120 38495368 30026196 38972624 48386096 30361148 54217560 86039448 20878382 46919372 31793430 39265816 45697804 183950064 41873596 33475364 59252496 143901312 46014808 23152218 51094712 92911856 133304712 32933864 33319348 50268168 65691016 28648524 60222316 119060792 32273682 45614852 34470556 99161144 52955268 48052340 106850496 68519176 38750688 50963180 34358980 55546436 42006352 54377276 57119200 67475808 110189824 50828824 32624568 63276884 59601128 330904384 183304720 70601192 49267580 47247220 44413888 58996860 43489720 57520988 79253264 87731424 37084280 37777604 270189888 153844464 47274716 41127040 25008190 47777272 30322954 65131724 39229124 32223176 61507140 58655784 28511132 81854592 64632244 46636808 68086376 42036820 38115744 77582520 119101952 35233152 50266512 32708216 38939248 67312240 57378524 30818618 42404180 35059416 101750368 46758420 48044288 131305024 105593640 122240872 140906912 16740274 32987260 34784076 63218972 42076448 60502528 262789104 80707560 33557900 39961020 36619924 54348764 34147056 50209228 28641698 36079248 45555496 42406852 100618176 40102676 58867160 62048920 49411356 108268544 131622920 202350400 40247540 50108440 421717632 353661856 59232992 319572480 28071872 76803616 45473196 30043762 125219952 27159446 48951908 80451696 56000932 32204856 51835956 94417112 36206168 65315620 57911588 136718288 43116132 131929008 28588756 100133504 36624768 45140216 48835812 31823574 33849240 23748288 175885840 32781110 54364040 53159208 68366968 23105872 60869888 60000784 274243488 79108672 37278388 33966768 70665672 40434240 43507200 121134992 339499872 16759673 82275712 71033264 36199004 50007648 73738528 545434944 51836580 327772288 26771006 63028288 22348104 109954032 50108440 60742076 25285706 54840628 62121648 109115168 59159592 113811400 47731804 17222486 47477984 17040086 38795080 64690664 25753212 194949952 43835144 82374904 175389184 176738304 56154880 30489424 61024168 193805840 38368332 33183466 38463712 56971724 53330044 50548128 81325304 43473948 33128032 59203984 30281982 68444792 71260176 62183956 47396564 27821378 85356744 313266528 78298272 32112486 85752776 41718580 55426208 29863452 43622632 127501264 91949792 465017056
cis-urocanate 2053229.5 643221.125 1722000 909624.9375 1077091.875 937373.625 826655.3125 1037734.813 915309.3125 1607846.5 1530966.625 989692 1007756.313 633115.75 620970 1189143.875 321594.5625 530926.625 4265859 1655552.375 567481.8125 577599.1875 566151 735707.5625 1727168.875 471854.1875 804739.5625 752587.3125 1079096.625 888952.625 905073.375 480193.125 3891568.75 790738.75 1411124.625 1288606.75 1247780.75 982277.375 501413.9063 354613.6563 482242.1563 1112405 494577.4375 1347978 8262289 2936034.25 390188.5625 238590.8438 1818354.875 4663689.5 8345692.5 1052133.25 3147004.5 934680.6875 6406179 508163.8125 698015.5 819770.125 6729201 2119515.25 331496.75 1637828.5 355719.5313 5400826.5 536889.1875 2127497.75 825116.6875 1112405 1141841.5 1354881.75 599724 479427.5 568083.1875 5167955 1075597.125 728396.75 411445.75 3313915.75 3039867.25 1624563.375 1484377.375 2978454.5 2382028.75 1468535.5 678370.4375 294789.5938 2130477.25 855465.8125 875899.0625 1445137.5 379180.75 2057573.75 711484.8125 629155 1727060.125 13829514 2332300 1951582.25 451411.5 1079602.75 1144062.25 1466489.75 599053 488374.0625 2162877.75 956475.0625 547978.5625 864244 726886.4375 1089802.375 1678946.75 621758.1875 2307671.5 594727.0625 2112954 1827718.625 3181687 810850.125 412862.6563 5870784.5 2836795.75 663187.5625 1093312.75 1990366.375 1156163 654849.6875 3318814.75 2009214.25 3599914.5 1587145 6228026 2854049.5 5014655.5 484416.8125 344293.9063 2271807.75 814438.1875 643315.0625 5303357.5 1484951 610346.9375 1021510.563 1379254.375 616774.0625 667577.8125 355106.7188 1520719.5 1666415.875 468713.5313 725415.6875 2103547.25 509385 32436682 2898367.5 2439537.25 391001.125 379120.25 694308.3125 1632143 335822.875 1029217.625 835511.6875 586540.3125 5237346.5 899324.25 648336.5 1772041.5 851890.5 551913.375 467509.6563 1157240.25 5500449.5 911718.625 499220.25 928467.5625 814450.625 592713.1875 362638.0313 886468.75 1581802.75 2361171.5 455112.7813 3329833.25 828318.125 855681.625 1552577.25 448458.2188 694464.0625 2752328.5 1379542.25 662843.1875 649413.1875 1851730.5 1431540 2135930.75 1507406.625 2617173.25 5346355.5 1004820.25 5527883 755359.0625 759040.5625 592186 505709.6563 568605.0625 315692.375 4048733.5 2323758.5 12637328 2190253 391159.4063 1615186 1151567.25 1443987.5 1057800 626486.375 6559286.5 1815869.75 1736518.875 2119481 440705.6563 10376575 3807441.5 2231885.25 418435.3125 464265.6875 978010.4375 2466847.5 716361.75 1309587.75 7854867.5 1944721.25 5194987 2983835.5 1439966.25 429350.7188 4324141 10938869 257534.6563 2316366.25 606206.6875 1302728.5 1385406.875 517086.75 623074.0625 3588745 2726216.75 4605485 2988674.5 438224.1563 3643063.25 6420830 4530093 1775580.875 4327578.5 687772.6875 7224409 1112405 1386379.5 1689220.375 357310.875 459117.125 6224495 2110206 721033.6875 482228.4688 877744.375 1537245 777948.0625 6480875 625626.5 4272586 461582.8125 499576.2188 654737.5625 1752616.625 2076190 719470.3125 700249.875 768418.375 1077386.625 2152187.5 7459847 1906085 5368658.5 2719960.25 458413.9063 4046180 1365263.625 377882.7813 4732989.5 1242331.875 4036182 296124.8125 1163424.375 1253115 285759.375 7487952.5 5236020.5
imidazole propionate 16123151 1453049.875 1292119.25 728679.1875 2479878.75 2508533.5 5521721 1878845.625 1179298.5 8165462.5 2556832.75 803572.125 3646807.25 719050.0625 1208045.375 2410911.5 1589632.5 2880704.5 2152529 4235287 1346447 3022398.25 1697192.625 1111287.75 3656962 616950.125 1472955.25 550996.4375 4378824.5 1889618.75 1770638.5 3095299 1850030.5 1037602.313 1414690.5 1193889.875 3091300.5 2963808.5 8140670.5 2732263.25 4109932.5 9832614 1131676.625 1360095.375 2925048 2004317.25 1209772.375 562545.1875 1918736.5 1987816.375 82014312 6705342.5 7938362 30506024 29244586 3659940.5 7435449.5 1045956 3189003.25 21553070 29845934 3508745.5 15673661 1861225 59808184 728260.875 7617630.5 9494650 7341198.5 934247.0625 3836837.25 397354.875 4678874 522877.8438 22587166 7343645.5 1711330 3001631.25 6545258 724363.0625 7956204 5975060 10721138 45139944 1500773.75 3727060.75 2587071.25 9841773 16647128 1076700.75 1655520.75 562813 25211130 6033946.5 2648429.5 1786775.875 82309552 33334818 16798414 990593.9375 2683841.5 3780651.5 1391385.75 5061581.5 3378276 3158641.75 1355576.75 5501966 2851048.75 506172.9688 602618.5625 2160734.5 9146184 4003773.5 1776752.25 1620299.625 1578366.75 10124500 2398883 11092606 7150836 18661052 3305973 59904212 2209940.75 5621358 684375.9375 23395512 18721832 55440780 3826699.5 14406250 8748036 48243416 369759.25 899189 4880287 2029226.625 968031.5 12691629 3188203.75 643543.375 12736905 1809484.125 2564154.5 808301.875 4951769 2631597.25 12108847 2778194.5 18764490 11527329 1070694 118379928 11109374 17720480 592982.375 3989203.5 2678339.25 1663742 606618.5 424383.2813 2144067.5 6495729.5 110957664 2309535.25 5707504 4376550 6416534 6015903.5 3410245.25 1888977.25 75267800 1889127.75 2287495.75 3189442.5 1863249.875 2773506.25 2562769.75 3842532.25 2013150.625 16687434 1345574 20713956 6109616 691822.625 34246364 13135395 5358889 13767559 33296866 11251734 2075241.125 11569869 9893436 44828552 2954141 24772864 28058168 1691687.875 5043779 958984.75 1759341 56301796 1024236.875 2307118 1400067.125 3387254.25 17203366 28799342 8254329.5 1697195.875 864803.4375 3325889.25 12114109 3047524.75 3997886 41932256 3897363.25 4822386 4414099.5 2254673.5 81429088 19212964 14704479 842334.875 687651.8125 3288442.5 5173122.5 2799231 18335340 27057126 21746492 24911994 53298304 13988085 14399336 14033054 21285818 1810886.25 2523497.5 8817567 4729418 3772629.75 3732200 572314.875 11615199 9308758 3732200 9657353 867510.1875 3807438 7600687.5 5722012.5 1563534.25 11771974 5582454 13194142 728863.5 6319858.5 15066139 4860822.5 2089283.5 18906110 2484192.25 6191405.5 6267509.5 4897947.5 3308901.5 1395890.125 8245023 1769819.875 12545730 3384920 1677210.75 562294.5625 4231133 847024.5 3783508.25 7539584 974023.6875 807331.875 3317371.75 3589413.25 8317914.5 8986312 12937098 1000793.125 26930592 10272269 8977050 11840162 8523124 5441882.5 1401113.375 16823688 4100549.75 2064500.25 7375087.5 5458054
alliin 1707966.25 351817.0625 3489084.25 1337787.125 6016805.5 361681.5625 12428001 3732165 6051035.5 6477853 3418461.25 500794.2188 1446730.125 3057448.25 3216597.75 1856463.125 883704.75 6343361 2728463.5 1452960.125 2454427.25 1458587.5 3205076 451309.4063 4167691.75 1777012.875 1813647 1086584.75 25093752 1900708.875 6836253.5 1627391.75 1260550.5 1855567.125 5223038 2724181.25 6270685 143628.1563 3463873.5 1840317.625 558947.9375 921807.1875 598090.6875 520601.125 6683689 638011.5 782592.625 15210238 253209.5 1496178.875 3362047 1743405.75 519124.125 213160.1094 462918.8438 1184017.625 1526247 637618 91557.3047 3267246 398078.7188 351992.1563 572802.3125 243453.2344 612100.3125 550001.9375 761570.8125 205655.0938 102168.4609 952606.625 557829.9375 1033435.125 1209692.375 179893.5938 784713 1107932.625 1934280.625 4006071 239205.5313 306439.4063 170032.0938 2187714 238990.9531 355763.9063 2277556.75 1253072.75 603808.9375 788704.5 1246240.875 442066.875 3080912.25 229837.3906 829343.1875 2127701.25 657792.4375 777075.4375 567085.875 736756.875 482448.25 5394954.5 460133.25 1004958.063 1097963.75 634549 315916.375 633900.75 436510.5313 997301.625 1176723 2357717.75 3304858.5 3551105.5 626010.875 733532.625 1575685.25 376806.0938 11403582 3982126 2256320.25 288632.625 1274601.625 1977522.375 5438135.5 1255482.25 501967.375 843838.875 1169428.375 9028228 684674.4375 1577357.375 306285.0938 5574330.5 5877208.5 693569 3154572 642251.3125 1550518.875 11104524 971843.25 1656798.25 1459855.125 3063903.25 691700.875 773726.9375 247946.6719
prolylglycine 1918552.125 970941.5 1747431.125 2073962 1796250.25 3015617.5 2618012.5 1168158.75 2125630.75 2690434.5 2538207.25 1324518.375 5479724 1318326.75 2369442.5 1527390.125 1072907.875 3344548.75 1122493.125 3251642.75 986269.625 2166349 1770896.25 4062958.75 1697431.125 1665069.125 1552843.5 763129.5 1473150.625 913988.3125 1567827.25 1395208.5 1625374.25 3040919.5 3470398.75 662274.375 3506328 7238914.5 1787144.625 622404.375 1072918.625 976136.75 437790.4375 2444079.75 1980219.375 1664459 2068459.875 913760.625 390945.5 1794809.125 1120795.125 1274613 2016909.25 1450712.625 2296951 713357.75 772024 2684043.5 1516222.5 802113.375 1310580.375 719131.5625 2662260 933458.25 1864259.75 1206917.875 637714.375 558266.5625 3379632.5 831056.8125 968570.9375 730699.875 1946338.875 1126806.5 383499.9063 1567170.5 1161584 1713134.375 2411685.25 2945327.5 2381941.75 997099 1083730.625 213088.0625 2003902.125 1002622.063 737056.125 554691.25 473369.2188 2394666 1338834.5 1070016.75 1517900.375 2051995.375 1038810.438 1726131.5 867898.75 880373.0625 566976.875 1078814.875 1102652.125 647485.5 1014340.938 891871 704176.6875 636220.0625 874561.1875 505614.875 1589829.5 1101519.375 1386890.75 973058.9375 970053.6875 602659.625 1077731.75 1227900.625 2206753.25 2735273 1791429.625 1984732.25 1060263.125 761132.625 705560.125 1487859.125 692559.5625 1277894.625 2391411.75 1366239.5 1203030.125 910997.5 975334.1875 1577219.25 1334648.375 881380.0625 583627 1139480.375 1200062.75 975432 697305.4375 1711154.125 636249.125 1678877.5 378690.8438 2000776.125 894142.75 1000661.5 1851841.375 443649.9375 615792.25 659878.75 1182607.875 540959.875 3493004.75 844487.6875 385267.1875 1108199.875 1430670.25 1530945 1972371.25 1184679.25 1171420.5 1334665.75 799546.4375 967872.625 1619386.5 1133466.5 992943.8125 1805741.625 2035938.375 1274613 1084293.125 1137567.375 1417997.875 721606.9375 2438591.5 428684.6875 1239372.75 1679788.125 1902962.5 2660927 1742069.375 1999495.375 612035.5 723381.375 1267240.5 346675.3438 506777.4688 1094172 1481547.125 549499.3125 1006707.5 427194.875 1274613 1861259.875 687251.4375 1161257.5 1752023.25 1102193.5 1215306.25 1449795.625 274705.0938 2174060.5 2439230 742771.1875 777555.375 1889166.125 1686852.75 2267687.5 2413108.5 2868841.75 965051.375 2069477 3354005.5 1526621.5 1600129.75 2621947.25 2882212 1165031.625 1449009.875 2292870.75 748349.875 1987894.375 1217543.75 517180.5625 1050046.625 4263949.5 2166331.75 1976646.5 690916.3125 2215818.25 4444965.5 2053430.375 738419.625 4222876.5 2792559.25 4139094.25 804603.75 958375.4375 2308044 804550.125 820028.0625 4094394.5 963915 787742.625 818729.75 1033538.875 816445.25 862295.5625 1122084.875 641159.1875 3633299 2071085.125 1584047 1512221.875 1070612.625 2028782 1104872.125 2962501.5 945494.0625 1395078.875 3771655.75 210988.8906 1397811 1733408.875 1079434.5 2080214 1659626.25 2498723.5 678402.75 1313945.375 473175.7813 4447385 3025231.75
lanthionine 459020.9688 471974.9375 533804 231101.4375 212377.2656 536509.8125 536347.5625 178906.5469 549546.375 882821.4375 507162.4688 291628.5313 890946.6875 175896.6094 413008.2188 491910.6875 346364.0938 259323.7031 261077.4063 413284.125 301114 781268.6875 927285.4375 412821.4688 2410098.5 445666.6563 416858.1563 191764.125 943314.625 359648.75 344575.75 417560.8438 588835.25 787877.8125 753169.875 206333.1563 367040.7188 803873.5625 209937.8906 348751.0313 275561.9688 730089.5625 130392.7578 6730035 731185 326561.625 449790.5625 164535.3906 1049618 254805.0156 4765745.5 1760116.625 530999.0625 1230493.25 2649771 2463945 350247.4688 133702.1406 438219.5938 6420492.5 1030019.688 267740.4375 3255961.25 272821.7813 3932229.75 84499.7031 2156583.75 387595.7188 1177330.625 172472.7969 1648650.75 369300.9688 652133.875 184156.9531 4227200.5 991011 269881.8125 397881.7813 912753.625 2018536.75 2512699.5 2048916.875 5639306 1311739.125 111014.9297 806188.5 278830.9688 2573819.25 281226.875 232757.9688 386335.5938 187923.7344 2714337 2475028.5 3348562 1630641.75 4622459 2168313.5 2892715 287949.1875 391558.8125 735537.625 1361901.5 254269.5938 217219.5938 1630299.75 682910.4375 117828.5703 274698.8438 150962.1563 291205.9063 9317376 728391.75 561348.0625 283021.375 543536.25 696204.4375 3562601.5 470855.7188 733978.25 1992065.25 7612612 295840.3125 3169886.5 1593946.375 1769068.5 504158.3438 969351.6875 6305443.5 5364068.5 726817.75 6547338.5 401580.3438 2876554.25 288024.4063 173768.8125 857891.875 322648.1563 210551.375 5172989 733788.4375 288720 1131290.5 741415.6875 85703.6094 148872.2656 317173.625 2044827.125 499607 711419.75 1742086.75 1807974.875 4306213.5 626602.375 81287.6719 644259.0625 996101 133065.1406 75013.0938 200784.5938 647893.1875 360186.1563 4885632 528117.75 1234461.875 288722.0313 615684.6875 629505.4375 1357802.125 480578.4375 4145457.5 244569.7813 385500.4688 703285.5625 918466.8125 728983.125 560122.0625 516328.7188 5523230 576569 4504243 1208424.875 625795.25 1875478.375 578287.125 2122567 1791639.5 1048649.125 2097766.75 1462332.5 268099.4375 5650568 110917.5313 2684855.75 3705534 6299287 169450.2188 906622.3125 733386.875 141350.4844 376855.7188 570895.5625 2186042 1002958.5 936313 156162.8594 72326.1953 1097024.75 1147845.75 603565.5 233961.3906 3936460.75 1153748.375 961448 1011516.75 7894017.5 1310865.375 568822.125 904593.4375 311784.8125 1692232.75 909131.625 1621748.875 636579.9375 902846.1875 440430.4063 3989953.75 2896010.5 858338.0625 842042.25 4687406 5605869.5 104260.6719 971627.375 2323906.25 860402.5625 1616758.75 713989.625 152664.5938 1528998.375 1766042.25 1579370.875 4835210.5 206850.9531 1155647.625 19925468 3242742 648163.875 3432760 1355817.75 10525848 461915.9063 2216083.75 397378.9688 2827459.25 1501200.875 488375.125 418867.7813 1193879.5 1268472.125 539775.3125 2280025.75 285349.5 4227097 50146.9141 261050.6719 860677.8125 311124.5625 633387.375 717611.1875 240265.3125 1728410.125 8889131 1236252.75 1314192.375 3796379.75 289095.625 1566753 1267675.375 281948.75 2969949.25 883510.25 3253250.25 1569483.125 744570.1875 578687.1875 401082.4688 6533475 2169485.25
(R)-3-hydroxybutyrylcarnitine 1394428.5 1430536.625 502858.6563 1611798 359731.2188 5132180 334906.4375 1285529.25 3200522.5 922490.1875 3175271.75 800856.5625 462370.7188 717467.3125 2331216.25 554380.4375 2539778.25 805501.1875 433789.9688 4514662 2876086.75 1663049.375 2004605 288107.5625 3141889 1814041.5 907645.3125 916809.6875 403351.1563 338904.8438 1380433.875 603440.5625 369988.4688 988124.625 1359367 704400.25 295254.75 889376.4375 124347.0703 128090.7031 1887245.375 2967327.75 198967.625 1373821.625 316473.4688 45075900 18621838 1002001.625 58972228 26378344 59680452 12982385 1925272 3158029 24018536 28245464 136738416 7265140.5 8109894.5 13549094 5358812 865206.75 25649270 2845735.25 11242745 3084396.5 3069978 52271788 116145832 31790996 2157790.25 13633729 62335136 15968219 16644583 209707216 41299876 38106016 4188240 65585596 3427813.75 13195431 51517080 8684228 7596114.5 3004758.25 52935428 36703556 10788444 27963840 5718745.5 39952164 21865232 1956514.625 2459534.75 10408946 58351176 21765838 1575517.125 6861918 8655432 12774160 4512996.5 5074670 13817237 27506474 14267048 16129863 3873914.75 22785722 30170138 70160856 107358896 10079762 6517581 22868922 460461.0938 17564242 10875071 15440181 81021984 7916185 6985786.5 31769060 10406385 875243.5625 7645397 29658096 33888112 20475718 60512280 9902348 997303.875 48012588 1218232.625 38621072 28777236 2746227.25 1788430.5 586792.3125 23707708 1710149.25 6408309.5 2385909.5 5242076 18294894 22203786 13495274 41410176 16602037 13983972 7624904 4901177.5 1069774.125 6448936 12638459 1406153.625 22885158 14379292 3194095.75 21747624 23187590 7882618 1914159.125 25081464 2112248.5 115071088 71450832 543633.1875 2564602.25 24765286 5558287 10956037 3789421.75 8197877.5 2268863.75 4762562.5 144365040 77827064 3620279.25 2749399.25 8304581 11006281 7287098.5 59699164 9904086 43272716 6588681.5 4921644 56332472 1890326.125 15125586 1491254.25 9589181 27387960 1039658.125 30085968 12122523 137424 1073151 8522246 4362054.5 7634382 28497224 17310892 648858.1875 85573360 18152688 14125262 3621803.5 2609082.75 18376420 7793053 7557847.5 329567.5938 9790809 72797656 8021259.5 37263768 5222487 13353830 12020554 2760603.25 4097646 4225302 48534224 7596114.5 28325270 14811327 1897131.625 9974879 41558908 27459772 1685160 2962930.5 8575495 18487260 3374874.5 1750038.5 6135406 17945876 8448588 2109801 2700952.5 338492.5625 4240823.5 7083799 1230589.625 13655935 158560240 10596761 817240.4375 720541.25 8003146.5 49892248 4103980.25 2379704.5 199365472 5255022 27049174 11438160 19024680 13779882 7283052 16654140 18622742 79799416 31200240 4979418.5 10697246 3826444.75 11613692 920529.6875 3348234.25 1745689.875 9198129 5567902.5 4014921.5 9507390 7084024.5 4356345.5 2071558.5 29179092 4741042 3748085.75 779505.75 4043630.75 5308031.5 2638577.25 20178046 8087063.5 10236091 13192896 8317750
N-acetylcarnosine 2044469 874706.125 2510127.25 693485.25 934589.375 1594754.125 701047.875 2039798.125 3611840.5 1530877.5 3919560.75 867342.5 6178144.5 868310.1875 3450694 2787232.75 1673356.375 814770.3125 1789260.125 2851095.5 1361185.625 1044361.063 1587916 3718793 1240521 1339324.25 1280213.625 2798907.25 2855553.5 1959189.125 3363036.75 903971.5 1616339.125 5312066.5 1263541.5 720849.875 1567594.625 1674085.625 1418529.875 2043949.125 881651.4375 2015306.75 2582316.25 3066401.5 2704445.75 1186923.875 1237956.625 1514314.875 9373215 3476697.5 3053599.75 121868.7813 4144701 2014561.5 1262308.75 1166613.125 8151693.5 4612058 2129899.5 13110407 1290082.75 6618794 578008.25 4656630 448054 475000.7188 2883125.75 7541090.5 1146560.375 2162836 342644.7813 8559306 4715525.5 1481088.5 1119467.375 2125251.5 5821689 9238876 5572161 4055458 3764489.25 1517498.75 827600.6875 4349963.5 313865.375 196476.75 1098164.125 499250.6563 6598308.5 5103336 3170047.75 1188932.375 17491104 11618627 7440876 993451.375 997137.3125 2616943 2961019.25 880471.375 4378913 1362134.375 1224811.5 1387691.625 769766.4375 1897773.125 3102591.25 1366804.375 187709.6563 814162.6875 490889.7188 7702883 2488130 1303492.75 7892452 3846017.75 724052.9375 6933974.5 1696054.875 486341.3125 1186905.625 1522666.25 3963024.75 14830273 770983.25 10384664 748144.625 4694684.5 2203568.5 817444.3125 3614323.25 1797739 613568.625 4714732.5 2154121.75 1202305.75 12258668 3479834 375594.1875 867568.3125 1145032 4701307.5 1917707.25 2569870.5 2959884.5 331517.4688 4137413.75 1223486.875 520439.7188 860699.1875 4300685 2035075.25 1576310.625 2020073.875 2347704 1405429.125 11436199 2044988.875 4940244.5 1255780 1498292.75 2915251.25 1875960 991794.5625 8429493 1174521.625 1955031.125 2222446.25 2772907 1323526.125 1138251 2835830 502662 5401496 979135.8125 4537423.5 7547631 969656.75 5287227 1203130.5 7069060 3047295.5 3828598.5 12782391 1651873.875 6511021.5 1292830 3333463.25 1391501.75 10544888 12124375 2478170 10768080 93261.5469 1046543.938 6127910 586058.5625 1411541.375 1015254.375 761931.6875 1644755.125 2227784.75 2447550 623533.625 812842.875 1830158.5 4211264 1327518.875 659212.875 6982760 3699425.25 3610641.5 2122934 1433528.25 24280188 12488025 1456858.75 2639667.75 1136219.625 6327400.5 2337000 1057421.75 1578489.5 6697672.5 944611.0625 11162434 9299986 2513677.5 2781937.25 23464234 6113124 1828901.5 3048347.75 2653609.25 2735073.75 1792044 2290702.25 5602340 6827656.5 5155250 13163486 789011.625 8447047 27517672 5110437.5 16039205 195008.6094 14359507 353955.3438 596375.75 17859684 1336134.125 1840472.125 8645078 4614232.5 266453.25 1675094.5 2539411.25 3778960 734960.875 1920894.5 2294671.25 5096238 183464.9063 5309787.5 1164591.125 2007744.75 1220169.375 1606930.125 356574.5 1059922.875 4349282.5 2445425 6174847.5 8229164.5 1329227.5 2904463.5 4462885 2561545.75 2149528 1556672.375 17345904 969056.6875 1671388.625 2053862.75 49376680 2623985.25
histidine betaine (hercynine)* 1283776.375 485184.1875 67776.7031 543880.125 412275.7188 603533.625 840661.5625 923540.75 78180.3438 1952801.75 2146656.25 726924.625 634986.4375 803625.75 949074.6875 1293360.375 446216.8438 2619559.25 1401242.125 3280085.5 4770341.5 1895284.375 2034390.625 963864.5 558104.3125 1753114.5 1736878 137043.6719 1318618.75 5307852 1639555.75 778587.0625 2619232.5 3146272.5 237695.9375 1387886.75 424961.0938 2926243.5 515619.2813 745905.6875 2901535.5 314555.3438 2710167.25 1640830 282245.3438 861930.375 494409 455837.6563 2193763.5 1156662.5 998083.5 2909910.5 287755.4063 478163.9688 613678.5625 510458.8438 237301.8438 3329506.5 1257230.375 544716.625 523324.4688 2608416 252777.5313 434956.125 8098654 149236.6563 1904339.75 2631326.75 835370.1875 373341.25 694204.3125 2629738 577911.5 3932256.75 228947.0469 2988154.25 406935.3125 1258088.625 199894.9063 1778356.625 523831.625 2439683.75 7408794.5 1185942.25 880398.5 1926983.375 1415056.625 492556.6563 1037054.375 657077.5625 979423.0625 1663130 885972.5625 778555.625 3394339.25 859445.4375 682811 21412810 1215753.125 653561.125 887684.9375 1540214 272696.0313 1475011.5 374689.2813 2254476 3100703.5 2154110 3098774.5 446516 170400.9531 3038069.25 1574770.25 1749094.125 688364.625 753987.75 857904.3125 943567.25 1184134.75 906865.8125 538843.5 2372655.5 1208128 2946200 560819.25 441085.6875 2996762.25 2791964.25 166520.9375 801131.125 2540885.25 437605.7188 322611.3438 650548.625 1319030 615461.5625 444765.8125 1121624.25 2939360.25 1690437.625 665611.0625 122846.9375 1269223.5 105601.4922 2242666.75 5185971 328906.4688 587224.0625 918033.3125 833588.125 271501.875 1764780.75 1273180.75 452806.9375 1305864.875 1372308.75 788605.75 8737998 2100921.5 85775.2031 830412.1875 1056294.125
dimethyl sulfone 188182.2969 273214.1875 815064.9375 275990.125 503792.4688 354582.0313 173923.6406 1102554.375 268882.3438 488978.6563 279686.4688 98153.7188 263771.0938 236261.375 270020.1563 200799.8438 431426.125 170117.6406 1407507.375 168145.0469 507458.2188 382790.4688 586807.5625 222582.2031 859776.9375 217551.875 163932.8594 885109.875 171094.0938 121876.4766 349538.5938 148007.4531 63001.5898 255788.0469 165855.3438 602839.25 1551361.75 499571.2813 8148880 950610.125 3309247.75 332137.5625 533843.125 116468.0625 168886.8281 243479.7969 112521.0391 139538.2344 2823946.75 145188.0313 2333089 232333.9531 685778.5625 344384 221971.4063 102001.8438 384550.4375 656362.4375 205603.6563 773613.8125 460989.1563 270358.9375 329329.2813 406605.2188 337209.6563 1223828.25 298385.6563 521302.9375 218064.5469 160048.8438 357343.2813 104086.4922 295471.625 686576.625 527698.875 122054.2188 318871.7813 141956.7813 204503.0625 939655.25 366002.0625 228143.0938 110966.1172 596636.125 1022438.938 145032.3438 308441.6875 86593.6641 244856.5156 656662.0625 297903.9063 8211996.5 372498.8438 283330.9375 118751.4844 149790.1094 395533.75 1908104.75 200058.625 427522.1875 176339.3125 122849.0313 73030.6016 129908.8828 238598.6563 85761.4609 175759.4219 123981.4063 865860.5 61205.0313 426315.4688 677544.625 546811.5 86374.7891 195982.0313 176933.375 831835.5625 291403.625 139393.6719 787148.75 541954.5625 305100.625 209810.7813 552483.5625 1793510 1456368.5 1161960.875 210670.4531 1401457.875 905132.8125 735680 547615.4375 148000.5313 403198.5625 344384 2461217.25 846995.625 273000.7813 193808.5156 203292.2813 863360.5625 332017.0938 551138.1875 298426.75 1052496.5 982093.3125 831999.6875 308079.4063 273984.125 769634 126694.2422 275090.125 1775393 205820.6094 344384 789623.375 224119.0313 224471.8438 1147626.5 1484077.25 76224.2734 132146.2656 2886664.75 561694.625 1197900 1756816.875 1160436.25 585877 123941.8594 172640.9375 1418017.625 884563.3125 499202.125 1654580.625 249410.6094 348454.2813 279598.3438 1482725.625 410162.25 161915.1406 503322.5 118151.2578 1382335.875 279534.6875 598309.5625 1294464.375 656595.5 900215.3125 433420.6875 491851.5313 1483383 175573.5625 136245.9375 475916.9063 371397.7813 717318.6875 941230.875
2-piperidinone 25046284 15788969 17959228 6315953.5 92156512 18287118 50987028 67261872 86012816 42107932 29928440 68588528 12180368 176418016 24729390 41448264 25101696 31825210 53107168 9031181 12305121 14718251 87567544 35524076 33336078 48848856 48466864 114677344 49839260 6616563 29989724 17505064 58507288 67099012 54626624 68634920 130552552 5980398 60656308 141620704 8399439 47959596 49527772 36899924 49231780 44629468 186542144 6464872.5 146954304 16418571 34197572 284296128 5116770.5 17384046 179343696 23984686 87185376 45971700 179127520 3452409.75 3536082 83763168 37759996 7865252.5 13316946 53366948 7455165 18446084 111100232 7254151 9385853 3368561.75 9947526 9189169 5364790.5 24097408 14177027 13165786 25587702 10460082 13268338 6473389 24924154 34380480 143462032 51942912 72711720 13602236 6336477 124048088 14237010 3113042.75 21986070 6922690.5 2458964.5 54026304 43079888 29293314 47230356 21962730 12650391 4955142 3594120.5 13360642 11206690 24464114 131078736 68531104 68154632 1488931 11746221 3672358.25 1495527.125 19620536 63234588 12723423 9239032 29322472 34320348 104373144 14953289 40627228 16505365 38201216 6960943.5 108125872 228159680 80758504 13486161 80561768 13647450 40698536 49833588 433036640 114156664 1003682.313 2263200.25 12890999 9557072 11916872 28344602 70145440 22072036 17767326 61676184 115453688 5809734 34673420 10308251 7313641 970191.875 12865062 9010799 68724976 44550168 166289072 3813754.75 57860956 20732206 1878610.75 1548982.375 999752.1875 21900104 126341632 5180667 31558226 11053308 17455118 2010094.5 13093351 3095789.25 64888912 198008000 30865368 12786307 74404056 9779376 17193388 6246587.5 48677844 41211236 175176368 9815919 57693812 21337496 64705348 107186536 3503577 2593566 27758560 291373248 6072145 97865656 28043884 130538048 189037600 18471608 43249392 6129959.5 70232656 167979248 70939392 21366586 13931574 2002811.75 5483060.5 3565154.5 9453236 22806844 11439303 8405747 50647280 199565392 201147440 4487330 58104876 7347496 131250280 1112414.75 26643494 9499173 112251888 2916694.25 68199968 5059171.5 10587341 6776989 12142078 74027800 71650320 18794330 1018145664 11955810 21986070 194580128 33818856 36324060 8083926.5 10191275 7392936 3905271.75 9502711 10335920 7086276.5 13420426 12890068 55247084 46060560 13783632 7975444 3610793.75 104115368 9201140 18597476 8334294.5 11491595 31939166 44860300 7637831 34779352 187036800 12294843 27661244 8350278 10210213 50590596 31157508 5799701.5 51353652 77274024 5126618 18502170 72043368 7857777.5 17782086 65062984 14364005 12404225 116763808 42643716 254217376 4328847.5 14749263 29987908 31724714 17655052 26498444 4083257.5 1788280.625 4738375 61867000 91570656 127661496 6476044 1668490.875 80808064 13582120 967866.875 12858940 61299404
N-acetyl-1-methylhistidine* 145298.0469 376378.7813 190205.9375 217297.25 172419.7188 432296.25 99636.1719 145973.5938 209349.9844 373531.5 172272.125 259693.5 115588.0156 152042.625 214423.8125 358035.9375 199604.6406 162327.7344 224055.2969 93198.5938 382352.4688 544374.4375 634613.625 66343.9609 354098.4688 245444.25 231558.6719 276120.6563 73415.2031 137618.7344 179803.5 325691.5625 243101.375 41556.1367 236394.75 473119.8125 232273.7188 159996.6563 63537.8125 781326.875 129257.4141 295589.6875 350738.1875 302078.7188 1137035.375 89818.8828 67045.5625 162889.5781 4962882 1137999.5 417728.375 789708.0625 518116.875 1480934.5 163288.3594 87902.9609 57965.2148 10447291 581737.875 40951.5508 3497766.5 242983.4688 4288683 2292563.25 113358.1016 988046.75 218073.1406 1217083.125 85727.0156 806122.9375 6919701.5 2116645 126882.6719 295388.2188 877409.5 4325682.5 1201117 2779546.5 1767612.125 22041.9473 670167.125 72119.7969 3355459.75 132958.4375 52701.6289 78684.7266 720999.75 4666499.5 1228740.5 358358.125 2262534.25 7549575 3726914.75 37026.4219 984966.75 2381787.5 127974.0156 48578.3047 4026813.5 330512.8125 155703.7656 161443.8594 160626.625 785527.375 2378946.25 411257.9063 681686.9375 313829.75 157065.8438 708504.125 1658348.75 415675.5938 69496.0156 5554222.5 105957.3672 2022953.125 3879956 102582.9688 862410.6875 867633.75 3351897 2671809.5 8592528 191669.4063 1532705.375 105583.2734 716179.75 81237.0234 76848.4219 4876014 502759.125 109910.3047 576504.625 421330.3438 84495.0313 113647.7813 11148782 275502.6563 1722448.625 1397943.375 442851.875 302402.5 6148840 637495.125 1031686.5 259093.0625 357615.75 412073.6875 1238773.375 90893.8281 8710621 339222.5938 2925291.25 96458.0156 373388.4375 703809.5625 181637.3125 255018.1875 3791535 151819.2344 79990.4141 132423.9219 775714.125 119905.7031 92846.0313 516347.5625 7896603.5 141900.7969 12397709 2773406 216715.3281 2677606.25 113628.7891 1050344.25 1984722.875 837579.4375 2551674.75 111253.9922 472099.3438 843569.8125 26018514 162167.4219 1564314.625 10068939 396317.5625 23844478 534986.375 228377.5938 51684.3867 132708.8438 10051108 585275.875 433295.6875 307055.0938 38072.8594 4445087.5 2149015 162407.75 83716.0391 14326915 353227.125 483203.5313 3514476.5 17992362 7520846 255639.7188 114713.4297 197222.0625 4253288.5 1218786 336288.3125 1398151 259692.0938 79828.2188 1977602.625 1992184 551374.6875 295057.7813 8512562 18809486 137928.9063 2917074.25 2000022.875 494392.75 1746060.25 482665.7813 795701.375 1557004.25 644712.75 976376.875 11080897 125518.0703 1487346.625 41582040 17799942 280914.125 2164172.25 921732.375 4842779 59898.9883 186498.2656 2050708 281645.9688 164989.7656 11040037 625984.5 336262.1875 3466085.5 1695500.875 372972.875 5872743 121578.5 8927690 30878.5977 2156319 171807.8594 188379.1563 96018.0469 296056.1875 184794.75 2186131.75 5057714.5 752676.5625 1414506 626290.6875 174539.1563 1214483 389636 215797.6875 28723502 186433.1563 3985862.25 34023.1836 202050.75 13538116 3530721.75
indolin-2-one 298629 50212.6797 762406.75 384863.4375 542028.0625 709971.0625 416334.9688 725664.4375 177794.2813 389165.0938 91811.375 115756.0078 110796.2734 191627.3594 175898.9063 962329.3125 240686.375 1608824.25 270012.6875 396944 306850.3125 642390.8125 537385.8125 627370.125 227442.2656 374643.9375 318561.9688 644071.6875 181542.2813 650635.125 220409.8281 133599.9531 499563.1563 223137.625 203694.8125 143930.4219 433894.0625 346057.125 1076691 123543.2109 476432.0625 389603.8438 1511309 158273.1406 347485.4688 424977.25 370891.9063 2546815.75 108328.5781 699972.625 98969.7109 699300.875 185699.4688 295885.4063 3578045.25 304796.75 509670.25 207396.7656 1054787.125 1253835 170764.6563 228867.8906 173581.375 109816.4063 457803 380121.125 346032.75 202220.5781 290161.25 195919.25 118847.6953 578269.1875 666663.25 466144 868489.875 418620.375 32982.75 77077.3984 657300.5 341170.5 167834.8281 414178.3125 172925.2031 702327.1875 69701.6484 323909.375 102179.3594 435531.4688 573477.1875 1936106.875 235048.2969 378221.875 2480137.5 563399.6875 460237.5313 1314531.625 265366.4063 366344.5938 753376.4375 2472338.5 6707634 150306.0625 667636.3125 138724.0313 163970.5156 1637702.75 691801.0625 89201.3594 159597 310924.0313 302608.4688 288294.75 2470330.5 499371.2813 615644.3125 108736.3516 34180.9102 159363.0313 1493972.125 186041.2188 197012.125 148109.1719 488528.625 1732910.375 99316.7734 421988.9375 130126.8906 562905.8125 2486813.75 329359.0313 1625865.5 213170.0938 880584.5625 144935.4844 795451.8125 746759.6875 683311.3125 185893.8281 177700.8281 2084148.125 332752.125 1473410.125 1257645.125 258130.8438 7066083.5 212888.5156 531467.6875 39570.2891 1091810.125 776364.5625 233953.9219 631961.8125 173961.8281 165376.3125 157016.25 169913.9688 1787874.125 190979.0625 531944.75 177957.0781 2648378.75 690998.875 392978.25 1083437 1351360.75 939862.6875 244647.0156 528772.5 473864.9375 2230491.25 731642.8125 965941.125 3476022.25 139152.4688 118565.125 571338.0625 803788.8125 606426.6875 198936.3906 1870519.375 942574.125 661860.4375 4902692.5 227613.0625 317962.375 5368790 5464184 177868.9531 294076.125 565933.1875 4671006 115759.5156 379116.6875 4754777 396944 820254.5 412752.9063 184909.7188 433574.6563 2011938.125 763148.6875 178229.5313 270493.7813 153154.2031 1635534 109825.6953 645782.1875 379517.0625 176804.6719 96678.4922 696629.375 400909.75 2888837.25 1172250.25 1193889 683501.25 61635.5977 269540.3438 68704.2344 3788021.5 136768.875 1929517.125 297063.0625 642093.0625 3898610.75 1204366.75
S-allylcysteine 3751336.5 1258001 3329306.25 1322452.875 836531.25 882913.5625 5628091.5 2922399.25 14770699 1267782 7119588.5 282439.125 549844 272475.7813 6864500 1113101.5 1070748.25 2838279.25 8736009 3193581.25 1917107.125 3539990.75 1491708.5 4215010.5 212142.5781 1212546.75 2961812.25 3355402 1735773.75 1060032.75 11997188 1121020.375 2947853 2340563.5 3390903.75 2326439 4960382 2257062 328278.1875 6465591.5 810596.4375 1638995.375 4623010.5 656300.4375 549844 3856639.25 1944543.75 1333559.625 877953.9375 4698521 2497884.5 905810.3125 7607111 2447206.75 849761.6875 30736.7695 581099.0625 226415.2656 54820.8203 53063.5117 1361317.75 1418442.5 184862.3906 78016.0859 2426125 749487.875 72884.4219 454162.5625 566936.3125 447711.625 62754.582 304403.5938 357167.125 117167.3906 151449.5313 58264.1836 505567.7813 710553.375 1020099.125 201096.6719 72666.1563 138202.5938 92207.3125 376706 179222.1875 273619.5625 351836.6563 123168.3359 174137.0313 370210.8125 1469171.25 216151.1719 167371.0469 151714.2813 1495959.875 421046.75 1737148.375 397733.7188 669558 2880465.5 781638.3125 537029.5 96591.4688 862241.0625 381554.4375 740475.75 425214.125 175736.7344 76317.3594 299030.375 279345.7188 59643.418 1159658.5 218156.5469 212007.0313 136874.8125 154696.5625 196870.1406 77825.8203 369272.8438 1695872.25 1211559.375 651238.8125 1546797.75 721453.875 241610.4844 1624927.125 47823.1758 195599.2188 493480.5313 1886120.875 183500.4063 385002.9063 860497.5 291852.4375 562658.5 128566.4375 93976.2109 1499182.375 165294.375 82613.6094 154972.6563 567058.3125 443380.375 207068.7813 508640.25 284685.6563 426518.625 2286623.25 1207928.125 562866.1875 348789.8125 234294.5 809425.375 884914.625 3280119.75 1036349.875 585470.1875 202032.2656 502628.3125 483100.3438 274069.2188 233084.5 760358.6875 1432423.25 2201874.25 4985481 205554.8281 129222.5391 778392.5625 1776545.75 222173.3125 420344.1875 88586.5391 102520.1563 43772.2031 49872.9023 535454.75 173486 176361 8104802.5 291915.4375 214379.2188 115025.0859 346353.2813 719133.625 3090277.5 13482706 500814.125 360249.6875 125122.1563 5919318 260153.6406 2342885.75 256882.7813 1627044.75 374757.0313 2006615.875 303558.25 72837.8203
2-aminoheptanoate 2531732.5 1936391.375 2837902.25 1590488.375 829870 1643814.5 1658212.125 2010317.125 1978873.375 10453779 1927557.5 1731104.5 1380546.625 4068702.5 991766.125 1962449.5 2346878 2071926 2007087.125 1983418.875 1051450.5 2133583.5 1514147 1651160.25 2186605 878604.8125 2162404.75 756416.9375 1333275.5 1385841.5 2265790.5 795435.25 1242270.875 1981712 1609228 2006123 1572590.875 2759120 822333.25 1201432 4038639.25 3236568.25 1251980.75 1469893 1736204.125 1748873.25 1330937 1393666.125 2939451.25 1505729.25 781584.1875 5055730.5 3786559.5 1167268.5 560292.6875 3699101.75 1374837.75 1516272.125 1388843.75 2865001 1399799.75 458333.0313 593790.375 621437.9375 318284.8438 1049130.375 926112.375 1330937 5601050 516356.6563 747391.0625 693800.25 1632751.875 699591.625 478861.2188 1912794.5 1316554.5 923854.3125 490684.0313 2085100.375 2416039.75 606844.6875 346016.4375 1444249 1902029.25 515614.0313 1615048 1896196.125 556906.4375 2355116.25 2458763.5 1064327.625 578943.375 1520561.25 1056327 907402 529910.75 1280768.625 3843790.25 859065.8125 1103279.625 1118047.625 1716561.5 1640738.25 922046.5625 3600020 814558.5 199840.1094 975009.75 4007049.75 4299428.5 1003497.313 1165790.75 5718119 837850.4375 1008426.75 800730.5625 618150 238462.875 1010420.125 1081784.5 1021651.625 935956.0625 4184164.75 184519.3594 555323 869895.625 942098.4375 1338978.625 4532559.5 894279.6875 3383125.25 1527514 2364071.25 708375.1875 635010.375 252855.7969 430106.9688 2003645.375 824364.1875 3422789.25 395127.75 1723690 5421217.5 1641470 1647618.875 762276.125 460194.25 787884.875 1680432.125 736448.1875 503955.9375 369454.5625 790451.875 4130029 1578104 463917.5313 808113.4375 864260.375 1331219.625 805506.9375 416157.2813 327676.0625 1240334.5 2841221.75 380787.25 744143.6875 1095364.625 349926.2188 2681195.5 1159862.875 1917145.125 1386933.25 1428238.125 4073764.75 4060716.5 2532555.5 705626.375 679948.0625 1014440 763532.0625 1356745.25 2514761 2309151 5979986.5 1677786.125 614419.25 1829969.375 650783.3125 2020840.375 1212559.75 742735.3125 1176779.5 865478.875 1683582.875 1828767.875 2189902.25 1424237.375 1411545.875 783176.8125 1652085 3047384 666543.75 3822416.25 863659.8125 703948.5625 451657.7813 265686.5313 2108546 1091069.75 6723866.5 1525725 381954.75 1831928.125 1368808.625 1354161.625 898618.25 12085035 2595217 751620.5 4720906 379259.2813 4572507.5 1815762.5 8914683 749738.0625 2283195.75 356055.8125 1330610.25 1224583 1271104.75 6384340.5 541367.125 1343877.625 1330937 590822.75 377818.375 1466226.875 953101.9375 1201913.5 1149622.875 2104337.75 640093.5 1497505.625 4573050.5 380178.6875 1009498.25 725821.125 2578137.25 3479554 1062344.25 599532.5 283807.4063 1117339.5 515377.0938 1219113.75 1236727.625 979380.8125 1477571.125 522198.625 743426.0625 221728.6406 756357.625 484926.3438 803061.6875 1502718.75 1857835.25 1844561.75 1372438.125 1674953.25 437384.1563 891292.875 1005672.125 2188954.5 601897.0625 3501012.5 455081.375 1519455 613823.75 3149810.25 1205794.625 1480343.375 2518646.25 1425484.875 2127488.25 4596744 446406.0625 3018958.25 1492981 1191196.25 3621905.75 2158704.5 2298920.5 1640170.375 1020894.375 1519802.625 547468.3125 1021257 549728.875
benzoylcarnitine* 476554.375 217286.125 73554.7891 246454.7656 226731.9063 136111.3906 92973.1563 153907.9844 444457.3438 208674.1719 480650.4063 222646.5938 125035 1446234.875 2161635.25 845829.75 166122.25 590404.0625 543440.75 564570.125 757930.0625 1824697.875 1388920.25 390468.625 689795.6875 438631.5313 160429.9688 228412.4063 529124.875 543255 2514283.75 2586345.75 114800.6875 311299.875 174146.0156 656172.125 640051.0625 68949.8672 351518.375 118623.9219 399526.5313 66571.9609 1273911.625 1865066.375 236217.5469 1038351.813 875314.6875 302290.3125 1817629 358964.5938 775823.4375 434291.75 500037 256188.0938 1730492.5 1198361 93525.4063 429786.3125 135437.7344 258795.3906 1156008.875 646422.1875 1391637.625 105378.4531 235301.5156 1826169.25 194470.0156 145208.0938 973487.1875 1314585.25 120506.0625 377173.8438 1147848 247083.9844 754338.8125 371396.625 2666198.25 271923.7188 2592857.5 500037 388205 821336.6875 1879399.125 745082.1875 236422.3125 295854.3438 4280896 728648.25 618623.6875 239624.7969 3350372.25 703993.0625 1005462.75 1354347.625 1861667.75 495778.8438 136331.1719 2196492.25 616507 1594199.75 491841.5 1150438.875 342800.6563 242868.7656 1361210.25 1877705.375 4060879.75 826167.8125 17312442 607543.8125 123404.9063 535512.75 1088074.75 192426.5625 668217.4375 99527.0781 70542.2422 374818.6563 1535270.375 324792.5 1331917 508232.4688 412882.5313 1420374.25 217171.7813 382505.4375
methionine sulfone 766701.6875 1506907.25 2455097.25 2180672 2144490.75 5093587.5 1227245.75 1965637.25 4152389.75 7340155 1368808.25 1820199.5 2059448.875 2285489.5 1243295.875 2509555.5 2352282 1670446.375 2316987.5 1766557.25 1565306 2927159.5 2429768.75 3579685 4585508.5 2824381.5 2341695 1434290.375 4572837.5 2659319.25 2809832 2857072.5 2571410 2585859.75 3066865.5 1361641.375 6235506.5 3702215 2922252.25 2783385.5 875844.5 1903652 756731.625 2682616.75 1867216.375 1538973.625 4860624 1462941.25 2864528 1369382 11106742 6225770.5 3578285.25 6784353 6341054 2627271.25 2679153 2513310.5 1875461.375 7875858 12665961 3301354.25 4076407.75 1870114.25 3644479.5 810451.25 2093471.125 2723301 10972663 4486734 5956261.5 1216016.125 2145147.25 679613.625 6931702.5 2614280.25 3343826.75 2039028.125 1211713.5 4233566.5 2764957.25 6617701.5 3558368.25 995493.75 4674821.5 1703406 1189220 1825084 792904.375 1114353.5 756520.5 675492.625 4139166.25 4956381 5088092.5 2601964 4687000 11726780 2507886 1002756.188 5088701 2204869.5 2818832.75 2679288.75 574172.125 21388828 1621905.875 528597.1875 2349352 899350.3125 7626365.5 10634876 3466541 4863509 2443088.75 3101593.5 5252108 3097010.25 1224335.5 4061679.5 1560750 5518410 1716152.25 5332516 1511884.625 902734.5625 2656485.5 6970678 3497762 5450194 563329.5625 3457296.25 4392938.5 4776034.5 774091.6875 903349.375 2184186.25 999965.5625 1761069.625 8749190 2827321 1567483.625 5395670.5 1239377.25 1375412.25 1975023.5 2078953 751810.4375 5388274.5 1864352.125 3516871.25 2119062.5 1978940.5 6871179 11518413 5313360.5 816804.5 1609445 2293712 1565628.375 2135344.25 2650958 1367910 2598050.75 5581388 2143828.25 5235059.5 1383455.875 5086054 3678177.25 1113656.5 3879052.25 8963996 6386215.5 3187098.75 1881907 3707635.75 2569870 1313808.875 2867231.75 2321833.5 6288474 3310120.75 9025131 1357034.75 4207310.5 6362794 4199765.5 11730169 5716036.5 1715229.75 8646818 833559.6875 4076575.25 2967617.5 5569657 2687596.75 7664608 5882154.5 640661.1875 8814951 913808.4375 1153344.375 1639917.125 3600245.25 847795.75 2241073.25 604230.375 11412732 2467812 380810.1563 3321701.25 921943.8125 5183722.5 9571270 2809921 2517345 6637303 2672644 1709235.5 9705431 826103.625 8648545 5149798 6527158 1861645.75 4348875.5 8020860 6160643.5 6033395 1303697.625 14399858 8046167.5 3876567 12910172 2377852.5 3739817 6777801 8402460 1403273.375 4805336.5 14791262 13452736 5231577.5 4062375.25 3156123.5 3699160.25 4865029.5 5564550 2864528 902875 27614676 6217752 4371978.5 3901385.25 2740927.75 2843446.75 2530434.75 1367660.75 6406519.5 2922926 7315347 2384606.75 2729220.5 2942835.25 1790200.625 4351437 8464882 6744216.5 2083259.875 4569722 1233762.25 7732269 1111260.875 4917232 5345794 5851289.5 958676.1875 4743217 1914758.25 3747010.25 3441825.25 7994989.5 2615797 5368973 8375355.5 13503895 2982203.5 13939092 8880840 2922181.25 5869554 8328870 3848138.5 4629891 2821239.25 1860561.5 3086843.75 2861824.25 6455193.5
fructosyllysine 20716570 19736182 13441797 25855652 5486804 38910496 9805817 10205240 7263146 22043028 15088287 9461829 4683328.5 3482784.5 6745930.5 9734998 4270197 28041578 5176337 8200891.5 2288255.25 14129058 38939248 14729752 8526121 8993414 15880743 5512602 18427554 15825342 4800753 5411999.5 11521302 8629713 18263130 3622317.5 14260802 11842152 7919065.5 11165725 4132593.5 10538809 8804872 7056382 18863130 3318576.75 4606032 3908923.5 13838849 26150144 14562178 12548927 30210416 15634037 15054352 14578283 12583543 25503628 27771334 20330164 13145288 20150154 28448220 13776563 10252376 7652325.5 28545332 3197676.25 9468558 12604996 15828649 8197500 5416879.5 18095004 14422552 18789366 3714249.75 13876491 10491573 20425514 25927172 26680972 13295465 21732716 9878939 25457640 5650648.5 12871262 13817578 13914559 8959805 9464193 25526200 21763456 12429839 20161792 7394123.5 19816540 11089638 3565835.25 2352244 10408835 26835002 11391881 10737596 10938858 14635061 8412903 4310663.5 3264530.75 5569670.5 10990587 14810678 8532258 3058337.25 16391085 3944736 10810680 12903704 6941419 9873536 12527069 2758249.25 14571025 8181102.5 11117579 6778602 8256334 6356529 10816887 13420904 5642235.5 28424466 39738652 16894620 17581682 12786596 16060948 12028633 5072332.5 9412546 20800304 128587600 19104054 9231102 7414535.5 13751044 3935017.25 13945534 5293491 8968635 21821756 13548153 3803348.75 4469972.5 15716567 8173045.5 11052422 8891828 9740589 10602012 14705457 8986510 18779714 11691561 13365705 10281857 17586082 3770592 9394703 22118644 10318198 6420450 27914418 19229472 6124709.5 26958058 14070154 12368998 7217890.5 13107565 11592133 3228809.5 9745110 11488483 7200929.5 10100336 13964810 13607305 10947901 16121862 11302608 6889625.5 7091080 6199814 13099212 7189823.5 13624866 8072958 4625568.5 6823704.5 4875077.5 25114308 19441946 5278187 13156842 15238110 9973815 6656317 10737596 11522966 5386511.5 8280861 4907613.5 11294144 18739224 19493276 6498162.5 10873178 10331675 7036133 7215488 10148568 23331204 7404472.5 4569386.5 5890156.5 13471977 6415081 8983408 8111837.5 39523812 19102444 14427147 9663570 4415738.5 9855184 16387057 7691118.5 3314712.75 9349634 11667411 10269062 20524398 3737237 4470435.5 3136336.5 63812112 10669551 12646653 4694853.5 11330966 8438898 5235463.5 45214960 18882024 26053254 6928399.5 8688875 11467467 12439457 18254876 2773648.5 6374750.5 9230900 20860296 4352804 3498486 4051134.25 21168154 13323966 14828884 6315567 11965275 6099821.5 10047985 19717574 15569037 3828380.75 34896576 6749076 5268459 13343528 5298864 5339870 4979754.5 12984415 7333341 2264375.25 10582501 6254954 4945517.5 55404708 11618738 7702633 14956251 36584160 4568059 6556812 5024152.5
3-methylglutarylcarnitine (2) 298440.6875 267495.7188 772071.3125 373818.25 933275.0625 314571.0625 172078.4844 633807.4375 372379.3438 887151.25 388450.75 534502.5625 542003.9375 359913.4375 318396.7188 229167.3125 429707.75 310771.5 217975.375 943198.9375 989407 573063.8125 357385.6563 267192.6563 553853.9375 325260.9688 484945.5313 44143.1484 1060203.75 864382.8125 141867.3438 479899.3438 1429095 911139.1875 600444.625 197904.3594 1144627.125 534530.5 288369.0625 418514.0938 938237 804477.3125 1050924.875 2437563.75 466848.7188 76456.5547 938237 393859.6875 53069144 6558135.5 1000947.563 3232763 4985444.5 5104784 368738.0313 243979.6719 195605.7188 28473644 5484118 184847.4063 3560536 413084.0313 38222828 156020.5 8590117 249910 1183721.625 866581 7557456.5 153986.0156 578032.125 105786.6953 155978416 1287228.25 467795.0625 404696.0938 916113.25 2667108.75 7811573.5 5274776.5 4271153.5 2401850.5 87012.0781 208320.1406 72356.4531 10293377 251828.0469 312546.2813 113120.1094 4505073 6390904.5 2571740.75 503747.1563 12033793 23012142 4124202.5 84685.7813 1281486.875 3486945 691222.375 139335.6094 3642914 708071.5 111923 121122.2266 407382.8438 95309 1183389.625 1464242.25 404679.6563 85363.4453 5136195 5288471 12956708 833199.25 274308.1875 712095.6875 52538980 234217.7188 3284882 2212353.5 113774.6406 388578.375 2564831.25 8523358 9105308 324742 35692140 1125591.625 5168082.5 66656.9219 148908.5781 1272036.875 122396.3125 564288.75 37306616 229833.0313 91567.3672 752718.875 915732.9375 188067.2031 809983.875 127689.3281 5363608.5 21831592 798120.25 716869.1875 2457983.5 240335.5938 4497319 22032758 1241584.25 735875.625 960193.0625 2864495.75 228787.75 1349397.25 437993.125 626209.1875 121338.9141 28783380 546386.9375 4977263 721626.1875 455140.125 910139.875 150897.5313 18560290 563702 721433.8125 892928.8125 2869598.5 475402.375 45968.7852 1690436.875 607320.0625 26206054 1211413.5 117641992 1753057.75 1331534.125 6630280 495403.5625 9379053 12827682 1474973 3573342.25 2525393 894500.375 109357032 409116.875 14796214 19185238 993160.9375 63388292 178649.875 2031694.25 1118279.375 408528.9063 197947.4375 226902.5313 133173.5313 32220906 1293708.875 830350.1875 335348.5625 73270.1016 1451915.5 16086512 511826.7813 226029.3281 95979456 1056321.5 479618.2188 6297030.5 68184800 2288821.25 1721663.75 597662.75 1008590.75 6079509.5 4274477.5 1917736.875 4346200 557628.625 455621.625 6412060.5 2458404 4156788.75 824677.25 15652234 99599584 113732.6953 4481098 5428493 2326820.75 7767541 2958344.25 874169.125 9839256 1037796 4568930.5 18616406 295444.9063 1465300.375 67215688 29182344 581614.75 6646433.5 1959723.875 36587896 947319.1875 3613159.75 685585.9375 349682.6563 3498060.75 6034121 846236.125 1218215.5 4485632 28014088 1500014.125 6439604.5 252264.5313 18984992 306160.2813 190929.2813 20506656 310260.25 826912.9375 142791.8594 1440986.625 194733.2656 6707388.5 12930918 33973572 3153194.75 4724894 1837381.375 837037.625 1438511.125 201603.9531 10468537 20071830 387592.75 2201517 431254.375 260388.5625 163512400 13444177
phenylacetylcarnitine 242973.8125 517474.9688 813284.3125 959331.375 632447.8125 1952298.375 356739.625 1006412.5 641378.9375 2781975 1795285.625 6708975.5 899992.6875 521505.5625 262923.9063 228999.2188 473399.75 465460.4688 1649139.375 241817.8438 518217.1563 3779949.75 329622.1563 822158.5625 2865224 495141.8125 2892680.25 287128.9063 2614728.25 685522.4375 729971.6875 500013.2188 4977974.5 1991171.625 1341983.875 812849.25 518005.625 631149.0625 1422447.5 915263.9375 1407701 2286741.25 361152.375 474461.0938 2727134 562636.8125 1138410.125 1619583.875 5343336.5 772436.9375 3754826.5 540328.875 3316669.25 5592701 968708.3125 552675.3125 3110241.25 907605.75 466948.5 9088686 2954586.75 8142390 2970204.25 1829546 1468780.875 661037.0625 9912566 2726586.75 962243.1875 3803723.5 1159815.75 411941.8438 37769.8984 3642318.75 2008388.625 1948231.875 3414247.75 917206.875 2039431.5 507070.4688 2616299 3313523 4132751.75 4646414.5 1455810.5 2830213.75 3505118.75 3352793.5 4592081 4604255.5 7788597 1866636.5 56975.5859 24498644 2629268.75 672200.5625 151855.3594 28109520 412215.5313 2812283.75 184483.2031 723044.5 8371003 4350736.5 3609693.75 2958194.25 3783312.75 1458196.875 6835370 1145493.75 865484.9375 2322744 2014935.5 993299.8125 4391892.5 8949510 16884168 8719971 1188996.75 1412682.5 1656648.125 3014191 3533768.75 23471642 7789314 335844.5 1496809.625 3595781.75 2124435 799379.0625 1605337.25 1827604.125 992157.3125 3125178.5 9202400 1454256.75 1923448.5 27569444 847231.6875 638915.25 1770095.5 3182601 13452126 1617450 545227.625 10246002 1080522.25 4551244 698437.75 3578233.5 596389.8125 1540859.75 6883992.5 3899606.25 4818619.5 3149674.25 2370092.5 436807.625 1578009.75 4723163.5 4907865.5 2802243.75 13017357 2034209.375 8744165 4122516 1331479.75 271703.3438 7255644.5 592579.375 4111271.25 3440788.5 761584.125 2663762 961883.6875 2899739 6866737 908891.5 13979968 1665322.625 5350420 3411905 1770522.5 5747031.5 364921.5313 677676.5625 7292788 637637 368752.5313 366513.625 1759383.125 927616.9375 1829546 3215382.5 4211524 3520215.5 6339903.5 2035700.75 314573.4063 3155710 1829546 2040404 741267 2177181.75 14790881 1295842.25 225828.6719 1600315.625 333855 2676622 7230846.5 197101.2344 2359055 8776731 2405188.75 15495714 954145.875 5199218.5 914038.0625 662829.4375 2448760 973278.25 1538373.625 5583403.5 3472370.5 1215279.5 1920539.5 1219992.875 680690.1875 2083015.125 6449590.5 1785552 603527.125 1526370.5 889272.25 4314443 7554326.5 4456472 1919941 5697979.5 3212226.5 1705452.375 391388.25 3228683 575115.375 5327905 171486.7031 827060.75 8019351 671946.125 442901.9688 1273550.625 8337211 5276636 135877936 1792037.375 6949389 2658583.5 317504.3125 2471567.75 3714414 5847586 380800.5625 5812369 348031.2188 6905666.5 2434924.75 750872.1875 974897.5 3256588 862925.6875 15924797 2270847 3736723.5 400977.5938 3185210.75 3977654.75 628765.375 1077589 814624.25 3034487.25 742229.8125 1539393.25 1060126.75 1256954.875 1335170.75 1515717.25 188500.4688 1792956.75 16379264 510494.0625 3343887.25 4485278.5
N-carbamoylalanine 202364.625 126080.2266 63771.707 77925.6172 53274.457 92884.1641 355394.0625 123373.375 96110.4297 183926.5938 28337.2188 65107.8438 77091.6172 69084.2813 96865.7813 121158.2891 182485.0156 88392.9766 164762.5625 206258.4844 63929.7852 314336.5 115626.2969 156715.9063 390877.8125 169943.6563 111086.0938 167072.5 120263.0156 61696.582 113010.6406 125715.7656 93373.1484 55769.582 191495.2813 160330.6875 714761.125 389398.2188 81519.2031 116983.0703 305903.3438 792228.75 444890.375 58491.9688 1233053.5 411018.4375 158488.0938 41341.6758 216437.3125 2097909.25 206104.25 260828.9531 310619.5938 401973.1563 604246.125 277772.6563 334173.125 93499.5156 43080.5547 815591.25 423043.7188 63491.6875 1278266.25 412014.0625 415728.625 81542.5313 151440.9531 54438.6055 505462.5938 67354.0469 79001.625 326280.75 278732 119283.7188 106414.9531 930298.75 222897.625 2410874.5 72534.3984 268646.125 222532.0469 167770.2031 427417.6875 1002726 72601.6172 635509.6875 249073.2813 253730.2031 246625.2656 76328.0625 526192.5625 170132.2188 290346.9688 215966.3125 541509.125 70685.6406 155169.2188 56822.6133 60086.6133 1224337.75 103621.9922 1267281.75 230377.1094 421304.4375 86810.3516 263030.5938 963272.625 1312646.625 361014.6563 250291.1094 310823.8125 334132.6563 207214.7969 140309.4688 216270.5 75120.3359 134584 1530277.5 68707.9297 552871.3125 524194.625 2451157.5 210330.6406 372736.125 53950.332 143046.6563 875013.25 256278.9063 216270.5 111844.8516 187418.6406 1666577.625 251577.4063 1356978.875 64284.207 260096.0625 547608.875 216103.6875 278359.5 161353.7656 807378.25 330834.8438 186985.3906 666830.875 1025477.188 39043.4492 273946.1563 222997.2188 154217.4063 188257.75 147470.5313 551816.0625 359217.5313 1354796.125 41275.125 237220.5156 2713965.75 1844998.875 88355.9297 428107.4375 1834735.625 61539.0273 512472.1563 501638.2188 251768.0781 124827.9141 455743.6875 415295 909743.625 81423.1797 356132.0313 106807.3203 45576.5313 201867.6719 1138494.5 119157.5313 352199.7813 392914 630277.5 73702.0078 113954.7188 880811.5 77150.3828 1185169.75 149627.8125 108905.2266 1128639 550682.625
N-acetylkynurenine (2) 331328.1875 487122.75 123022.1328 147679.2813 117183.6328 150392.8438 168511.875 138051.9531 86666.5391 195242.5156 79150.0313 179210.4844 124199.0391 93499.2969 80918.5781 100949.0938 59588.0625 79849.6719 214729.8594 185076.125 221511.5156 269897.9688 184138.2656 96371.4609 50219.9688 55096.0977 83821.2891 205449.8125 216971.7031 249191.5781 103225.7734 124586.7422 100479.8203 114235.1172 224257.9063 64710.6758 178567.1719 121288.6641 621651.25 1040759.938 64441.4063 82038.3984 1504777.375 656610.625 337360.4375 165487.0156 58420.6758 367821.1563 83424.0781 296025.6563 2902547.25 120957.3672 529862.375 130601.3672 1457900.25 325383.2813 82147.1094 150897.9219 2609108 153708.375 812805.4375 942487.125 1031458.313 90100.3906 44171.4805 1099190.25 202378.6406 1760309.25 169363.9844 283000.2188 278599.9063 236752.0625 40601.8359 89469.0469 1292580.875 251935.9531 341745.6875 912820.6875 3175314.25 1104895.375 1575830.375 55000.332 444901.6875 172584.2031 1099837.5 88493.8438 33216.3633 541793.5 115105.3828 113612.3906 60294.8398 513330.0938 544788.25 149377.1563 171759.8906 294478.6563 101947.3203 408042.5938 321681.0313 251745.3594 426596.8125 378622.2188 76861.3281 584730.125 2588248.5 108934.9297 247266.4375 118617.0469 755753.875 1660495 565238.8125 1640974.25 92130.6094 667528.9375 311229.9688 149807.625 145453.4531 216199 2030293.375 164995.375 203504.1719 877496.875 756443.375 112773.1094 2108615.25 441863.375 181470.5625 617512.6875 60145.8203 3508998 260621.8438 100541.1875 67500.4063 125687.3359 256284.5625 595099.375 328483.9063 417070.4375 201440.4063 187845 154108.75 390712.7813 119586.4453 75913.3984 3378076.25 132627.2344 361683.8125 87713.7656 103067.8594 136366.625 113578.375 92811.7031 4299984 113483.1406 1380255.875 532540.1875 88532.2813 1536037.875 162735.1094 829305.6875 260134.8281 369438.5938 130841.9297 3425629.75 2197450.25 149109.6563 6501270 2157603.25 31486.9297 1298436.875 133216.7188 303181.0313 448382.7188 250115.7656 501383.9375 449018.25 642968.625 245249.6719 69055.0547 936090.8125 208140.0938 200665.2813 220858.1563 1419461.375 188420.6719 995734.3125 141728.5625 4927670.5 857000.1875 163753.7344 335298.0938 211211.8281 1322514.25 434700.4375 124633.75 1575215.5 409953.9688 1549324.5 392224.4375 104767.5781 165272.625 272873.4688 157505.7656 40303.3477 120287.9141 66335.8438 417758.0625 72750.0859 1195514.875 1680735.375 151789.4219 153102.1719 3392834.75 69288.125 493200.8125 100552.0391 577247 313407.9063 193885.7188 1787850 100386.0469 546609.1875 153564.6406 63270.4102 665862.9375 75444.4688 470829.875 157828.4688 128047.4219 62902.7891 350052.3438 189756.625 399333.3125 217668.1563 259280.125 318987.3125 150062.4844 190005.1875 516842.5313 82338.5625 141088.4531 783509.8125 220727.9531
N-acetylglucosamine/N-acetylgalactosamine 1571923.875 1244451.875 1210670 1619515.875 1246758.75 1984979.5 932448.75 1546349.625 1476544.625 3549173.25 1462177.125 1671982.5 1398279.875 1080969.875 913001.9375 1514202.875 1084067.75 1954994.375 2118487.5 1871817.375 1524303.75 1862829.375 2181260.5 1563509 2156055.5 1343283.375 2092672.125 1266138.5 2296843 2104787.5 1588430.125 1182183.75 2529108.5 1264155.5 3192640.25 1109701.25 1652356.5 2301714.75 1312301.75 1852551.5 1636934.875 1662860.75 1590814.875 1757397.125 2572138.25 1777096.75 2447402.25 1419041.25 2331146.75 1535144.375 12793275 18256874 3600304 6765000 16430273 8000046 2326864.5 3049376.5 1786509.375 8597710 8220706 4609047.5 14662666 3639723.25 17651182 2194190 16040075 2588326.5 6821515.5 4039935.5 10685670 2653221 3323959.25 3731613.75 7666920.5 9039516 2140885.25 4343677.5 7259762.5 7829336.5 10240810 9490955 10875896 10038795 3402829.5 5466775 1951835.5 10815539 4190779.5 2205718.5 4095201.75 1688941.375 10925073 7706187.5 7308943.5 7220942 13320035 5771047.5 6794003.5 2060260.125 2294045 4619605 5633003.5 3099344.75 2653792.25 5200649.5 2983781.25 2023382.25 2418131 2082891.375 3696250.25 7232613.5 4168765.75 3755073.25 3906503.5 5279982.5 3928797 15291635 4553843.5 5466785 7701993.5 12855066 2119616.25 5063076 10101053 4458983 3280008.5 5032339.5 6337146.5 12514076 4950414.5 9381926 3184214.5 15680528 2733900 2527469 7738509.5 3062322.25 3463571.5 11472673 4769296 4213309.5 9514979 8513074 3060128.75 2690452.75 2700259 3243083.5 10897210 4255232 3846625.5 12101121 1444598.625 12923813 9007214 3864685.25 5590932.5 5258034.5 5705039 2612084.5 3164873 3558158 4169774.5 2703750.25 17692496 4510394.5 5621872 4283662 10301316 4100061.25 4405848 4172212.5 6888492 3585181.25 3415758 3839933 8287496.5 5648645.5 1782454.5 6013448 4545778 13319355 3732764.25 8344806.5 8602900 3264011.75 7315083 4455480 23106900 7672537 5284320.5 10204310 2142754.75 18663608 6045814.5 15935177 2877018.75 8631438 10888509 3361126.25 6397821 2508928.5 13150651 6148404.5 1846396.375 4025586.25 4641768.5 2849379.25 4192761 8105053 14902609 2834591.25 2949897.5 8902286 6038147 3643797.75 2571391.25 12786032 8954433 5518762 4003719.75 3992552.25 27107876 10167667 3153035 2227480.25 2858932 7400555 4192761 3954777 4341047 14336797 3388631.25 11793681 8499104 2487579.75 4824274 11535573 9203583 2428477 4971183.5 7112378.5 9264242 5461580.5 3652597.25 2625385.25 7359807 10744562 6171757.5 7933098.5 1533589.375 6487097.5 9221999 5581935 4134641 13238508 12077011 10726370 1933285.25 4375394 15024030 4334353.5 1504435.375 15442205 4618085.5 4609943.5 3599430.75 4301003 18556900 4419026.5 12449886 2515787.5 14318257 3396934.25 3760738.75 2607921.25 5833841 4087562 2319645.25 4051460.75 2317496 2468952.25 5222246 7913469.5 6539882 9593673 9017024 2666003.25 18801098 5029591.5 2757801.75 3923814 5934619.5 4804831.5 3250521.75 5220342 4260386 2925011.5 6264694.5 5400463.5
adipoylcarnitine (C6-DC) 401781.2813 344299.1875 296418.125 2677580.25 211165.7813 475739.25 394211.375 354430.8125 358607.5938 3952213.25 920608.75 954219.25 369627 213309.8281 401162.0313 493894.7188 633496.5625 449980.0313 424061.9688 402179.5938 823289.5625 650494.125 211142.4844 1218749.75 400707.5625 717076.625 576022.1875 358773.2188 707834.625 512187.3125 592025.1875 176218.3125 1605482.375 627874.25 519590.25 610916.8125 205239.7969 620418.5 251039.2656 918946.5 604282.8125 578791.1875 268783.2813 496197.6875 577577.375 425207.5938 206091.7969 247831.9063 498073.5938 246215.5469 24224330 10924842 1950917.875 12957278 38407272 14224275 385107.8438 1828963.5 796422.4375 16907902 15748633 5214195.5 10025430 4201802.5 99559640 1993798.125 6062403.5 1661608.5 3178237.75 5588520 12711265 2926240.75 964407.25 946490.5 43191428 6119108.5 2648705.25 2365451.5 3761432.5 31503006 8788793 22005182 6480285 10910176 2017478.5 2394518.25 1777961.25 7621736 2230768.25 991890.4375 2028514.875 1179847.5 9063516 5078053 19060462 9496888 37377748 15898118 14023420 3307131.25 1185928.875 5419943 16965286 2707268.5 815430.1875 6923809 1475709.25 2374152.5 1579798.375 1352867.875 12034221 65201256 6443824 1132257.5 6799999 4474685.5 7503629 51315108 2965195.5 2810890.25 6366573 57291508 959721.75 7946759.5 3218309.25 4055293.5 2722453 1908806.125 10659271 23586116 2149289.75 5724877.5 2435588.75 17779448 2276359.5 1091118 10476363 2627495.25 2837405.75 89251920 6865289.5 1846065.5 5956329.5 1151083.625 896692.3125 1570895 2153014 1732918.75 9787238 2411112 6287460.5 7867996.5 2845393.75 7930306 21271220 9784226 5658819 5385071.5 6856394.5 3765009.25 913561.125 1779523.75 2012470.5 2804297.25 22530072 4067053.25 6211400.5 3504481 4335305.5 1110690.625 1768021.375 1790666.125 15164859 9662775 948353.25 2703109.25 9650938 3844836.75 872012.0625 6458375 977039.0625 8862511 4796169.5 11474836 17931208 2665638.5 8205479.5 5002915.5 15702471 5887928 9585711 9357317 1723451.875 7554421.5 6118305.5 42266912 1771488.375 17798206 22281852 583691.125 47787996 964570.6875 11924170 6283073 292475.3438 1415169.75 3761432.5 974372 12455208 13193006 7655112.5 2386729.5 2328675.25 36904628 20451420 1214035.875 3757855.75 10209872 3772372 11794608 1807607.75 1673035.625 84299232 4446216 2867901 1023069.875 3185481.75 33140754 3216520.75 3824261.5 2741413 7032712 1686198.625 32494720 53241492 5064255.5 7464661.5 52047168 38019364 598928.8125 6863344.5 29738604 4059881 12995150 7425414.5 6526820.5 30635144 7959939 10576571 17852740 1011841.688 14043080 65476460 25201014 1291789.75 13816720 4129585.75 6502689 1258923.125 6263757 12026707 3679632.75 1468066 21108718 6012193 967221.4375 13296801 21742334 49890748 3117842.25 16045262 5111790 58102464 2843791.75 2830554.5 1609553.5 7951207.5 3464544.5 3896577.75 654350.875 902404.875 6799595 3976972.75 28101610 17266402 20295550 9412672 2441509 32413066 13496499 1342918.5 4057287 1873626.5 17136948 1366705.625 2764080.75 1065596.375 4106330.25 57534036 10264581
4-hydroxyphenylacetoylcarnitine 183064.4688 46148.2539 194931.4844 109979.2578 79208.6328 506491.2813 50889.6914 1546858.875 964797.0625 229854.2031 111408.0469 95864.6641 204909.2969 70079.5078 352071.125 131705.9219 180791.5781 680699.8125 535403.8125 63167.6836 220132.4531 371213.9688 95175.3203 242581.1563 210397.4531 291076.5 142140.6563 126806.5156 379996.9688 281133.8438 257008.2031 309706.8438 270408.875 222553.8125 298593.6875 239671.7031 372127.5625 487984.3125 2562574.75 560975.25 1061429.75 2547866.25 1017519.875 502685.25 333188.25 534935.3125 683895.8125 4295643 1098280.875 934525.1875 443100.7188 3016171.25 365611.75 450863.9688 53956.7813 6308340 422274.9375 1325195.375 121293.0234 191803 305311.2813 3072649 319500.3125 688553.625 546585.1875 2819304 2165558.75 5676766.5 2111333.25 778287.125 594600.375 1178197 356332.9375 7549354 681889.1875 494496.875 362030.5 1535915.75 883694.5625 1135006.875 2227427.5 2081851.875 1064055.625 853889.3125 134754.5938 133935.0625 486181.1563 3750775.75 71515.9766 550574.625 2605938.25 1609386.875 189716.5938 116661.3125 673347.875 78600.125 502897.8125 1190499.125 254335.6563 34197.5898 380050.9063 991328.8125 1978336.75 699088.5 2563966.75 3263013 3865520.75 115451.2031 5859441 1663794.25 708918.1875 1193045.125 3588098.75 695907.0625 1052878.5 815639.0625 2511792.25 572988.6875 6125583.5 2657238.25 71891.1875 1831712.25 325057.375 95023.5313 497096.4063 92797.7188 857124.3125 2315101.75 105621.9063 2765207.25 980126.375 2875857.75 3766605.75 1852102.75 1275055.875 1856418.25 775047.625 201599.875 766513.5 334516.7188 2219545 1170616.625 1035338.188 295291.3125 1062320.875 1251426.875 217142.8594 447864 591161.875 278731.9688 683969.3125 1174908 162752.1094 5541235 627157.25 3057368.25 4398718.5 163094.5469 4052237.25 615729.6875 451945.25 802258.75 4382391 909532.0625 520391.4688 1255928.25 2003110.25 292823.875 7211523.5 623596.9375 1315283.125 134439.5781 4651053 70618.6094 467161.6563 136978.8438 2261570.75 743584.6875 2401807.25 101823.5859 368410.2188 1197088.25 874595.5625 553542.9375 1526410.25 1155026.375 2006151.625 784079.5 328900.625 5764286.5 5508506.5 56669.9883 131175.6875 8321665 1627695.125 3157940.25 2502177.75 699088.5 377461.5 3718416 8578645 904741.6875 663159.875 1324296.875 831540.25 159027.8594 304717.9063 871643.3125 1544451.125 501132.7188 1398804.875 483656.5938 3087148.75 1772641.625 1056122.875 2289981.5 47852.5313 673798.3125 1289696.625 1727434.625 851287.125 2736001 1327337.375 82521.1406 432764.2188 7381783 164098.6406 137249.4531 8016860 865248.3125 898060.125 467466.3125 551268.3125 1643507.125 195209.0156 901205.6875 3262423 654592.375 739178.5625 367644.4375 199844.8125 114736.8047 204202.5781 2948796.5 1340298.25 3068328 1909589.375 198931.6563 699274.9375 723757.1875 187592.5625 1016372.688 8042436.5 6389043 295463.75 5575201.5 1091731.125 262274.625 2631565.5 2138821
suberoylcarnitine (C8-DC) 443711.9063 229428.9219 310658.125 800775.0625 156140.2031 378418.1875 206969.4375 159938.4531 139752.6406 7277908.5 316607.8438 665586.6875 300497.5313 89649.9766 169224.9063 397781.5625 339789.1875 407530.4688 343825.2188 288818.9688 1808727.25 925268.9375 234538.2031 1684221.375 209050.2188 1847891 659872.0625 432173.125 494984.75 296355.625 394195.4688 115623.7031 2079262.25 465949.4063 113771.5469 147122.875 193037.2031 416684.7188 236082.2344 225369.7813 278746.125 446831.1563 154951.2656 173381.0156 391105.5938 123289.4219 332532.6875 130050.3125 383733.4688 227710.3281 35367228 13871626 1864184.625 11482970 99870112 11101907 84423.9922 3713954.5 683918.9375 25339774 31961476 2470301.5 10362490 3436590.5 153483088 1468668.375 8775375 1521942.125 7110495 6494985.5 16380362 1530439.25 1185349.75 1200976.875 65398368 8339597 1829349.125 5404824 3473228.75 33789692 9286084 14658720 10262366 16402577 2308488.75 3334424.5 688311.1875 14057350 4230951.5 678905.375 3280917.5 426454.9063 7903551.5 15287901 12799888 11574822 32112346 32308824 30884556 1756250.375 1301233.875 3813392 41100852 2632003 2287983.25 12723306 2023982 2168803.75 1740910.75 2036213.25 12985539 98556472 9747286 1080650.625 2539825.75 5487932 12724501 56079612 3698727 4017009.75 9490459 107657632 620664.875 11937004 3244572.5 3946794.5 2610965.5 13198760 9372846 51779540 3578598.75 11916015 1377055.375 7548085.5 1953091.375 1454274.125 7256177.5 2775381 1893703.5 107311184 7955481.5 5212976 12048538 2561759.75 1373364.875 612864.9375 1946901.625 1732517.125 12851594 2343801.5 7461020.5 5573723.5 3564098.5 31530840 32457840 9880345 3508847.75 2659330.25 8144446.5 2882558.5 1143869.875 1457783.625 2753826.5 1827553 48653228 1883158.875 8381408 6497658.5 8077355 1238338.75 2187223.25 6667663 17915760 14880507 430708.125 4077408 17715968 2738211 618896.75 4141664 2076753.875 7981734.5 4094904.25 15268987 14912035 3816181.25 13230612 4337130 24761584 24778942 6612317.5 11261430 866471 8889500 16795882 61371800 1466974.5 35270036 13275402 443101.625 80353224 721875 11044995 6128840.5 278402.2188 1360329.5 3171107.75 1438996.125 34264284 11763265 7514701 2938431.25 912484.4375 46880628 19812542 2384796 2422808.25 9496579 5775839.5 5198838.5 1472815.125 2211939 64560940 12705342 6565176.5 1097944.25 3886909 21477146 5847904 5144638 2883408.25 13242578 2927589.75 32845678 86191752 7272391.5 7888287 80541880 84179152 1046913.125 6885353.5 17358376 17783250 10483051 8503091 6222534.5 45255916 15159916 15631330 26653784 735988.875 41653040 100796784 43863868 2549250.25 13186613 7244257 9341709 732928.3125 17865786 22642292 2894953.75 415457.9688 28485010 6405108 2793898.25 18557480 25846074 25022988 3505262.75 8014297 2557364.5 87595168 1835273.125 4919827.5 1571770.375 8720532 3946794.5 2179061.25 1116254 668407.375 7192446 4667988 31897744 8464931 29590750 44000912 3705421 41568060 21399300 1717678.625 1627335 4398600 12887703 1166512.625 6143781.5 2535358.75 3755165.5 58372896 33201028
azeloylcarnitine (C9-DC) 248185.125 341714.2813 101393.4844 174072.2344 32157.9004 67905.8828 70324.7344 194505.0469 47235.3633 33247.2617 3413947.25 632650.4375 351534.9375 1266632.75 3162799.25 2604138 102268.3828 49323.5078 5136173 1199594 170674.9531 603163.125 730456.6875 19209756 55040.5352 3008064.5 197841.5469 736701.75 421986.5313 1591157 172363.375 207371.8906 77098.0547 8243668 3216198.25 239817.0938 350609.375 382093.9375 3210068 1473201 1630512.75 1586241.875 1468555.5 117201.0469 280520.2188 64314.6328 1360059.625 418471.3125 140291.2969 311281.9063 7297029 4516351.5 1182535.5 2183045 2475371.25 3828160.75 5928119.5 59215.2852 834817.75 704690.125 3087270.75 107694.0938 270869.0938 1661515.875 900394.125 84318.3906 218246.7188 376286.3438 516896.1875 6551208 911840.8125 167146.1406 625543.1875 837777.6875 1677264.125 3179315.25 501088.625 972703.625 397978.5 27972208 223421.0781 2721218.25 2014316.5 225519.6406 275077.9688 1019363.438 5871462 4835142.5 358748.4688 3533337.5 419258.875 1833097.5 546115.625 106495.1406 319149.2188 12842691 712461.0625 74962.7031 1067065.75 1535070.75 69698.1875 663517.4375 555834.6875 1906881.375 173293.1094 802877.875 892060 270124.8438 2055376.875 8330750 1354418.375 273976.875 1169789.625 99579.1328 244957.1875 244143.9688 483587.7813 105695.0469 17887306 309887.8125 1612389.375 329443.5625 641910.375 446778.8125 229059.9688 373139.0625 2360421 746382.875 248202.3281 2482031 144404.375 53262.8555 351052.8125 326802.0313 3487766.25 442909.3125 9182724 1625157.75 117541.5469 1527643.875 517246.4375 1810569.125 2075353.125 491935.875 1430140.75 44380.9805 874333.4375 1086904.5 11335504 127829.3203 4048950.75 4087686.25 14974263 56104.1367 861127.9375 1158816.375 50061.3633 235024.5938 145457.6719 2257711.25 759155 1059090.875 672729 93066.4453 4720070.5 1400083.75 412716.1875 568505.3125 2598484.25 926277.6875 699689.0625 640834.125 112708.2031 16423323 3671582 1033236.75 374865.8125 3673584 307186.0625 237787.6875 759504.5625 1343313.125 239368.4844 4146475.75 5223376 1239498.75 391446.4063 7926667.5 14316493 49690.2383 1062895 1541713.25 2612396 1732028.625 649658.5625 409001.6563 3117784.75 1609123.625 2569413 6308097.5 728387.3125 821448.25 7174136 7787078 287916.9688 1678462.25 2245292 1649475.125 670321.0625 1766187.875 284462.9688 2432964.25 514967.1563 137119.0781 492913.5313 4947586 1316477.5 333792.2813 2211854.75 12083290 75093.3906 194296.3906 177864.8906 1166066.125 346886.3438 186645.2188 360236.1563 720599 4689008.5 500182.5625 1414593.5 2736112 362613.375 1189480.25 932087.125 156677.5781 259122.2969 107504.1094 1847472 47017.0547 1180832.75 481557.5 4090855.75 2050849.125
thioproline 8818631 10772908 7936200 7820767.5 5715709.5 7797730.5 7920973 9708479 6777335 6871073 6782325 7836109.5 6052904.5 5753356 6156299 6623128.5 6429051.5 7449382.5 5213725.5 6547104.5 5231284.5 5326222.5 4919195 12527759 6166596 7998658.5 11124645 6785842.5 10876826 10367987 8389421 6454892 9540361 9231740 8680417 11710199 13394297 9136082 5120581.5 6210001.5 6559887 6588800 5280043.5 10474311 7815975.5 8789981 9313234 6506873 7942182.5 9753652 6939153.5 8671965 9614484 8371418 6139680.5 5386714.5 6283572 8256476 5811322 7169968.5 8886238 8377771 6068426.5 4434462.5 7494962 5104189 5026455 5114960.5 4975761.5 5220250.5 9411750 5760421.5 6754483.5 7379246 10943376 6737989 12965358 5926085 3838835.25 7715251.5 5970596.5 12946687 5898509.5 5564038 6457084 3476902 4524593.5 5114793.5 3675521 3979463.75 3091466.5 4370350 3471974.25 5991809.5 5953242 13200279 7216010 9878703 3756414.25 2771997.5 4443600 7341319 4524487.5 4662050 3082382.5 4457379 4856275 6154057 5195566.5 3528398.75 7464539 5978372 5963584 3543404.75 4844706.5 7194956 3817168.25 7093998 6272026.5 7096855 9785912 5689599 4870516.5 12498274 5274668.5 6419890.5 4581712.5 6584142.5 4492131.5 5549749 10146420 5152359 6687326 4754754.5 8353686 3720314.75 5075722.5 5883446 5137309.5 5806463 6291459 4763871 9931326 3985519 3935970.25 8676524 5120583 3754724.5 6293272.5 5736909 4002630 3986559 6833927.5 3893181 7366182 4546198 10347091 6446355 5980981 5271584 4853875.5 5783220 7327964.5 5768604 4812509 6272026.5 4532910.5 7547296 5513532.5 4950676 3706913.25 6191384.5 5644549.5 11796148 8588551 7922600.5 9149570 5914169.5 7821915.5 8517507 5050721.5 12016923 5054402 9960219 5722818.5 6945354.5 5135544 2625728 17333090 6981521 5215146.5 6637674 4905056.5 8248360.5 4773489.5 3478392.75 3561082.25 10454716 5449740.5 5660179 9740850 3828049.25 7057654 7669438.5 7047540 4396014.5 3820501 4852328 4975337 4961282.5 4091610.25 6777407 4130737.75 5129347.5 6320234 4195182.5 6102832 5988490.5 5218892 4647876.5 6614685 5539025.5 6731977 5805354.5 8121685.5 8536194 8345509.5 6528747.5 7142709.5 6101269 6756261 3349343.5 4832172 12516861 7820633.5 7221412 8697690 5046445 7608868.5 8289819.5 5937781 10085115 2611833.5 6639778 8852793 10237099 4572438.5 8530288 3073398.75 7107902.5 3339632.25 7317160 5597064.5 6272829 9129142 3505457.25 8178803.5 6550449.5 6155276 8762439 8731846 6256728.5 5711748 7863786.5 5504252.5 3121069.5 7916415 7151770 8232420 4826398.5 6271224 6622394 4621915 3960466.75 6349102 3776248.25 6916486.5 7938905.5 6513008.5 4961529.5 10361652 4910636.5 6100623.5 4907626 8121752 12073373 10375417 9322499 4409772.5 9950423 11187402 8172221 3355594.25 8417196 4787658.5 2740731 8055951 5091651 4563127 9906930
2-methylserine 7362569.5 5221457 11206318 4085573 4701647.5 7109074.5 6615157.5 5687487 13354110 6212083.5 5660154.5 5285508.5 5279982 4042093.5 5208695.5 3103291.75 5976133 9100821 6395833 9357572 5382249.5 2097605 8637585 6870671 9044429 12941178 6860091.5 7718714 8928672 6224718.5 10339376 12631560 7767189.5 10154870 16547949 14966298 12722081 11492410 10608555 15072605 21557856 19537034 12951440 10884817 20795192 16936798 9778171 8066015.5 15050126 6884171 34574768 35745456 28907876 38070236 25269360 27812734 37786856 39634536 27709134 25917878 25477012 30486364 29060802 30067632 23404568 36624436 26532744 22798522 20251784 28816904 27474048 32119722 33580148 20630346 17147328 37979964 37178948 22838220 18785454 29994284 29153426 26899328 43836628 28325018 22944766 22809208 28573670 19647396 22490260 30908714 20323438 26414726 33058852 15251088 24120448 29463878 22373452 21727100 18429830 23356170 31306228 24263614 25375980 19424504 25279066 24642334 29062112 34674348 21894822 31999080 21853150 29557948 32876464 24666322 22003498 20043732 25633226 33912788 22435080 35143688 25289216 25556542 30939190 34762408 30482256 35372620 20410278 25791862 33715580 18874066 34746412 37048652 33967552 30290148 26993134 37867356 37034792 37517760 30683420 35812820 38130640 78757808 28043496 31765320 48382924 19620824 36081472 22316222 23991660 26323344 30311310 26142874 28628252 17375334 24296970 23949240 31043478 23542602 36963108 25202062 30679892 25072880 31989988 50273980 54422908 28117582 28241574 33698644 31269726 11381523 31182230 35093168 26694414 30467660 47411812 37934836 19326172 32496282 34981460 37576656 27860724 26978470 26117182 31839762 12960136 14513826 37343904 21093534 12811260 9350704 12603266 10458665 10293691 12674189 10734255 14645273 17672228 29094918 12314692 14738067 9383792 25950196 23533916 15726722 12012908 24241698 21301136 24746506 26287046 37726324 50665400 43484644 22242780 19136038 28252716 8490344 25516776 40764148 10122310 31963060 27056046 15109811 19830038 36601596 32359898 19167580 22166480 26418322 31030908 40538584 19842116 80922728 49598624 30334894 29268572 38924468 21817786 45307600 13360068 35180888 16282236 32053696 45640724 19799550 33514382 24829716 21502128 20600592 27891282 24323386 30090122 27447108 42032352 19774586 13762588 30881798 49787368 85133872 23278758 27645664 29126558 25053230 22229076 25088162 23965998 29235224 23258168 13950403 18404604 28966180 23424180 29254998 23507704 50089112 34488960 29871814 35951692 46617416 26583170 27687884 34663004 27139396 59520248 23179422 29802734 24364972 28512306 28852794 37150200 35088484 33821992 38900648 31166438 32942968 33848968 22266404 26226546
(S)-3-hydroxybutyrylcarnitine 492455.4375 817417.1875 247074.625 1138126.375 207487.9219 3291341.25 253431.0938 791500.875 233438.7813 1996269.25 427894.5938 1897717.875 410196.5938 1097845.75 262457.3438 2512238.25 374444.5313 1300085.875 499759.6875 306914.0938 1317389.125 1819304.875 682236.625 811529.5625 365355.3438 1119917.125 1035686.625 456788.7813 1739912.375 540992.1875 200108.4844 1445434 439741 613478.0625 324804.0625 573005.9375 1565103.125 220287.7969 706123.8125 198550.8594 1268171 309153.7813 1266389.125 197732.1875 1928932.375 209205.125 1522439.875 354795.2188 20354454 17272622 848221.1875 5118722.5 10537541 6505297.5 133511.7656 2392606.75 467378.4063 3556500.5 6330132.5 3592133.5 10030751 1938104.375 16481706 1364280.875 3242064.25 396502.125 14746019 2884517 4363447 992288.25 2000146.5 1839349.5 19540966 11012698 896914.5625 2511771 11165813 12438912 8406277 40381784 6875246 18889644 1138096.625 3720047.75 758858.3125 12428714 3447979.75 1108452.5 5395720.5 816765.25 142806384 6788401 2984166 10208887 5563677.5 13749219 4844199 776958.1875 1457536.25 2318878 6075792 3279546.5 1139361.125 6468091.5 3551327.5 1298261.75 586289.625 3480471.75 2466594.75 9727121 2633259.75 3279325.5 1858840.125 10378184 3733668.25 51519984 10858386 4241364 4093177.75 37888416 286407.3125 8376159 2113554.25 11715620 3763563.75 2646932.5 3526081.5 10682787 2115167 1260312.625 2410789.75 19105106 2429548.25 2818176.5 9330829 2626590.25 942377.125 58854436 1816215.5 6021394 18432922 3323982 1023920.625 300683.4688 2981244.75 1442550.75 9684102 2905588.25 1776047.125 11783937 3826365 8722309 37912044 4385483.5 8638907 3672746 6409594 686907.3125 1420075.75 2040184.5 2061546 2459823 6291529 2803152.75 13116073 7971070.5 10573990 2384771.75 5481322 2380448.75 12604679 3975291.25 367140.4063 996283.125 10455340 4265431 1037723.375 2863445.75 2106423.75 3357247.75 2773889.5 38657860 13663759 1213452.5 2983280.5 2887861.75 20916752 3543847.75 8976199 5103564 2372174.75 7009381.5 6487940 11444137 1853136.375 11402998 3161769.5 2254111 8041503 895361.8125 7721694.5 6589288 1095462.5 2760012.5 3483783.5 9407527 17272390 12816570 722498.3125 7562037 20047796 5119870.5 2855062 1856360.125 15613711 5138541.5 8047807 801719 2828371.25 34730416 18853458 5292832 1737960.125 2938896.25 8039920.5 2395769.25 3006276.5 2634164 30350668 3423211.75 24334054 20181956 1870089.625 4761367 30677998 3893515.75 924802.0625 2012504.375 5261023 4834062 1647768.75 2707590.5 3877048.75 16479942 4072007 1112130.375 2489294 98538.6797 7855462 3541610 2056343.25 3843637.5 31993616 4364946 1346938.5 432012.0625 3009565.5 415047808 3162604.5 586501.375 54982552 3666935.5 2987202.25 1937339.875 5590014.5 13613825 2346692.5 15038352 2372283.5 33537060 3352773.75 2276136.5 1801965.75 2881172.25 2674595 574547 3565611.25 652380.3125 1734259.75 2393286 1842129.375 4918730 5852969 4255533 610373.8125 10187931 4127078.75 1220184.125 847268.625 2144675.75 2110959.75 1516974.25 1708360.875 4482978.5 2643466.5 5058441 12633340
methylsuccinoylcarnitine 118634.1484 265607.4688 178360.1406 154066.0469 355313.1563 412917.4688 89143.9219 87248.7266 233014.5938 69345.1797 55105.3633 103367.9063 59330.1484 100168.8516 611064.625 175393.0781 280125.4375 127863.7031 109989.0625 62423.8633 150705.2813 83557.3203 128265 166628.9531 311237.4688 225391.6563 77507.8672 123451.3828 353440.5938 185166.25 41901.9844 362950.6875 148778.2656 298971.2813 249490.7031 219405.0625 126707.1094 66797.4766 5564121.5 620687.25 167790.25 345062 2944060 867708.3125 65280.1016 76021.3984 4231344 919630.4375 1328847 29373.1895 7071551 905359.625 369872.375 92015.9844 984244.8125 28629.7051 99068.0781 12829929 200664.0156 62998.7031 108009.1875 1455389.5 928440.75 287198.1563 1015683.938 597962.75 78082.5156 1794865.75 43204.0859 53647.9922 1326017.625 975013.875 222980.9844 3206495.75 3871572 914839.0625 190112.0313 561341.3125 87056.6641 787621.125 94885.2891 231144.8594 93600.7031 183454.3906 118844.1094 148810.0313 948572 50444.8086 572357.25 5623198.5 65102.4922 609806.875 131652.7188 60893.5391 235169.3281 472032.125 3857529.75 15209835 128911.2188 527921.75 112474.0781 3633486.25 440795.9063 75387.1172 785062 152510.1406 355066.375 303782.4063 4112970.5 374951.6875 224630.2031 95422.6406 88688.9063 4479991.5 392904 114221.3125 78299.1641 5103870 72962.8047 234227.625 91305.6406 96583.3438 3137241.25 182005.2031 8942429 210876.6875 654771.875 128092.7422 887536.3125 526623.1875 118419.6016 263849.25 191268.2031 133401.7344 6402336.5 60632.3828 2032737.625 2453834.5 20824410 1765270.5 111321.6094 53056.9375 4308063 226534.3906 266029.6563 461879.1563 327173.3125 78188.0313 1502520.125 653959 84408.4297 3568907 6786675 892496.0625 167357.2344 617406.9375 712980.6875 532330.875 814410.6875 180143.7344 1453320.375 525159.3125 749844.6875 1970945.625 7364870.5 1286088 587193 419394.9375 569946.375 245081.4375 510418.5938 633125.5 587956.6875 6241775.5 45292.7344 435230.0938 49168012 8185173 163361.9063 1330970.625 797329.625 32946718 1780619.625 473382.125 381904.4375 55151.4883 586046.375 928668.625 360264.8438 658761.3125 1351358.125 964323.9375 91956.0938 39353.1055 239537.9844 1003742.688 5184859.5 686193.1875 1023996.563 1577297.25 200676.4063 339207.0313 136875.7031 3365903.75 2663944.5 336683.4063 112557.4297 6761992 3186224.25
pimeloylcarnitine/3-methyladipoylcarnitine (C7-DC) 65732.3516 219507.25 1227958.625 304864.4375 327051.75 413363.7188 92251.1172 212120.1875 468951.4375 972736.5625 331485.375 193587.625 665026.25 299832.4375 291519.7813 171941.0781 744757.6875 182394.5 147640.6563 1146299.125 802440.0625 508522.9375 759927.3125 457599 592675.875 482981.5313 279753.25 84990.0547 668743.4375 962401.125 212300.7188 1026750.188 855262.3125 440284.9688 175291.5 765615.9375 495681.875 372231.6875 856285.1875 876233.6875 774917.875 777455.1875 418174.25 455712.125 324587.4375 232437.7656 112022.4844 419445.1875 472015.0938 12439014 1443393.25 895407.125 4267708.5 3605324.25 5059527 845379.8125 314641.9063 602362.5625 8652313 2381476 423287.9063 1517739.375 873134.5 25002126 247440.1406 1490666.75 566664.6875 1365052.875 1030615.563 3061572 380204.5 385181.9375 20071074 1635298.625 503447.9375 438648.875 571404.0625 5072393.5 2653253.25 3013726.75 2180447.5 2006346.375 67982.9531 347777.3125 310927.25 2901063 525534.625 332010 576405.3125 154979.3125 2821453.5 3440353.75 2051657.25 2160625 1469168.5 6571011.5 2984833.25 309894.125 803266.5625 906657.8125 5352057 427382.7813 352637.25 2636652.5 914337.5 300651.2813 390403.6875 544783.8125 832506.0625 8668941 1045376.688 716942.3125 911729 1264939.25 2402912.75 7118157 464041.5625 723038.1875 1226612.875 26900336 350039.4375 1834921.375 397827.5938 661939.9375 384452.25 545655.6875 9374989 6009347 1038655.563 5749951 1725771.625 5650261 102194.2656 135990.2969 908781.9375 281744.1875 658397.125 35018996 2230022 403850.7188 1971702.875 1380569.75 325265.0938 193106.8281 797413.25 1414825.75 4330357 518979.125 1503987.625 1573167.5 463150.7188 2010051.875 23253254 1967523.25 264909.4688 794132.875 1955994.75 358798.8125 416197 474969.9063 785401.5625 282984.5313 7750335 913520.625 4793419 643895.6875 1064556.625 835299.75 216152.1563 591324.4375 6630894 725843.125 570979.375 612275.4375 2136238.5 149725.5 1006358.688 399603.9375 5967331 1627762 12790576 2917737 412151.7813 2288780.75 2120274.5 3564228.25 2915677.5 815506.3125 1774291.125 125460.5313 1794017.375 1380949.5 18859908 557595.625 9131947 9927722 362172.2188 17014582 190259.2656 1301994.375 1392472.75 502658.625 389448.6563 377967.7813 10288284 1310238.625 1984256 948662 652354.625 6975865 4127302 453659.7188 1199200.625 5666059.5 1210090.875 2133340.5 2048327.25 122097.4688 23603672 4824555.5 927049.5 447105.9375 1380381.625 6240126.5 1752678.25 1239767 1250346.375 2049435.875 559134.375 7314918.5 9652830 2935393.25 618372.375 7899043 12046425 2749355 5629184 1571526.625 3599278.75 2932495.75 746922.0625 5358541.5 1747328.375 3404518 26634022 1046126.313 2316460.5 32283314 20369352 270099.4375 2340996.5 4104639 3644871 240563.125 1225667.125 5849388.5 534847 142638.9063 3765428.5 1598780.5 273432.75 924587.4375 6213123 3914389.75 1064582.375 5812810 250899.0938 24424544 506590.4063 690124.625 440929.5938 5654697 983803.375 852882.875 274935.1875 265836 1063366.875 3435215 11597695 3768998.75 6629666.5 5291490.5 582675.5 2647965.5 2000881.25 436442.8125 4394917.5 224600.7031 10607234 271773.8438 1448868.375 718923.1875 355691.5625 20871110 3333201.5
2'-O-methylcytidine 636717.375 759012.125 1096593.75 877348.6875 700379.4375 1839644.625 681428.875 729311.0625 879298 1343505.375 759399.125 1189099 1541354.125 839073.1875 851805.0625 1401017.625 919960.6875 887068.6875 808508.875 906718.1875 654738.1875 1013906.25 863142.625 1045900.063 928316.625 1287730.75 1336576.125 794843.5625 1429111.375 845921.375 1201830.375 1058146.25 1210601.625 1145960.375 1762351.5 985246.375 906626.8125 1575430.875 1047507.063 1047268.313 1034649.438 842386.3125 1067539.625 1121994.75 1133418 897376.6875 1355671.375 975917.0625 893022.875 853490.9375 1728246.75 336243.8438 950410.875 1231908.875 926810.3125 636213.125 1363901.625 890545.875 854556.6875 1199230.375 1426403.25 446375.8125 890961.8125 548554.9375 954266.4375 1218961.875 703779.9375 1063346.75 2241633.5 798397.9375 1486221.25 1129571 1442992.375 903578.8125 1363861.75 1033967.813 1140088.5 1753244.5 1797755.875 686380 888684.9375 1857174.375 1420241 925214.375 1377837.75 1056529.25 1100792.625 973761.1875 1207806.375 855918.6875 731704.5 628022.5 764623.125 1026488.813 776133.6875 861388.1875 1438206.25 758773.5625 869704.6875 1048190.938 1115912.5 1547991.75 367915.3125 1036258.938 1513485.125 2428590 550776.375 1145304.75 1063797.125 1635710.25 1478004.25 828848.8125 983944.8125 2016016.625 1958721 1256648.625 1013696.625 801482.5625 2179669.75 1855197.625 3054656.5 999318.0625 1035981.313 918921.5 1594561.875 1756917.125 1240240.25 1096467.875 860055.875 1435324.125 1891541.875 534173.9375 731894.75 411195.5938 600775.625 594846.8125 587111.25 715260.5 751884.9375 832479.5 1264379.75 987049.4375 923869.75 1100745.25 676776.5625 2609305 1065931.125 1997458.125 1047409.625 488394.5625 1075010.25 1234664.625 1012871 1024395.5 604013.75 770634.9375 505070.8438 2361723.5 820758.9375 594968.3125 676766.9375 241971.4063 853121.625 696326.5 1999532.5 1313143.25 1269938.125 1995379.625 1594634.375 1218332.25 1819542.125 1147158.5 1117819.625 1156776.375 1346945.75 1799862.25 1176690.75 1079742.375 1204073.75 910954.6875 745572.375 935071.8125 567222.125 1768280.375 1267865.625 779070.5625 1367709 402039.5 971862.25 1112565.625 837092.5 689353.5625 1361540.125 1697621.25 779379.6875 1016869.313 1018851.563 1217540.75 541565.375 1028510.438 1682070.875 466159.875 951654.3125 1033235.25 689714.8125 681399.5625 1454435.25 800991.625 1414578.5 1667989 771181.0625 1325570.5 812300.375 935341.5625 659341.25 1476130.75 1200252.25 1978376.25 656340.625 1486836.125 255652.6094 1389055.25 622405.3125 998399.5 976268.75 984931.5625 959293.375 488362.3125 1024394.875 1494275 2186317.75 1720391.25 1776972.5 679734.1875 585878.375 1180331.75 853626.8125 801871.8125 1025279.563 713938.625 824306.6875 2420261.25 997661.4375 857352.6875 611129.75 435167.2188 1260775.625 974867.625 524259.25 1020145.188 686620.6875 538913.0625 714775.8125 1253654 1433339.375 428182.2813 671233.8125 1075234 1084178.375 992742.5 1473178.875 728665.125 1108265.5 633298.125 1277124.75 796364.125 628353.3125 852679.25 855862.9375 1423644.5 707463.6875 1352162.125 1012871 821616.875 1255648.375 1063248.875 991697.4375 1229429.375 1512681.25 917185.6875 905733 1012871 1040579.75 1731846.625 254098.9688 1022280.563 707181.25 823129.125 872454.6875 1521840 780683.625 977254 606684.0625 673062.125 1037317.75 1024806.875 1044336.313 450609.4063 759784.0625
gamma-glutamyl-alpha-lysine 4579432.5 2482203 5406168.5 4340615.5 1574453 6799498 3358479 2734844.25 4989454 2513721.75 4425957 4177532 4765741 1860223 2770624.5 4576618.5 2316696.25 3165833.75 2905172.75 4843248 2038604.875 5061427 3305133.75 4477807 2476487.25 3823140 4329688.5 1802309 2927935.75 3121951.25 2731481 2809331.25 4170484.75 5761928 5850916.5 2627792.25 4222399 8209167 3450607 2826767.5 2668233.25 3947661.25 2840634 3044845.75 5042654.5 4581982 4656167 2798870 2687691.5 3457172.25 5104063 8250677.5 1956995.25 3042882.75 5238919 1186678.5 3762779 4194887.5 1850969 5841073 3473222.5 1698280.375 3175241.25 1680001.375 1490029.25 2482827.25 5136273.5 1740180.875 2009648.875 1531121.25 8702191 1687656 1187074 904721.5625 2685516.25 3511959 1661486.375 2995829 962652.6875 2415570.5 1636276.5 5325724 2061026 1845735.5 1435542.875 1841781.375 1022595.563 2492304.75 1945838.25 1762205.125 3129703.5 1911318.875 4336629.5 2886483.75 2300222.5 2694568.5 7563227.5 4068636.25 2422627.75 590609.1875 731670.5 2337833.5 1948512.875 1927418.875 1391347.875 1523691.625 2011625.125 1033712.5 737143.8125 2189748.75 2629800.75 1651323.75 2396570.75 3158865.25 993741.375 1716676.625 1402871.75 2227356.75 2502584 3041036.75 25692330 3489192.5 1162073.75 5809060 3921426.5 4845358.5 695214.1875 1174699.125 1596476.5 4243111 3044025.75 2099043.25 2270446.5 4853186.5 2225823.25 1569628.5 1182836 1675366.75 2096024.875 1382321.125 1274816.75 2165174 59302748 2279619.5 1746083.375 1995850.25 2256322.25 3158491.5 1945805 1088295.5 1717454.375 1768001.875 625489.8125 1800001.5 4890180 1377773.125 5722088.5 4158342.5 1952550.875 2653813.75 1352662 696805.0625 2971206 3427879 2971771.5 2902245.5 2176030 2140736 1546620.375 1934138.125 5027941.5 3347865 9879175 2718470.75 3302632.25 2568867.75 6077644.5 3843203 1448871.375 2299385.25 2329781.75 1692458 2173053.75 1667303.125 7867816 2395771.25 1570937.75 2197613.25 3027557 2527084.75 1246123.125 3429617.25 535984.875 2614839.25 808651.4375 1609651.375 964991.9375 4192976.25 3811364.5 626947.6875 1708949.625 2252048.5 3442447 4400669 2576876.5 2180096.5 2048083.25 3890364.25 947506.9375 2218418 694891.25 3212124.25 1122955.25 1609752.75 1406330.875 1559701.125 1789726.625 4689611 2094174.5 1710304.75 1886836.75 1789233 2436941 2900424.5 1745171.625 2304889.5 2214093.75 1895446.125 1045725.125 3097672 1582906.125 9706368 3645959.5 11292403 5450982.5 1379270 5444402 6592259 1311227.75 6038244.5 1158574.625 2415570.5 2535723.75 1702738.75 1650776.5 1957081.75 1563895.625 16768273 4716695.5 2012174 1419600 4352084 2284457.5 1573080.75 4788102.5 4588588 2996798.5 1667397 2051647.875 2240596.25 6583160 4545465 2051374.875 4705979.5 2275818.75 1859044.5 3920866.75 1146021.375 3466870.75 1802735.625 1370580 2534061 3569938.25 1801040.25 1707581.875 1158644 2752286 1436565.25 4438562.5 7342182 6054516.5 1279156 1344735.75 2858534.5 1749615.25 2388931.5 4258683.5 1910093.25 3699833.75 3232155 1392610.375 1974656.875 13648017 3347503 4999238.5 1459343.75 4719634.5 2119701 2435370 794232.125
glycerophosphoserine* 55759.9922 45311.1094 54641.3555 50768.4453 61614.4102 67013.2891 243778.5313 801584.75 63589.7617 45827.8164 361069.4688 111483.5156 42925.0039 334722.7188 292483.375 65749.9766 1371939.625 370824.6563 247528.8906 164347.8281 98137.1641 354552.3438 59639.3047 187969.6406 590731.5 188368.0625 64371.4922 147605.9375 363151.4063 179523.5469 358100.8438 171713.3438 241206.5625 152872.625 230580.7031 75624.3438 382314.0938 63555.9688 34012.9023 134818.0938 606623.125 260185.1406 312659.9063 183274.7969 862051.1875 461500.25 557422.9375 42731.125 51289.2695 276993.7188 131621.7969 54069.3516 176889.3281 114951.0625 63827.2188 80227.5859 92118.9766 66888.3281 183614.5313 2427210.25 123920.9766 116660.3828 437287 424465.3438 327404.2813 195952.375 124776.5234 136302.3906 96980.125 234207.4375 340480.3125 85413.3359 413295.7188 176536.9375 64200.375 208064.5938 64926.8633 729081.375 71311.2813 163482.3438 1041547.563 475033.875 45563.3125 44393.0859 222647.6406 142444.4688 71573.8984 417513.75 44290.4531 244548.8594 1081207.5 55200.8125 971035.25 533310.6875 143875.2969 63190.1406 130544.9922 154537.1094 99666.3438 283637.1875 194835.3594 72208 101019.7031 295550.75 79146.6484 88598.0078 470733.3438 57562.3945 187426.1719 89870.8672 69866.3594 365390.9375 82290.0625 468749.0625 317694.4375 125522.9844 96430.5234 588753 196217.4531 132087.5156 179747.7656 116189.3594 444162.2813 146522.6406 275326.875 207535.3281 886680.375 69534.3047 353227.8438 64243.6406 630065 256368.8281 164680.1875 167835.8438 84401.2578 192914.9844 301827.9063 432400.6563 200875.8906 142334.875 164433.1406 110689.3984 895331.8125 154336.875 368025.5938 86657.0234 228223.0625 850920.625 589898.0625 84658.6875 128665.6172 75248.1563 56785.4063 81286.7891 240887.25 441666.2813 96438.0703 100947.25 160246.375 170318.5625 155276.6719 63068.9844 140465.2344 68975.7344 70977.0156 129127.2422 153895.375 85943.3828 134712.2656 90691.9375 153384 99452.0234 78967.5547 810253.5 423314.5625 67708.0313 60922.1328 775206.1875 287474.625 68032.9219 88907.5625 402707.5938 71043.625 218327.9688 168114.2031 57809.5508 73395.8203 129013.3438 119078.5 252006.7344 200094.9219 286936.5313 88679.8906 142865.75 69056.3516 89767.2266 78088.1172 191910.875 93509.3359
"N,N,N-trimethyl-5-aminovalerate" 9462738 11353900 14544362 8725050 12536553 13322198 12725455 15578423 7839102 48536220 13091817 29431454 14120438 5308952 8351969.5 11580432 11969996 15397061 9649994 9306958 15563112 19060618 21299702 18536578 13591520 12064224 33142218 8818665 25807842 4793529.5 7827845.5 15335730 13128977 18490730 7742206 24145290 20850012 27569870 9561602 16052840 11467857 11092921 5638283.5 11307163 63186640 12967213 11207347 10532502 18447418 12870100 15909945 11155236 8073382 11428156 18961596 15694889 16113260 10407293 3134443.25 3298874.75 13311837 9350922 35328208 6650620 37791220 23145748 10641529 5261936.5 18197030 15896946 26851562 3899807.25 11151636 4794448.5 37957852 14046226 6937555.5 3156128.25 10805201 14872273 21373992 29809792 15238854 23953224 14239310 8209230.5 6914434 19137726 5600493 10818203 7432393 8344257 72765424 9795523 15389178 12613642 15848435 15134808 6041157 8949819 3291247 6920859 18186452 5917885.5 7417317.5 13098207 4798532.5 3654425.25 6799685 6695089 27927802 16749784 3584831.75 25463444 7869861 12997062 26210340 47134656 11232014 7124249 22017902 48398748 4270426 14484078 3358586 57330092 15079343 6545627 7635923 19057074 6007684 28507916 10472827 49871280 5001276.5 12013832 8097455 7382805 3676070.75 49946040 7332842.5 5302149 28128572 8354649.5 8924811 7984487.5 4218176.5 6116642 19246826 13296727 5614845.5 14647922 21455530 12114190 50606436 12977740 10813352 8433933 14692711 4546020 6579171 7488153.5 4123986 7179487.5 30984100 10287117 19638830 10510030 11123005 10699532 10823496 7927159.5 12432297 11102331 15784984 5482859 17381472 6080952.5 7707805 6772172 6318565 19095784 10697773 76550400 47133332 6725671 4966556.5 9455685 14058450 17685874 14565605 18872040 10439351 9261938 13442446 42367932 7141856 28555060 11485456 17513936 26157952 6516251.5 22170970 11103415 7439933 5520273.5 12530894 13199221 36283756 27630836 35090584 3101492.5 9843624 23477302 14183803 10982282 5739156 43093404 18027644 7508064.5 12929005 13562438 24626808 24625298 4796196.5 14375552 6595632.5 22099388 7846717 21084950 11142137 23013908 5761762.5 12647422 15466742 7406090 12629492 37193364 14262161 10078645 13277699 19915110 12035590 4959869.5 9306329 16180246 15017863 14298049 7115271.5 20685708 3771351.75 18308036 24563036 19936366 9267710 26441604 13144711 26838856 12374728 18291378 150149664 5135194.5 14818368 80528024 12530894 9395827 11488471 16756367 18499300 10314099 33858012 6993734.5 39876876 8731331 8461132 10489698 20065992 7564918.5 6487504.5 16164282 23604666 16829590 10837323 11669691 18878096 18367914 30171880 6497768.5 12215931 5839722 4653777 12477415 19681974 14464411 6906786.5 22066046 12876810 6842403.5 40841584 54206632
butenoylcarnitine (C4:1) 130523.4609 43004.4844 70021.7734 967158.625 388721.375 684923.9375 893989.3125 1586922.625 128385.8438 242259.2969 360504.3438 108632.0234 1532565.5 1629816.25 354398.625 620391.6875 44247.125 144318.8906 40420.0664 515282.375 1485128.75 377173.9063 560475.4375 905467 405403.5313 551904.6875 4908379.5 1866260.125 478944.875 500712.75 338839.125 347374.25 146202.3906 1624067.25 607906.6875 140921.1719 240490.2813 874038.6875 504396 826869.1875 541171.9375 151781.7188 217231.25 79070.4141 64931.5234 259983.0156 155196.1875 143664.0625 183275.0156 357145.75 1135450.75 842886.0625 1537143.125 339136.5 208587.2031 452417.25 406053.4688 126038.7891 132337.8594 1569967.75 384625.375 2226127.5 496937.0625 267226.3125 536130.125 47372.8984 1587544.25 466804.8125 488733.0625 185922.4219 548081.25 74559.8906 426043.0313 406453.625 672056.25 944652.375 232327.4844 65294.6953 121053.9531 121379.125 337867.6875 2503622 350956.1875 339136.5 125519.5703 340210.875 3089829.75 1216732 468594.375 124809.9063 49144.8711 133635.6719 415574.9063 2078082.25 1392671.875 50831.1445 363242.0313 285541.4063 1241071.625 160041.6094 243545.9063 168444.4219 499909.75 1877082.125 318898.9688 2167628.5 346673.6563 113895.7813 338829.7188 188280.4531 289291.8438 480785.25 864392.75 181592.9531 1629113.5 128936.0703 68989.125 4312705 323880.875 566643.5 108690.6641 207799.0313 35353.1602 865904.75 106372.8828 339443.2813 498639.1875 109501.5625 1982284 1335529.5 112376.4766 73333.1484 329370.3438 72708.8281 514764.375 171270.9375 70265.8125 306060.5938 156130.75 1298378.625 188203.0156 209741.2344 1428883.625 349113.5938 366682.7188 168499.3594 25693614 4163223.5 168448.4844 303034.25 165589 339805.3125 450229.375 74832.3359 266605.6563 194958 1370261.25 189920.8281 83631.4844 71362.6797 63105.957 64190.1289 284426.75 96901.625 137145.0625 1161239.75 65891.4297 578360.375 108898.7109 116790.1797 314366.3438 437290 820471.9375 303095.1563
2-furoylcarnitine 112481.375 202365.6406 27223.1738 108127.0078 225963.7969 108508.3984 43159.4141 38502.1133 100049.5469 70105.6875 135387.0156 83470.9531 75333.4688 626364.5625 59707.5977 84501.9609 255302.4063 282566.25 295447.7813 351811.25 435235.125 408024.2813 106230.9531 104008 127054.0625 259455.5625 84705.375 2279719.5 264282.125 245631.125 1063357.125 436786.125 152101.5 366410.0938 50289.9258 185532.7031 63905.3711 191676.6563 106566.0469 42988.6094 223082.7969 152101.5 475748.375 180562.2969 57907.9063 133142.2031 410176.3125 71924.8438 105707.9141 413341.2188 490273.25 82287.7031 54803.2422 336129.7813 187936.7969 194667.3906 64130.7539 342538.5625 429994.3125 156845.8438 2601365 538530.5 81201.6797 270494.75 179107 123640.7031 56279.1875 41082.4805 45175.3281 603233.625 57242.4688 66613.0156 103118.8203 258926.75
3-hydroxystachydrine* 3678318.75 172932.875 33414700 818517.6875 17030100 3643023 545955.25 526800.3125 21573508 146938.7188 24945904 594679.6875 952464 601254.875 41499348 2437659.75 6485863 646520.625 1538909.125 3731946 46965932 2561580 981106 11569020 27106096 119326.6797 7490380 2142504 18088094 39857328 2428863.75 8399824 34777172 1210601.625 5099253 92667480 42390500 12688300 146568416 1911112.875 15190771 240843440 1083355.125 35538292 566572.0625 5478065 2036527.375 8598166 552640.875 2757267.25 18302452 2968022 15091909 375164.3438 2099891.25 114551.0625 66900440 318401.3438 25454178 3393010.5 2571520 3190015.5 35792932 471330.875 366179.3438 750916.1875 31615726 336427.5313 988975.1875 137394.9844 33296008 521291.4375 481558.8438 86856.9375 148841.5938 1552927.75 190038.8125 976977.9375 6668965.5 80855.5 495439.6563 432015.9688 45967176 199563.8125 23566912 751041.625 4522295.5 4354351.5 1287204.625 5987562.5 4532076.5 28383366 1200083 20313534 1085972.125 1275769.25 5253219.5 1950379.875 4838347.5 90833120 4451004 1215761.75 6022627.5 205288.0625 5842507.5 70628440 2817037 32296842 61623.1875 4815830 20040066 101480.0156 528673.8125 10463777 6387027 23041374 211833.2656 14035266 4890538.5 159652.0469 664963.1875 1289425.875 33101254 217824.625 307715.5938 2789813.5 525870.6875 1675516.5 1248663.5 794598.1875 18420386 1540233.625 1254464.25 4257761.5 2134776.25 1733228.625 21842284 639551.75 11329858 2043391.125 297396.4063 59797736 219699.3906 464799.4375 201818.0938 272620.3438 2104724.5 7524040.5 398753.0625 493866.1563 43303508 579320.6875 756439.0625 2493926.25 855201.125 4488185.5 2338022 11905739 949036.25 750809.3125 1628394.25 67020.6641 13128087 7504590 2750127.25 8687178 414124224 10427256 2581460.25 25908248 8995528 6530540.5 5802822.5 151431.75 6098797 4654179 111298304 977672 22071874 401790.3125 1479312 160477952 135046.6094 3196271 1160120 14146582 9992184 2685361 355954.4688 590442.1875 2457678.75 2720370.75 73644232 466137312 1887433.5 34398784 97909.75 56970040 381044.9688 119963.0078 461153.5 1490014.875 43965744 8351954 29576408 1457634.125 690267.4375 2899581.5 1501033.75 45425576 11788091 9208975 14195156 12051757 13657024 27092954 408287.2188 3912146.75 591537 1838177.5 2274278 2069091.875 10897558 16725796 1277089 2240823.5 32867544 1630698.875 30813662 28638420 1634756.25 300806.2813 1053736.75 564259.8125 2338713.25 16358064 804305.6875 717846.5625 174074.25 16395182 113853.2969 460954.125 3224278.75 1398275.125 3865469.75 471280.3438 6246976 11041565 18683286 2884049.25 35823364 140750336 96392.5547 3466357.5 686509.1875 2496205.25 52381.6172 12117056 13748437 7300913 1594696.625 701895.6875 27417676
hydroxyasparagine** 1084317.875 818605 963078.3125 1231327.875 871535.125 1641060.375 744759.0625 1150861 1182318 2947042.5 1211037.375 1293280 994303.875 1064999.375 760106.25 1213429.75 1168809.25 1259168.375 1157790.25 1895833.5 1143129.75 1639083 1795943.25 1088246.125 2124035.25 1045042.938 2033469 1022201.813 1650916.125 1788135.625 1185895 792456.8125 2647104.75 1559153.5 1532088.875 916700.3125 1646612.25 2336075.75 1039583.688 1085519.5 1055354.875 2161678.75 1062498.375 1166855.5 2056967.5 1607472.375 2241780.25 1317626.375 1378115.75 1281337.125 7407971 4247075.5 1925091.125 4002576.5 8164758 7088813 808412.3125 932539.3125 597678.375 7335039.5 2826779.25 1002086.188 6716309 1202806.375 9376160 722652 4949367 829998.3125 3692504.5 1489362 4680661.5 932682.9375 1262675.875 965273.8125 10365728 3405494.5 817287.5625 2137658 2307779.25 4287380 6290301 6971796 6068122 4603706 1135448.625 1765042.25 680287.4375 4243220.5 841200.9375 760518.9375 1460442.5 500954.0313 2767766.5 5035011 2688247.25 3210273.5 7427975.5 9985498 4430103 623071.5625 1272525.75 2112227.25 4848555.5 1570834.875 616194 4330147.5 1351814.875 583788.25 940336.5 983982.5 2572276 6165886.5 2305665.5 1859542.125 1073178 2090581.5 2228623 4140582 1055201.375 1875313 4227425 11546001 748901.25 6981188.5 3469888.5 2070668.375 1058049.75 4036149 4763545 6508717.5 1403535.875 11646893 1488074.625 4284030.5 810360.0625 672120.1875 2150323.5 1182938.375 1119590 8409133 2086466.375 1068557.75 3435370.25 4053862 843406.3125 1059840.5 1299251.125 1399952 7647785.5 1413542.75 2834703 3990756 751198.5625 6873224.5 10649016 2389020.5 747573.6875 2121965 2244532 1114527.625 1344097.75 1239866.5 1695380.875 1015420.875 13259575 2527977.5 3484038.25 1124634 1691430.875 1865666 1679940.625 3080151.25 7231940.5 2798993 2094696.625 1833243 4194765.5 2086367.75 725942.625 2782407.25 1326435.875 8971169 1515505 14864515 6439095.5 1647177.5 4899759.5 1599355.875 4444403.5 7578483.5 3210329.25 8318501.5 620273.875 3302288 2075654 21052080 1444640.875 8553340 9794772 1198789.5 13832629 811363.0625 1740280 3815973.75 864556.8125 1046191.563 1617751.75 800714.125 6021835 3330760.5 1647420 1495260 759671.625 3586908.5 5362582.5 1536122.375 1095461.5 11367474 3498739 1713630 5164127.5 1009398.438 13179529 3794825.5 1498466.5 1104435 1733636.25 4759562 3446151.75 3701970.75 2279994 4566580 1768858.25 6638775.5 8664463 3565659.75 2924526.25 14068781 15092319 1149261.375 4391964 6032845.5 4620841 4530322.5 2457105.75 1523654.75 3665083 6043596.5 6765038 7782606 881218.625 3686184 14606117 11070788 2295287.5 4835950.5 2801767.25 13195215 886936.6875 2126465.25 3219342.25 2090581.5 688934.625 6283580.5 4229113 1459143.125 2469236.75 5222681.5 3798752.5 2281789.75 7717657.5 1099185 12697881 991467.875 2316469.5 973310.5 5694083 1179252.625 1032177.063 1870192.25 1275290.125 881484.5625 3694150.25 11779020 3800392.25 4776517.5 6807459 1421052.5 10157692 3857408 1141720.375 5542001.5 3147143.5 14865650 910477.25 3353273 2585296.75 1096336.875 12277800 8117387.5
3-hydroxybutyroylglycine** 468714.6563 420482.0938 418740.0313 825385.375 150937.7813 6813631 308846.5938 506528.125 530381.9375 1076278.875 464614.0938 978110.5 402668.6563 759709.9375 358602.2188 1201690.125 447190.6563 402257.375 408780.1875 550654.625 2063225.375 4758063 1369693.5 759024.5625 1733451.875 805941.5 226614.9219 529453.5625 303458.4063 275214.8438 390072.2813 946535.25 322359.9375 453314.2188 477795.875 465372.25 964403.8125 447634.5938 542735.25 536617.25 898116.125 660350.625 472947.7813 1215029.75 619790.375 6851581 562629.375 645118.5625 532164.125 2508552.25 2242616.75 400073.5625 2995457 2320747.25 17746792 512353.1875 852067.125 733720.3125 1034950.813 2997861 794376.625 4431539.5 4752006.5 1745276.75 1642685.125 540874.0625 1194633.125 464386.75 1864638.25 940955.0625 526957.875 2346332 25036852 3479021.25 909153.375 1088855 2474574 1609673.625 2045534 4162838.5 1751106.375 1146335.875 544395.1875 2127326.25 816649.1875 739220.125 1887952.375 1404912 755739.6875 677406.75 2022839.125 2810007 1866036.5 703856.625 3083704.5 2922776.5 5286865.5 482332.375 469781.1563 892325.125 4249995 1276787.375 694595.5 838178.6875 949853 1044631.5 758079.6875 632663 2819661 1234779.125 2324963.25 1478646.375 1388968.125 2351720.75 1502851.375 1221792.75 1439061.25 5922788 567445.9375 3103108.5 2533043.5 1738560.75 766604.25 3214106.5 2784808.5 1691477.875 1578128.875 753471.5 7896812.5 2054929.25 3001832.25 2032363.125 2480580.5 576771.6875 1564851.375 1447601.375 2113380.5 1784771 823423.875 546469.8125 417974.0625 2176149.75 874181.6875 829254.9375 597177.8125 1598030.5 2099292.25 3187699.75 4088464.75 2433242 2289012.75 2538597.25 1398714.75 658082.3125 818226.625 3676054.5 1482916.625 572883.25 1504455.125 7265512 762602.3125 995233.25 796011 1322788.5 488956.1563 4390997.5 361867.5938 18629410 2630406.25 452564.6563 1129004.5 1983302.375 612080.5 767797.6875 540202.8125 1003288.5 3450644.5 1871286.375 6022231 3015611.25 2459429.5 888759.875 2836417.75 746105.5625 1177954.75 6091428 3406899.25 1130189.875 1108139.75 438852.7813 15644478 513547.0625 1163014.25 5531963.5 808482.25 12875033 338212.3438 2055553.375 1253442 191797.1875 426351.25 1426917.125 997545 2780987 4389859.5 1280793.125 773518.4375 9062106 792699.4375 9222389 386799.25 475673.7188 5910187.5 1085637.5 890205.75 216177.1875 980541.8125 10264581 248203.2188 1614528.5 1912715.625 1781795.375 1780683.5 973030.375 926876.1875 1114475.875 2280473.25 533551.875 3191599.25 3781644.5 513366.4375 877137.75 7445778.5 8754288 509474.7188 682396.375 1125939.375 1822446.375 2036237.5 2096276.5 914109 1002173.313 1087181.375 665607.875 2611196.25 426443.9063 621923.375 12491661 2555029.25 1623809 5833993 2029316.125 2301728.5 558659.8125 1440601.125 501946.4688 792164.75 20452606 876542.0625 1123211.25 825227.3125 4127795.5 2788979.5 2439851.75 4148613.25 635370.25 4105450.25 1501739.5 769061.125 1739308.375 3762581.25 1314554.125 437924.9375 383450.4688 821173.9375 1759677 1243474.75 6393953.5 2138854.25 1897354.875 1542972.375 588227.75 4096634.25 601698.5 1135858.5 748633.6875 584072.75 8951272 952410.6875 5471706 774886.6875 1613759.5 22738856 2521726
N-methylhydroxyproline** 839015.75 151767.375 511838.9375 617003.6875 864883.875 706198.1875 510702.6875 577651.25 940311.1875 281907.75 259434.0625 468042.25 439435.9688 218711.7031 548545.5 156821.2656 1165931.875 314709.75 292216.6563 629882.3125 1776905.625 478609.9688 94553.7031 565198.1875 3405700 365835.875 918389.375 894407.5 656053.5 5024333 551811.375 822076.375 1587194.75 2323438.5 128645.8438 255124.6094 353782.5938 1159688.25 408289.0625 703559 1687850.625 519456.5938 540416.4375 646906.25 68133.0859 483827.0625 186896.5156 215033.6875 636108.375 381701.9375 195161.8906 427270.7813 678669.75 803139.875 253241.4063 1982660.25 100662.0469 454756 360004.6563 3448397.25 308576.7813 717360.9375 159125.9531 447139.1563 587446.5625 146781.2188 222928.2188 2404548.5 247463.5781 3572492 448484.5625 618045.9375 361700.5938 202606.8281 836972.75 108443.9688 507866.25 370926.9688 305891.9375 677021.25 241339.4844 214087.9375 3433073 384149.7188 608840.75 237351.5781 504637 1153839104 143574.8125 775183 1751376.875 2822228 4771084.5 644158.6875 291065.5313 338138.9375 1696608.75 441089.1563 350075.0313 347764.125 248430.9531 532866.8125 1117469 232848.0625 267029.7188 235066.6094 381912.0313 125190.1719 866550.375 75993.1953 164638.9688 98134.9297 382237.5 706395.8125 276791.4063 191256.1406 351000.75 860699.9375 276424.3125 192857.5469 1030460.75 408867.0313 357796.125 472958.7813 400848.6563 521350.5938 452634.7188 422306.8125 1403291.25 501913.9063 1034795.438 413609.3438 2029987.75 725597.125 578184.125 312214.1563 1031127.375 617483.1875 161041.9844 4708426.5 1206105.875 87244.8984 625177 340748.0313 318141.1875 516666.25 492607.75 166780.9688 950523.6875 507360.0938 621504.75 243919.0625 1053482 277210.3125 247335.7344 4373741 332522.8438 140646.9531 215370.6719 380306.0938 1329666.375 2675797.25 728627.6875 623319 1047048.188 661041.375 372775.375 962694.25 892269.125 755030.875 743496.875 548504 3642234 1985985.125 503019.8125 670281.625 1351426.375 499936.3438 2590541.5 424458.9375 709687.3125 75061.0625 1504986 1072987.375 297760.3438 264013.8125 870704.8125 2439582.75 194009.625 281576.5313 175960.4219 286906.5 474702.125 1711860.5 145728.7813 302245.2188 191332.3125 1068980 666988.8125 541856.625 706497.9375 1173602.875 839272.3125 212134.625 680854.1875 184609.5938 228322.4688 1248122.5 290264.5625 964613.25 781536.5625 452853.1875 780319.125 293878.875 2659350.75
"N,N,N-trimethyl-alanylproline betaine (TMAP)" 26048974 22849696 47510128 33468810 23718314 62697380 21815560 43033844 53916116 86559632 41023992 39189236 48957664 27968566 37606796 45892072 36049580 29926392 46696928 55335776 46201132 68148608 56598324 45357336 52082284 32867584 35688600 26839820 52451096 45856924 35610052 25429254 77577760 62625048 56866500 28592618 35649512 55645892 41324492 32875858 37708636 55489112 37383000 53874152 71046848 62528164 33951520 28783074 26247286 35724564 832983808 325848736 107398272 238650080 546643776 624029824 46167476 96069328 33869524 808177728 228729200 146266944 1029108992 212544352 1573249280 73540296 501712064 46160688 282258752 247428176 556320512 83449672 120108456 68185824 1381719040 408095712 69777672 99154352 303999392 540271808 978894208 677409984 495868224 613627456 45936000 228702768 55231020 569187712 81997592 38573124 142484624 35112880 983079232 353343648 265727216 273830752 1632829184 906897472 664463232 36801536 59404260 112265256 549863808 90388872 54556040 261637760 136761344 57352620 50593212 103706296 81150680 408061568 188477568 141717056 78551608 103162672 92368392 629733312 295614016 136031856 466483616 1550848640 88045736 653341504 244961440 137511776 170571728 130266080 342636864 970489728 105795040 610161536 86400608 562560896 68182448 34318724 344210688 105162112 53191056 1944574208 92132824 84729192 603664960 342772416 158102576 29379858 74769072 108617464 788503936 135156096 149564992 197655872 119290784 235224064 1083081088 99515752 45991988 159050976 341878304 108484008 147974528 139455488 243428224 89909896 893983168 269423264 379467616 175030672 302813120 117950264 84438776 123645936 919477760 133592608 44989728 80520480 352781888 124757656 86461208 245407664 119349896 803667968 95279520 1246463104 714648448 68260312 308759008 122407600 599119488 247238160 299324352 659337024 120613408 304682240 89729208 1022935168 86926256 640006976 1150263168 89033264 1539874304 50246240 269054080 321687808 31161050 149798848 137511776 64610924 432375040 461770976 194805776 115429936 100067704 725303616 660951040 171815936 90187616 578730112 236922464 645633152 183802192 142437552 1806589056 575386176 72418968 95445960 102320480 854030848 148953984 218719296 103413624 460737792 49538800 805009792 714460864 140735888 334602528 1179367296 745684224 135568064 344894400 792091904 119375912 274963264 96072104 384767936 691513792 513691520 210494784 658239424 30763272 298762624 1335899008 474414144 116390056 912889216 156672048 766875072 38901716 53788096 1670215552 179059200 72542144 1431070336 282391520 69826312 305416000 397930432 408465120 91516984 514650720 187314288 965892416 80069736 57941972 24551720 369718816 106256592 89319648 125763576 58254700 45189792 124707624 483141472 248947600 351452256 517587008 128427888 468875104 324258496 75802512 229209808 250767920 616376960 130033048 162785648 327156384 98277704 1237171456 346457632
3-formylindole 1364399.375 1581787.75 2308223.5 2191057.5 1773338.875 2187140 1809807.25 2631571.25 2083505.75 3245481 2199652.5 2519863 3985622.25 2009355.375 2394552.75 2917858.5 2071421.5 2690980.25 2380848.5 3622597.5 1890604 2866383.5 2273206.5 2075988.625 3415135 1431272 1843604.75 1680272.25 2795668.75 2214844 3371224.75 1690673.5 2669478 2875958.75 2611681.5 1521168.25 2858417.5 4300868 2937265.5 1197814.375 1186378 1936174.5 1460513.5 2444700.75 2459161 1770403.75 1601918.375 2381771 1439171 1678263.875 834682.875 3995744 870503.0625 1154360.875 1670346.75 2614625.5 991399.25 1148299.625 874556.3125 1678725.5 1676503.625 1800691.875 6782575.5 1623231.375 675749.9375 813168.0625 1336413.25 1250526.375 568887.5625 1804638.25 1941355.75 1462265.625 1893547.625 1129412.875 1199513.625 1062835.625 1347751.375 566584.1875 1022416.625 1121740.875 2143334.25 919091.5 1216927.125 1248770.375 1122537.125 1713616.375 1326148 1150554.75 926464.0625 505322.9375 760619.1875 1155220.125 2652354 2173000.25 1920950.5 3625260.75 1825556.75 4276061.5 1120091.875 357633.4063 1626261.625 3632248.5 707422.3125 1302305.25 438826.125 1662596 798216.375 2096194.375 1850475.75 700333.625 1823305 2631414.5 3034166.5 406164.0625 568999.625 677444.5625 1386238.375 2186562.75 3114913.25 1830609.125 370500.6563 1470006 2142336 1833364.375 6788706 898251.0625 1733088 797186.5 2650472.75 2830882 3943993 4072931.75 631905.0625 641301.1875 2162673.5 653722.8125 2343936.25 1161946.375 875690.5625 17875406 661787.8125 810883.4375 1804342.625 2443463.5 664963.1875 1797622.75 987837.5625 1259438.5 6630976.5 1306764.5 1349716.875 890886.4375 1128554.25 877370.75 1919218.125 579011.4375 2577757.5 773759.75 1833749.375 944766.1875 987372.5625 1763676.75 1124679.625 1950788 2683820.75 1450192.125 724632.5625 702183.8125 1263440 1537365.375 475834.5 664729.1875 644237.625 1158693.875 1787042.5 1245682.875 525894.8125 1232194.125 1023149.938 2688341.25 792023.0625 12650091 1054231.875 2297563.25 1679187 1658204.375 2066241.5 783712.1875 6122896 1755375.5 2037417.75 4200963.5 1441490.375 1829872.875 494517.875 1848859.25 252302.5625 1824231.125 8172141.5 985550.25 1470071.875 598921.9375 1117658.75 1193773.25 1246688.875 5689720 2391441.5 976301.625 838910.625 1733446.375 3562672.5 529042.1875 1678725.5 1530679.125 2604116.25 750471.875 755748.5625 2466481.5 1686729.125 2005668.25 1868442.75 2289270.5 1417240.375 1180669.625 1621048.75 1414002.125 1272326.625 7069566 2209311.75 2116486.75 3736827 1588289.75 1811428.625 1799768.875 964080.3125 2613051.75 1835731.625 2110683 1873383.25 1858595.5 2569045.25 6018741.5 2917695 1870089.375 846811.375 1649965.375 1175141 1075695.75 703553.0625 1404441.875 667582.25 1123963.625 4025337.5 1515372.625 2201616.5 28235416 1247906.125 4549437 1126707 870908.9375 2716075.25 3038731.5 2353869.5 6821905 726470.0625 1217827.5 4625845.5 3000753 1160017.75 586915.4375 5243853 3464106.5 1417141.375 466449.5 976612.8125 1243673.25 3657924.25 5285469.5 1824718.625 629486.6875 1812458.25 670288.4375 1265836.125 2132007.5 1368792.5 1871758.5 1016674 2713381.5 776768.0625 2758088.25 4155427.5 2184617.75 466025.8438 2978410.5 1097297.25 542659.875 1948827.875 508186.5625 4905633 1348577.625
gamma-glutamylcitrulline* 2013259 507242.0625 2330211.25 709064.375 1107951.875 1078155.375 1477272.875 971703.25 2049035.375 1100866.375 1251144.375 1322715.25 1651739.25 687680.875 1268814 671147.375 1548409.625 791909.375 892122.3125 2204124.5 1168158.625 1223674.375 2365564 1939608.5 2095676.75 1035273.125 2062194.875 1289150.375 803632.25 1080329.875 2121071.5 1666567.125 2363348.75 1877469.625 1938458 1845503.625 1427594.25 2669242 1394349.25 1271477.375 1114383.25 931684.25 1092211.5 1609687 1056502.5 2724294 1390072.125 1486256.875 1064385.75 1493125.25 436681.25 474431.75 431836.75 1006888.938 370970.4688 132474 711880.3125 188255.6875 103325.125 871775.625 634249.6875 62359.3789 140162.0938 314793.2188 310994.6875 140102.3125 243291.2656 272177.0625 564238.0625 369570.2813 235540.6406 400772.5 544209.6875 372401.9063 175657.7656 61700.6914 329820.7188 289383.9688 193245.5313 73546.9922 343831.6875 42859.9414 357686.25 192407.4531 109581.7656 176611.7656 303592.6875 198389.9531 512334.0313 1101842.375 129255.9922 150098.5781 163238.3438 407519.4688 102527.5234 697534.5625 246637.1563 433721.7188 326390.1875 223525.9688 212687.0156 274713.375 148615.5938 2511819.5 336518.0313 93626.9219 251684.9688 101787.875 888258.4375 299085.8125 567371.5 159630 299231.2188 97206.3516 138491.7969 1785011.875 302736.0625 402722.7813 345014.75 142277.9531 58042.9258 72116.8359 90808.3984 453021.4375 93103.5547 200523.6406 59531.6484 199040.6094 186248.5313 418516.9063 94821.2109 1442206.875 376132 393397.5 1443930.25 515508.875 292964.25 303117.625 91697.9766 91544.2109 363258.6563 172332.5156 192400.0313 801887.25 979272.5 190611.2969 151966.5938 75895.0156 165685.1094 669547.3125 92540.8672 238668.7656 480915.2188 666286.25 566413.4375 123391.625 140256.9063 51485.3789 177895.4375 224279.5469 193282.125 124788.0781 177123.2188 71082.7734 366032.5938 189085.4375 256780.5469 362677.75 162764.6094 587670.125 93350.7188 66385.2109 56062.1484 79434 927762.375 335329.4375 334577.8125 374303.4688 1023656.125 234080.6563 797156.8125 143540.0156 734493.75 512350.5 697670.125 1011953.688 286819.1563 1059886.5 562548.3125 112596.9922 498047.5 103461.5859 306696.4688 1987988.625 479120.7813 442777.8438 190570.2969 785759.625 721164.9375 459587.9375 405569.2188 645780.25 520338.375 115788.5703 640445.25 448380.5938 407396.2188 233265.5781 280487.9375 119368.2813 658614.8125 218510.3594 553155.375 308041.6563 710909.0625 155914.0469 208938.3594 92417.6172 1170807.75 389775.0938 1467989.625 1703715.125 921328.1875 246499.1719 351929.1563 545745.0625 324530.0313 1068302.5 1084826 710923.625 558308.0625 358691.7813 467015.0625 1084921.625 2656307 928357.625 533027.1875 180878.7031 2324348.25 110997.7891 791696.3125 312741.3125
diacetylspermidine* 274870.5938 396165.3438 239761.2656 3617488.5 11258389 411791.625 4648798.5 9123778 4010458.25 206678.5625 3873761.25 2371799 3915066.5 10174888 1293485.25 26713058 882807.875 462991.75 461899.8125 4718435.5 3210813.75 6462503 389895.9375 1475848.875 504497.3438 4937858 4226345.5 855773.75 1031785.313 7121941.5 2930421 2646095 7131831.5 3865868 7232934 2808990 2242369 513635.1875 8384822.5 10262152 519442.4688 4652009 25392060 354475.9375 3703921.25 6897868 10853696 3656443 2225003.75 2561856.5 4344871 490810.2813 765258.6875 469520.9688 1396781.25 2701346.75 942840.0625 453295.5313 341200.8125 600983.25 1493688.5 3903272.25 824471.3125 2145553.5 2568712.25 24145520 5241180.5 11914385 10738985 6422807 1049127.5 819670.375 3302718 10406837 2133730.75 2176180 2479759.75 1166111.5 1287355.125 1290207 914630.875 14275716 1963713.25 784563.5625 8126433.5 1549476.125 861693.25 11308961 2321702.25 11414000 4190681.25 7623469.5 805332.0625 163772.7813 489204.125 1291281.875 6446435 3277199.5 1889381.875 6921809.5 23018348 632384.5 4004291 13200907 1767379.75 311288.8125 603220.1875 895557.875 2307649.75 1230031.875 1417951.5 3426307.75 2908439.75 13590940 754333.625 2531146.75 613452.5625 11632071 503302.625 2242369 7105287.5 2009410.875 1688935 5711498.5 2075800.25 8475715 6350867 681095.9375 5651310 905677.75 3442102 1262767.625 2611195 6799519.5 821614.6875 18822548 2152650 4628252.5 463449.8125 8735608 14218988 793257.4375 2783409 336449.375 15253491 919352.5625 357231.4063 3944793.5 3423531 2242369 1931873 20052742 26436656 1433207.875 3042663.5 1935296.5 918283.5625 421502 19094212 1663219.125 3204346.75 775275.875 4619239.5 7942648.5 8430229 3326377 245055.7344 543384.0625 5647319.5 2684647 1385849.375 1490453 3540651.5 2655119.5 16144714 6539557.5 2339051.5 5628847 565123.75 2240032.75 1428179.375 1114474.375 438376.6563 4516544 678719.0625 365629.7188 1925663.125 4842902 2632903 2257806.25 7182105.5 623437.8125 744488.375 18157946 1349502.25 42205672 1611260.875 1519934.75 851937.0625 588833.5 5290184 1118886.25 1879034.25 404661.6875 15093191 2795694.5 1603642.625 1528288.375 439473.1563 2967319.5 728678.25 664169.625 1001470.375 11928938 6319235 5689117 432274.25 14161311 2428921.25 371678.5 1731259.375 1476851.75 671530.6875 610699.5 1256367.5 1522387.625 8823007
3-amino-2-piperidone 1417753.625 795288.625 1008073.688 1073934.75 547672.75 1417273.75 985947.5625 778140 1231059.625 1530720.75 1517653.125 657017 1029813.813 644712 954261.5 862017.875 1026247.75 1000179.875 993883.9375 1364437.875 1013736.063 1193667.875 1457371.875 1036739.75 1387732.5 982122.9375 1553001 702184 1032942.188 801710.5625 1837471.5 1016222.938 1164362.625 1278257.125 1797399.5 1199459.625 859932.25 1598217 1272290.75 1350726.875 713203.5625 990674.5 1079150.5 545501.875 866480.25 1100292.25 1787811.375 1060391.875 589447.9375 901944.9375 1755584.125 1201756.5 769755.875 1463153.625 1339628.5 2364010.5 744427.375 556248.3125 749426.375 2962749 912022.9375 342766.3438 936129.1875 575199.25 2366875 598925.8125 842630.375 537151.5625 687903.6875 296437.0938 1444077.75 588986.125 627478.375 261190.5313 3458958.75 1367681.25 711935.4375 374259.4063 436753.75 954270.25 1353371.375 1112265.875 1158249.875 745725.75 491446.3125 826647.125 2223123.75 943964.5625 723048.5 635598.125 641448.6875 692692.875 1562924.25 1165543.875 1057991.5 1336587.875 1774688.875 3238933.5 1506802.75 377937.625 493255.7813 792160.75 1034783.25 952094 696497.6875 1094442.75 728100.4375 481730.9063 564920 547462.875 566482.6875 1232597.5 975468.0625 933994.5 433690.7188 657290.9375 816629.8125 1213339 547609.5 895149.8125 1809129.625 2434010.5 466348.4375 1449481.25 1036450.125 799936.0625 839844.5625 649290.5 1128824.375 1122936 572909.1875 9317312 936390.875 1984140.125 637727.1875 380993.4063 645634.25 700482.5625 472105.875 1105313 884482.6875 493735.5625 2644937.5 891237.3125 585269.9375 653846.5 568641.375 903308.3125 1491862.125 643261.375 914906.4375 1020281.313 441839.7813 537952.125 2792863.75 514538.25 974277 489528.4688 671199.875 1181662.625 295497.9063 456011.5 747108.4375 919906.3125 1867750 901684.75 1099777.375 536552.5 693271.9375 768674.5625 745292.4375 1106891.875 3327714.75 421063.0938 1380421 827456.5 858507.5625 746317.8125 729325.125 835849.125 1074772.25 3268834.25 1216566.875 2951016 2103662.75 972132.125 1027016.75 954261.5 1112338.625 1557867.125 1210763.875 2592115 439190.0938 1046768 749242 3231568.5 284613.3125 1444414.875 2061314.375 640235.0625 2659740.75 805537.625 1154664.375 768639.4375 791021.0625 544113.4375 460186.3438 428570.2188 1180949.125 1339730.625 764172.5625 918875.25 340088.2188 1732886.5 1049876.125 848326.1875 567253 2209300 553401.125 589719.625 1021735.438 480939.6563 1716981 792340.25 1147020.5 901776.5625 646387.6875 905334.5625 1186900.25 1540054.875 1147893.75 2736103 819375.875 2864381.5 2544437.5 1108072.625 841191.5625 2549078 1921150.875 1097438.75 978388.875 1421352.875 814827.4375 893990.75 1113567.25 699448.0625 744155.875 4043148.75 1375663.25 4784445.5 674712.75 1609032.375 5131269 3581559.5 1599278.625 5207898 364111.8438 2466307 708585.875 656474.625 2103264.5 775816.125 491481.6875 1870018.75 858793.0625 683333.1875 814907.6875 1068097.75 715300.4375 660665.8125 1261301.875 707296.1875 2381010.75 222919.3906 396455.9375 365652.5625 1972061.375 845835.4375 1008968.438 639598.375 986410.5625 634768.3125 1006973.938 2972901.75 1169563.375 1404058 3663572 659496.125 1760061.75 1009594.875 669744.9375 2345481 619735.0625 7419138.5 703785.5625 353948.6875 1065151.375 554509.3125 5989222 3094077.5
"N,N-dimethylalanine" 1842317.875 4508698.5 5421570.5 6985838 3648775.75 6718831.5 6349630.5 4620214 13532077 10580445 2818867.75 2183034.25 11659849 9314885 4452633.5 3533488.75 5450048.5 6486378.5 8954287 9608357 6771331 5190182 9413701 9197350 5654491.5 6419080 4106369 6259596.5 8923629 15979822 11211348 20884998 8539529 7306001 19508016 14316893 3873961.25 9122001 6483024.5 9005610 15755566 8011730 13041222 16708112 7666836 4535293 4637398.5 75758944 66762776 4719159 26135528 18043370 6629985.5 17810618 5576211.5 26964898 11671720 2048569.625 14294588 3023933.25 21772030 15024705 18584366 17191126 3836326.75 11709243 3593356.75 6241840.5 19031812 11609496 10365987 8212716.5 6420294.5 5173744.5 9056932 7903798.5 9512799 7952483.5 2031751.75 6796950 8602882 1445382.25 6974148 1479437.375 7739339.5 7358074.5 10588330 15898965 23493326 8374323 5133635.5 2848109 10105454 3187009 3462482.25 10879398 4526543 14707573 13470069 2904770.75 6547368.5 10947419 2420402.5 27891530 14097176 1959364.125 11279706 8871163 29002262 7866146 17137698 60755992 3865570 9797278 10521785 12805277 17033650 1300856.25 19525220 3812304.5 30382190 4365640.5 3023019.25 5774046 3763164.25 5022636 4350807.5 9712391 17556964 6776593 11128175 3175167.25 10572531 20399454 7066043 5286464.5 2103684 9968125 4365367 31764412 3354183.75 13631631 16526673 4754309.5 4260479.5 13524622 9982866 1570057.625 2426348 10974759 7864279.5 4094684.25 2383073.25 47250160 10865447 19397684 14095427 2567035.25 23249076 3638390 14570998 10573906 4555119 3150537.5 1909462.125 4842925.5 5314383 19244442 2365907 14492901 42246476 1327416.75 28597206 2132737.5 2988398.5 9842083 19763176 1575664.75 9193430 7042620.5 7789131.5 18393524 3445256 9161326 62272748 28725402 5656828.5 3806564.25 2806921.5 11841642 14666320 7085861 23897584 5152714.5 10544927 6150505.5 46121516 40851384 12269773 9424915 19106090 29800834 11096741 11805661 23280964 19974382 4924987.5 4203108 4099749.25 7219872.5 8190307 10992714 32999716 3971043.5 23564096 18939876 19279088 2642959 10222534 14467399 4372926.5 9005610 21736152 3011475 10574096 23192440 9812254 6004082.5 8467391 10924659 18625396 2441042.25 8832425 14314770 4533032 9658251 6748128 8972473 5701043.5 6050568.5 3632331.75 11334329 23294188 20017550 5689127 23191266 15264214 10390163 44896644 25293614 15287989 11860104 13899745 16838266 17217742 2875744.25 10213549 7830774 21193804 34156792
"N6,N6-dimethyllysine" 23275438 19951636 25738612 19862068 28238132 35201932 18025542 14265047 17968296 29019060 23238288 17877620 16105753 14513961 18569166 15799489 21661718 24909440 43582408 28061988 16082556 24253236 30346806 25205946 22223214 10194727 34216300 31183544 59872172 26476910 29035984 15121614 35651796 24788608 34121568 19389392 33219984 82783344 38751920 26620486 26461110 31702846 34907636 19068908 24305684 26874480 29511516 18062936 19349560 54408096 54164292 30372744 21279506 49544696 41281680 25973028 27305110 44253416 20148564 60696348 20827022 23944370 52563588 40209456 22496214 19096808 138679392 17000464 38830700 20947572 33170526 22569826 39979596 16851548 35116160 42774292 39730452 26608250 22983192 49223176 163304864 160609264 99057288 29118286 30862012 65710024 12723684 111272736 47243884 20040800 36883584 12749628 122439760 122546800 39845236 69655384 49895848 38189848 43089876 14547666 42030820 35501044 37603296 34374376 35065540 52796660 51503476 16461148 20415848 18172704 109217904 138766944 42721028 31590502 31571726 38233380 48914052 43072032 39769732 52806908 78785160 45719108 22818244 115186024 83957200 33858772 20736030 19774670 34731752 24070858 45840388 39981756 27309182 131650984 29133258 14471805 80159840 37737140 24661508 93295216 23244512 29054130 65200132 86239872 23036004 28121148 19485440 28370052 52269652 73559288 21070906 48504316 13180945 129685048 56299252 40637132 37670968 90696832 69778008 51365204 11413936 20166426 38965668 29271134 24736304 39266736 211048160 58861652 38535868 23978086 31983014 37098144 17131350 23350986 24008184 20999198 31760654 35256956 33117876 25346196 40326568 55483872 36587512 259822560 84465416 60854480 34874124 37038348 163824944 186650640 52354572 209791200 18671098 50200748 29176594 37889252 62416328 22169114 53928496 30336478 32117654 17908036 51990592 100579944 18591644 36079400 35566320 39734988 43089760 100879704 35998952 40510888 21406526 36542480 33367712 29286186 25550406 150973792 114916216 35065540 44601688 37781016 72494160 33720300 31728362 22711730 59759584 41018852 24278246 35806336 44267500 36329376 30874678 96210568 297698720 13410363 62397884 71438456 41240440 27231584 47978748 370224096 64404308 154477184 17643534 25093614 22970176 88586496 28785276 40413208 12326533 65630864 39726072 345409888 43288480 151337328 92285904 18455330 22025346 14319580 40357288 41896436 13181101 136567376 31495656 60150932 82277280 142864800 55618736 25442122 56820728 46828868 51259396 19692616 28982328 30226158 34323396 20195546 21043516 34217036 18679530 18159668 28590282 316592544 36084092 60556992 44798240 19066254 71850424 115468408 34271436 32131868 35103392 34025288 16790350 25890154 34044348 52083300 335551616 281657664
indoleacetoylcarnitine* 194757.8906 187624.5781 697946.1875 442843.3438 235961.9688 408276.3438 1133239.75 104689.8984 1500757.375 222734.4063 556063.125 782623.75 275429.7813 330732.8438 1722074.5 512051.9375 1080237.875 320664.6563 2288739.75 761288.75 84218.0859 738340.3125 2002770.5 1045942.438 698676.75 235782.9688 305570.3438 194868.0469 435534.3125 290554.2188 7168571.5 150904.3281 331096.3438 986081.875 438030.4688 152992.7969 285596.3438 840722.6875 614020.8125 185143.3594 108297.2891 3407000.25 2203233.25 95010.3594 289666.5 4176574.5 88737.9375 211302.8906 537489.4375 375157.5625 1042329 105512.6016 121262.9531 1811319.125 1177297.375 170406.7969 64835.1094 408605 639740 479928.7188 41910.8203 222437.5156 306642.4375 473860.3125 904678.4375 1017287.438 351503.625 130517.2969 171666.7031 277225.0938 97388.1797 467102.1563 151952.0156 516091.625 98391.0859 215860.2813 163783.7813 293144.5625 42863.5039 99897.6719 56540.8281 151510.375 197021.4688 1860251 1395139.875 382815.25 344111.8125 122357.4297 85405.0078 289987.4063 106276.9688 120869.3203 131419.7656 50798.125 1113708.125 381351.5 76060.5625 381338.2188 677111.875 748355.875 742249.8125 42093.9727 168024.3438 210590.2188 40791.9648 2463360 138436.7031 66678.6094 367625.0625 152148.0469 1782853.75 42786.4961 627162.875 1725988.625 508225.4375 130707.3828 852150.25 315119.9688 48852.4453 2459184.25 288429.7813 98972.5781 39619.9883 236300.7344 118826.1797 569913.9375 195731.6094 310120.5 130588.5703 130031.5703 214123.2188 371274.4688 107111.75 525322.375 1269563 195555.8438 456815.8125 667934.9375 163233.5156 512159.3438 274188.6875 361889.375 326052.8438 344538.4688 489769.2813 62906.0508 74616.1172 57364.3984 108774.0313 102698.2656 215740.8125 322682.5 314597.8438 77172.2109 457064.7813 1499119.875 56495.6563 149286.7344 439325.5 317098.1875 642318.4375 136169.4531 127074.3516 602492 272669.1875 1099366.375 176502.3281 55041.5703 202009.3906 171841.7344 356379.3125 321138.7813 716420.1875 973195.0625 71134.6016 236518.7344 116112.375 114470.6719 573819.5 1343138.25 169304.9219 79032.875 77596.2344 388068.3438 609084.875 268032.3438 813549.9375 753705.25 107622.5469 373797.2188 222043.1406 148615.2969 532745.4375 331300.2188 423682.5313 790324.375 317812.3125 97543.5078 225393.1094 4027378.25 248357.9531 240387.9063 849623.5 1143231.125 149203.9063 35832.1758 294216.6875 211745.4375 132301.4688 483290.9688 496569.6875 786382.125 1506692.75 84523.2266 231335.1563 76344.8906 78074.5 62245.1328 377653.0313 400027.875 140715.4844 984165.6875 636797.5 624392 343016.8125 1459582.75 58026.0391 82226.6328
N-acetyl-isoputreanine 4081225 3199699.75 2581570.5 3047202.75 5010154 5570656.5 3217278 3688174.25 2825541.25 24691592 1672052.375 6674151 4002199.5 2711469.5 4053031.25 5780431 4503057 3575930.5 4194099.75 7895870 3726496.25 5035739.5 10694680 5525839.5 10139099 2732007.75 9652989 3454946.75 4995693 4297915.5 4700873.5 3333438.75 6886282 4618807 7785168 2994670 4672251.5 5738655.5 6238839 5706602.5 5792974 5728862.5 4122354 5116169 3450999 7220027 23719514 4848337 4284763.5 6703871.5 29127256 170579584 5587298 28352404 72950536 54028520 6042279 7108785.5 4247588 64574784 12502838 7535083 109568632 6036995 47648680 3468038.75 12249343 3589937.25 11140080 7925339 39783536 4331522 9702717 6004099.5 32556494 13745497 5214779 9342011 29780022 31454500 51680008 23533578 63538304 14398801 4005414.5 28532322 4963969 49078192 8781802 4737657.5 11761762 3067491.25 27148668 50176964 8189565 23384814 223484608 45732544 26406256 5264478 32371270 7710921 15463455 7484250.5 5908264.5 51627968 12267264 5007791 5265369.5 4751412 7190921.5 30556916 17560736 13082186 4072078 10794881 10355769 57466084 15767427 16061918 87437616 31024660 7786907 16357285 83219720 34165048 8584250 16171875 32678778 51463296 8517235 95426064 15712722 75940384 8291061 3006313.75 39815780 5947309 10143260 84150096 10441661 16358676 34701796 32872058 7157731 3893393.5 4103839.25 11804785 60510108 13860206 17796180 27717440 3274076.75 18577952 55316736 13007599 9883050 34191244 14689035 6094541 11443835 11052353 15148295 5230177 38746316 14318093 31508860 12341661 41796280 7641077.5 4809922.5 15983899 41067144 9840113 8124155 6758294 8502235 22150538 4273568.5 9739012 6386657 70644816 7400017 85536224 55135964 11069436 44963432 8314995.5 33680512 14158972 27088368 26616810 3724057.5 31822164 14640962 89358728 12182863 31113646 168199920 7823870.5 56902528 4016838.25 123107184 6779376.5 4645125 9436018 13082186 6833395 26571764 72799968 51772372 9269022 11508639 16879420 20099858 13156773 5010359.5 90636424 29135640 17866018 20356756 12239999 176245264 19264070 31632684 5404256 6017687 31366824 21828324 20208256 21087886 42137980 9981043 24524020 43362656 14996117 24990450 150214064 79930064 6568260 19359366 26270044 20674066 21391470 5902855.5 6319780 15993845 66406288 16544137 65116688 4235826.5 56806644 153993184 43220124 14704479 157527792 18783342 51989504 6870873.5 9251946 68743920 15306188 4686975 95835768 17090330 13678150 14069277 18083184 82159912 16930276 42755120 10631942 49272556 5932214.5 6606182.5 4900994 16902616 13820047 9485586 19994690 6057698.5 3989732.25 14862954 44902112 61738260 34878088 62720992 14268101 42879392 16090261 8774438 25346992 28834776 55455092 8869939 11036519 24950032 7916924 227581792 28734352
"N2-acetyl,N6,N6-dimethyllysine" 314797.4063 929133.5625 184690.6875 144068.4844 286765.7188 202601.1094 260235.6563 79961.9766 47432.1563 220403.375 81798.6953 471585.8125 92375.7578 315935.9375 216791.75 96916.375 250092.1875 321944.4063 1035478.813 313035.0625 129471.3047 330466.5 354739.8125 391500.1875 75428.5781 523589.4688 813907.6875 1588217.625 241680.8281 224434.5 162243.5313 218809.5938 1837854.5 206276.1875 117690.5625 308963.2188 737506.5625 984998 146449.9531 269246.1563 725007.375 98043.3047 1478865 1961778.125 580185.875 132267.9063 543793.375 1383652 437207.6875 315193.3438 1661154 156624.2344 4118415.25 229432.4688 1888905.125 1185832 1509790.75 78970.2266 9439027 86095 589649.5625 230281.2813 2085713.25 538158.6875 1320927.375 2468366.75 1452056.75 555472.3125 117732.5234 1836941.125 19109290 4222504 6556400 588964.9375 513318.5313 778364.25 49470.6992 12159206 134439.7188 448626.8125 279386 486757.5625 2128605.75 4980065.5 983917.4375 861358.4375 2914128.5 536987.3125 3046961.25 87494.2656 857085.3125 199038.7188 822741.9375 289235.9375 295945.4375 1331486.125 424729.1875 379670.6875 303576.25 9086576 4017128.25 927674.4375 303586.875 554447.6875 748688.9375 497070.0625 2585444.5 439129.375 393548.4375 1034405.938 2326525 111357.1172 8941208 3220762 295559.1875 401808.8125 68590.1563 1447142.375 1996095.375 148071.2188 9480891 163028.6875 4520427.5 94001.4063 1440666.875 172873.9844 5595764 320937.6875 450798.25 1273829.5 57924.7461 188416.375 51325.4531 1913138.75 1081279.5 532051.6875 1078298.75 571855.1875 2174216.5 3956166.25 614003.5 92180.4063 233665.3125 2166956 735725.625 65050.7344 45859.5273 500262.7188 180065.3125 554960 513077.4688 9927878 366962.0625 198118.2813 112568.375 145512.1875 2353180.5 341881.625 148957.1563 339316.4375 273067.9375 226132.6094 1774974.875 164800.9219 31165788 1970280.25 1387147.75 464040.75 432522.8125 3081102.5 6528743.5 814827.375 3999631.25 702367.25 665239.1875 1809510.375 717190.8125 265984.875 3641447.25 481754.2813 3560463.25 218926.6406 2542292.25 83322.1719 333975.5938 213917.3906 5428446 2817961.75 357977.0313 979124.0625 180178.9531 1304410.625 528749.625 110117.2969 54031824 1514393.5 590412.3125 2093410.75 8660909 617041.75 238358.75 210207.75 1803775.875 2883158.25 826040.6875 235494.9844 1583161 146506.0625 2256093.5 10179258 317629.2813 3446813.25 3513171 158569.3281 1370795 18017014 186348.5938 5013195.5 328509.0313 420129 682382.1875 1364580.75 115699.7734 4545957 126521.1641 1118071.125 10296680 35995376 244851.7344 1995647.375 4163128 412785.5313 1048640.875 311302.5313 43797692 619820.25 562460.875 2410093 11740182 2636816.75 173110.0156 1544801.375 343249.0625 3759214.25 150631.5938 581170.375 154524.1406 522771.5313 244523.1094 362794.4688 1079113 24299258 2438227 2850966.5 1299539.5 192175.6563 1244291.125 2993090 438235.1563 4618517.5 452139.9375 1578995.5 150618.2031 590122.6875 500467.5313 56050004 15144197
"N2-acetyl,N6-methyllysine" 313725.5625 570470.6875 189869.2031 139867.4063 215689.0938 175735.7188 253579.1719 117790.2891 171080.3906 354780.8438 63701.957 339657.5938 93796.9844 153247.1094 220229.3594 188781.8438 240901.5625 242229.2656 563880.25 334465.5 100377.2266 671930.125 522218.5 173909.8438 302876.0625 134857.8281 401041.875 830880.9375 1455776.125 102521.3203 205907.5781 287980.8438 230580.25 321684.0625 288590.4063 212241.9375 291450.875 1263957.75 436155.4375 271842.4063 485052.25 758277.25 810017.625 273331.9063 284304.5938 342012.3125 702117.5 355551.5625 71282.9688 1080709.375 808264.5625 806155.375 139103.4219 181858.5781 282934.25 173488.1563 186614.4063 564816.0625 68634.0391 732608.1875 410384.0313 363472.4375 251257.3281 204224.8438 374607.5313 139691.1563 568305.4375 148181.7344 438545.4063 71861.8906 733998.5625 144653.8281 626834.1875 289338.2188 136977.4844 328901.25 272155.3438 371727.0625 749218.625 915978.0625 791868.9375 657166.6875 440289.7188 578292.6875 348380.5 342768.9063 272129.125 1313651 155968.0469 157517.875 276472 64548.25 335459.625 145383.5938 229430.7656 534136.25 533842 382438.9688 366571.375 47741.875 421010.0313 306768.75 195117.375 274096.2813 285406.8438 898977.125 202541.7344 138300.0938 142734.0156 463321.6563 1704600.125 513102.7813 384251.7188 672454.5625 132134.25 287955.1875 100312.4063 1326552.125 351794.0625 300463.8438 718075.625 407981.3438 198840.4688 1664881.25 403019.4063 986080.3125 327388.5313 107141 229627.3906 514034.3125 167450.5156 976435.375 137406.4531 528746.625 131267.1719 125301.125 536841.625 215022.8438 325818.8438 985574.6875 343280.6875 185712.3281 711774.3125 514192.75 177753.3281 213274.9844 99162.9297 154629.5938 965419.25 122278.9609 139672.7656 418108.4375 357056.875 350838 817113.75 211990.4063 269315.2813 134067.3281 571252 361998.8438 63358.9453 211052.3281 187043.125 306582.2813 2281907.5 122819.2266 151597.1563 406281.5625 260990.5313 260560.625 1241007.25 226439.0469 154928.5938 528679.875 184456 317479.9688 750565.75 6218650 1171188.25 1199271.875 437197.5 152462.7188 1404921.5 1957809.5 169390.0781 1380735.25 55117.6094 393569.25 348380.5 471692.5313 475326.7813 280713.5313 738330.8125 244755.5469 1256042.375 235553.0156 1210274.875 114879.4688 231716.1094 491437.9063 2222078.5 1418669.5 509814.125 515553.0313 213344.6406 1286941.5 211808.6563 67827.3828 3713716.75 746405.375 346978.125 645811.5625 239427.2813 1032180.188 424363.2188 138288.0938 227827.0313 751230.25 542627.5625 458605.1563 461656 1999552.625 263664.9375 1119623.125 3382604 183209.9063 1099269.75 689994.1875 222251.6406 1021064.313 6053131 155865.4063 2158087.25 267236.75 212158.5156 370032.3125 666936.875 405603.4688 942977 93312.6719 701818.4375 3561388 3603680.5 146842.5469 171017.2969 785484.25 73735.6797 103358.0234 609639.4375 156510.6719 93493.3203 5425436 251022.8281 446949.3438 837986 1440057.75 962122 836191.25 396126.8438 895540.4375 244299.1563 110616.8594 119962.9375 721157.9375 349782.9063 387368.875 838017.3125 265481.1563 90261.7891 396171.9063 466962.4375 1136318 978365.375 432998.625 1014830.188 791976.6875 331805 491641.8125 476721 1652913.625 486222 241451.0469 220988.875 253218.875 5207116.5 7709976
3-hydroxypyridine glucuronide 1577084 4381833 634872.5625 902610.25 2001414.875 121519.9531 584543.875 222219.9531 350364.9063 487854.5 914492.4375 1128486.375 1125177.375 300189.8125 487854.5 705505.3125 234144.625 4533254.5 137198 502669.375 1666728.375 1487859.875 235006.5 4331315.5 242169.5938 207428.4063 1843485.625 54791.3047 72591.625 2165397 625955.6875 46244.5781 19635520 89526.4766 288864.875 1975005 99789.2578 366277.7188 66890.7891 382854.8438 145918.5156 522371.3125 9309902 49327.8945 1895508 733539.4375 78195.5859 373664.5625 219887.9219 1455468 245099.0469 312990.0625
3-hydroxyhexanoylcarnitine (1) 209611.3281 146350.8125 234041.7813 240671.7344 124161.7422 392601.4688 116437.9844 248360.6875 186739.2344 510802 212064.8125 357613.0938 251606.4063 87298.4141 159811.7656 331651.1875 217607.3281 366982.2813 297082.2813 142352.4063 453568.4063 486996.8438 194647.625 466695.5938 143248.2656 412717.5 394944.375 260542.1094 381720.1563 247428.8281 272197.125 142460.6875 594753.0625 364480.4063 215334.8281 58583.0703 198388.6563 307480.875 130151.7266 273004.2813 165017.4375 479533.9063 176353.5 253612.9375 603505.0625 136192.7344 133806.8125 183695.4531 223579.0781 119741.2969 5596162 4487069 409476.75 1189916.75 6545617 1608593.25 120366.7344 581856.6875 163848.9531 1215547.875 1672764.875 942322.1875 5558708 654278.3125 5062468 302830.5625 2804256 207155.4688 3969239.75 735725.5 2744269 347448.5 569505.375 690055.75 4384138 2165074.5 304518.75 1181109.5 1460889.125 3217391 2832490.25 5285623 3679332.75 4567201 565317 1397556.5 237796.4219 3367528 506096.875 304052.5938 1071712.25 227459.2969 3672833.25 2472124.5 1359097.75 2770107.25 6235154.5 3420878.75 2342536.5 272970.8125 547361.4375 880681 3870638 738361.0625 305265.0938 2269512.75 778729.75 375222.0313 237589.0469 824752.4375 858760.1875 1891883.75 786342.625 836588.5625 564557.25 1783141 1355021 8557995 2147051 1097142.375 3211447 9038377 171241.875 4756754.5 1171252.875 2748477.75 883874.4375 1653520.75 1341878.25 10119053 727031.4375 721883.0625 574116 3004268.75 557803.5 475913.9063 1329575.375 632084.5 419838 11506383 722364.25 847488.5625 6941754.5 2001332.75 365405.2188 188769.3906 723042 498237.1563 3823654.75 709672.1875 644079.625 2403267.5 685265.4375 4043558.75 7531970.5 913442.625 1124066.375 850746.25 1175188.875 372898 410354.7813 499658.3438 783416.25 488179.9063 5353157 1148741.875 4385687 1652673.125 1541515.375 810201.25 720118.4375 928731.3125 9016483 1442954 267194.7813 445265 2521055.25 1020712.688 364875.4063 905383.125 855978.9375 2129260 619459.3125 4596299 4194532.5 397476.5938 1724747.75 680620.5 3041850.75 3057712.25 1634762.75 1497475.125 572227 1521930.75 1637081.375 3147542 446074.0625 3613609.75 1531849.5 516213.0938 7903197.5 254071.9844 2233167.5 1810410.5 117055.1719 554698.625 736938 990694.9375 3438358.75 3068735.75 2228100.75 276798.5313 1012812.313 5815481 2571462.5 1061415.25 588137.375 3678388.75 2695811.75 1952129.625 600675.4375 729274.6875 10440045 3962624 985896.8125 334786.125 563087.5625 1894187.75 536534.375 1101600.5 937927.3125 5183761 836127.0625 3947384.25 7400305 1323611.25 1574812.125 6546403 2134028.5 460573.9063 998075.625 2449413.5 2685650.5 851498.875 770645.6875 658891 3842603.5 2544849.75 1149715.125 1517263.25 130707.8203 2236036 2439679 1102948.375 1012472.875 4956197 1306693.75 921397.25 234216.5313 1099919.75 11036053 1008206.688 344128.5625 8245146.5 1358027.625 983164.125 851115.625 1697388.375 3351000 521357.4375 1755770.125 557835.6875 7316307.5 787344.75 880681 394229.8438 1750538.125 740515.75 327327.5313 1181623.25 295254.8438 403500.5313 775073.1875 1218448.5 777236.25 1819945.125 1416862.375 541781.6875 3489452.25 1469170.125 335763.5625 222397.9844 1539400.125 1581252.5 404215.1875 1163792.75 1600996.875 443533.4688 2799487.5 2986913.25
3-hydroxyhexanoylcarnitine (2) 149759.5156 155228.3438 1590551.125 1273007.375 318118.5938 2336336.75 444515.3125 157134.0625 290383.2188 662413.1875 361547.5 1505440.75 330652.375 971000.6875 74991.5313 587064.25 994532.8125 296695 1060438.125 91005.2813 198864.3438 167849.3438 1549168.25 641338.375 265589.5 403056.5313 821829.0625 900279.625 1467422.5 1286087.125 1125922.5 183238.8906 463406.5313 1195213.375 121791.3359 58842.4102 415991 2023341.125 666277.5625 418631.7188 1080042.5 2386912.75 1423804 702293.25 106351.5156 142982.8906 270665.9688 1073642.5 181978.8594 99392.3359 1020014.25 270404.5 69812.9531 308400.3438 761759.125 298617.125 319562.7188 184147.75 593313.375 439413.3438 3278636 897448.625 345836.9375 743836.3125 2613764 1434180.5 255217.625 777618.9375 352022.625 360146.6563 252515.8125 2676187.5 233114.8906 145827.8125 154415.1094 1327130.25 172305.0156 130678.6563 442424.5 175183.0625 97218.6719 4760570 201244.0469 188613.1094 2479777.75 609662.125 89702.1641 194805.1875 153672.3906 1680172.25 272495.75 147689.5156 641945.6875 127187.1563 1217776.625 2441593.5 268431.9375 428491.5 350864.375 488868 115584.5234 122024.5547 286875.3438 1401927.375 324434.2813 1565384.25 567347.0625 576136.3125 226213.2813 226212.1094 288519.4375 2973475.75 382217.25 689348.125 340407.5313 296779.8438 315799.0938 533341.875 189570.8906 1624760.875 869302.4375 112008.4297 393768.1875 185905.0938 804622.4375 883501.125 458165 416899.4375 406748.1563 542793.875 791657.75 120455.6797 1517051.25 306892.3438 213388.4375 3157691.25 818876.3125 423506.3125 150892.6406 257469.5313 721171.0625 856578.0625 908970.9375 79326.4219 211174.3906 2285863.25 748338.8125 459022.9063 253155.6719 1074915.875 904989.5 763387.3125 218941.2031 2840668.75 1441697 294730.3125 81176.4297 194159.9219 707829.1875 129946.3359 431888.7188 282361.2813 2434708 283369.75 1017112.625 1486327.25 415991 561598.0625 1855512.625 401285.8438 134744.8125 547099.75 532096.5 742745.1875 81469.5 144915.3281 296859.75 1577235.125 816144.5625 270102.0938 264533.6563 801765.5 680142.875 274558.1875 434273.4063 2367754 573659.0625 168419.8281 289631.1563 3044406.5 316933.625 3695483.75 445680.9688 319669.4688 346104.5625 490831.7188 853749.8125 140046.0781 690579.75 133340.4531 2117454.25 192241.3125 183336.0781 415991 199038.9844 294989.4063 114170.0313 338517.3125 212962.1406 237154.0938 570482.75 341885.125 237818.5469 757930.25 440774.6875 663145.6875 352103.0313 143271.9688 391046.4375 719934.8125 135536.8906 587554.5 1144582.25
"N,N-dimethyl-5-aminovalerate" 521827 547289.8125 2920859.75 418480.6875 483040.2188 148337.75 358035.9688 943582.8125 464948.5938 1563941.625 401082.2188 189411.6094 224110.8281 398370.6563 101713.9297 194755.8594 237301.5156 3166294.25 443995.6875 2062776.375 1219890.75 450422 118149.5703 360033.2188 259052.7969 313766.8125 298371.0313 127482.6719 144432.2031 337875.8438 85379.4688 521827 2070648.5 106576.375 606495.1875 87731.8281 265808.5 422272.5313 2497230 520713.0625 300925.5625 1455777 1839380.875 244760.9375 272957.8125 1064061.75 1325698 765274.875 7259963 4305172.5 62789.0547 6055267 127323.2188 329941.4688 167671.0469 61317.2656 3024179 66976.1797 1756597.25 296542.125 286697.9688 3268344.25 1648761.5 1370014.125 2343864.75 955341.125 2569196.5 2357583.25 5878273.5 408536 506595.375 115065.2031 1240250.875 251632.4063 83817.6719 378888 557310.5 130726.0703 3008062.5 598461.375 694439.375 3028011 1213586.75 291206.2813 319917.875 3741581.75 286296.9063 4757726.5 10659210 1136905.375 469170.4688 401870.2188 10762316 1982689 110524.9297 1640920.75 3094919 553331.6875 505464.25 624998.75 336222.9375 292362.6875 1755637.75 1729741.25 806847.1875 1922827.125 134008.1719 3127118 8213620.5 640612 135367.8281 380161.0938 3853234 430395.6875 963088.25 463547.375 212964.625 352998.875 1238013.875 438249.4375 7129241 241751.4375 509580.0313 247170.6406 1028472.375 5284380.5 1198204.375 1326278.625 479287.9063 97300.3438 199187.5469 1502580.25 986166.625 1080263.875 974623.3125 371068.8438 2559205 160695.75 170365.3281 96918.4375 1001473.438 884075.75 864316.8125 63039.4258 474160.3125 2215992.5 396984.2813 337413.4688 737638.1875 92088.9219 169321.625 247151.3125 284523.625 160960.1719 1488739.5 372875 105924.5313 1778058.375 312872.5 1450077.375 528151.8125 10037964 488563.1563 884517.25 3727210.5 1044687.25 601617.6875 128476.7891 632745 479909.7188 2909375.75 2130903.75 442386.1875 515502.2188 4233628.5 3880475.25 747285.3125 874680.625 4317888 17713938 234505.7344 419937.4375 830454.375 439200.875 3156734.75 1639902.5 411439.1875 1545703.375 960328.5 1079504.625 400148.4375 280379 872622.125 67207.7891 635169.3125 391023.1563 94912.6328 186647.4219 197061.7031 1477936.375 3218940.5 180149.7656 1479029.75 2413333.75 26845.3242 17375416 1292803.125 265872.2188 1391859 169472.5 1120754.5 383374.8438 9817198 1403993
dimethylguanidino valeric acid (DMGV)* 416664.1563 37532.6914 206271.5781 87600.0703 516419.5938 2721224.75 91059.8984 88499.9844 149083.9219 580282.5 123200.1016 263287.8438 1423559.625 263910.2813 272417.375 917063.5 101724.3438 208538.4688 555661.25 108624.6641 76121.7813 192533.1094 250238.7969 644989.0625 346973.5625 89748.4141 158211.8281 293010.2813 213757.75 473819.4375 292955.875 89400.7656 114391.4453 517798.625 36658.4453 3680213.5 11262412 2472783.75 479646.9375 17603576 1361959.125 260894.375 267425.5625 50986.3711 24411906 3204959.25 623907.75 9811520 498077.7813 36723540 6799602.5 917398.625 1333234.875 697262.25 518881.3125 43010.6523 47933.4023 9978158 4966827.5 481934.2188 2870640 4098712.25 11945082 12142862 4462773 12120879 7033495 831488.1875 455666.1563 677610.8125 12180804 744436.25 221992.0156 3156062 5827749 1252105.25 785135.6875 16342384 8476378 3789264.25 404804.0625 430112.2188 112747.125 525846.1875 36175.0313 404816.8125 7516994 673561.875 23080.9043 4503656 879089.625 1291909 919753.6875 417193.25 12534436 85771.9531 80068.6641 23019106 253853.2031 8056599 2450658.75 1362818 5528463.5 4678910.5 13655114 556148.4375 23584102 153149.9375 11950186 292411.2813 783864.0625 1304956.875 2265928.75 13352517 10690102 725185.1875 3285109.5 1094268.25 112996.2422 9057060 412646.3125 1195727.625 6370532 9071079 28576324 1504645.25 112144.4219 341736.8125 378606.8438 401985.7188 544015.25 443579.2188 4323701 122743.7656 26628874 182349.7031 180591.5313 73413.7656 987752.5 1308272.875 708114.1875 6532193.5 1347597 165148.9531 2489770 104167.3438 221479.5 3103875 25590448 9148792 4480271.5 352887.3438 7143036 343671.8125 480884.5625 13078427 4150895.5 3165787.75 6282826.5 4533678 17176090 603606.0625 4192899 18149210 41117.9883 64117552 2671895.25 8949830 505412.625 926724 254479.375 22017854 3829180.5 4648042 2966168.25 1347597 1339398.375 76533.7734 30898052 2305191.75 4790542.5 4684471 7827758 13052830 95679.1875 724719.1875 10104450 4847828 648028.4375 1126459 462224.625 120864.1875 12316337 15040367 4485340 1496436.5 16095362 23529970 96384.0234 11669300 1953327.5 5033933 3745966 2338360.5 510247.4063 5063855 8408417 18958728 14490878 490638.9063 9621601 17716594 27447822 541210.3125 8426995 5462197.5 25088512 503043.125 4072781.75 5072112 1856675.125 2307162.25 5972527 50073.7305 1780806.625 1992079.375 11846798 672265.1875 10725631 204361.75 18671204 1570507.75 4677794.5 891834.1875 292139.5938 2414182.75 9217841 721346.9375 8288644.5 4165485.5 22443.752 20936626 2630742.75 17719892 4536759 5140219.5 837333.9375 310236.0625 23600752 9940731
5-hydroxymethyl-2-furoylcarnitine* 1058595.75 833090.125 5351818.5 356035.2188 870784.1875 510437.375 773168.9375 1420364.5 407555.5 1195943.5 2248120.5 3211597.25 827217.375 495526.0625 2908274.5 473387.1563 551449.875 103855.1172 5935676.5 1436823.25 1834084.5 1993185.5 1855155.25 2247634.25 1181944 3124673 273961.7188 120371.4297 2571438.75 7638758.5 248397.5781 323113.0625 2003180.125 598956.9375 419357.8438 1138362.5 2024586.625 2105429.25 469418.5313 6303892.5 1038636.063 2977932 867452.125 1167944.5 2826800.5 1081604.125 885095.0625 1139065.625 651378.5 1052268 617079.5 1290006.875 461982.7188 998343.0625 5540872 3648814 889328.25 1619018 601536.25 6171384.5 7654580 3456776.75 7936047.5 2007187.75 2915155.5 7162940 585460.0625 1120962.125 3084631.75 2926850 1181944 678847.1875 205686.2344 9927758 287999.875 6772271 17644780 1146048.625 2158790 5675191.5
"hydroxy-N6,N6,N6-trimethyllysine*" 1046753.5 868802.9375 1667791.375 1062346.875 687111.125 1573495.125 423548.2813 1193663.375 1545916.125 3141277.75 1142633.125 1294219.375 1374407.375 785606.125 949812.125 1116272.875 863493.1875 937015.375 965072.0625 1924356.625 948119.5625 1558589.625 1977653.375 945684.3125 2448208.75 834637.75 1720062 577453.8125 1167560.5 1568508.5 1157249.25 782217.375 1648319.875 1743584.75 1703678.5 803635.9375 1336984.625 2147385.25 951538.1875 1364219.875 741749 1838948.125 883425.375 1272543.125 1927639.25 1304171 1426486.625 1008766.563 1046350.125 1074850.25 15488409 4639159 1478857.625 5374280 15154838 10773482 996414.125 676692.4375 503381.6875 11753557 6716251.5 1920408.625 12008659 1004902.875 16669566 520761.3125 10937931 572398.25 4596133 858248.3125 10811654 867321.125 970456 1159985.375 21688658 5820020 758726.75 1998193.375 4678673 6287687.5 7584995 10892685 10225801 7054107.5 552380.5625 3187119.5 635203.375 6224306.5 1560628.875 476793.4375 1622143.5 506738.7813 14567520 8954784 5220878 4506904.5 20428822 10953280 12360139 385770.7188 1421044.5 1881243.75 10071423 1963350.625 669615.9375 5613068 3335255.5 843767.5625 633324.9375 681079.3125 2224220 8378453 2276839 1661689.25 912243.0625 2023385.75 2042326 10765150 3037626 2843203 10609200 25378716 659154.3125 11661137 10286923 2293646.5 1776962.75 3981904.5 7245698 19763526 1199805.375 11089343 954009.75 14948319 1513793.25 547812.0625 3847332.25 1134312.875 1471227.5 19421444 2331157 2735132.75 22437044 6017899.5 430693.2813 781204.3125 1074372 1201409.75 9363768 1402963.625 3233042.75 5312449.5 570165.4375 4818433 26668216 4188999 1534348.75 2547359.5 4773718.5 1184579.625 1419080.875 1109731.5 5162208 1111347.625 16323719 3948790.75 4380635.5 1613789.25 2368497 3151355.25 2613375.25 1608033.75 14755890 2209194.75 1282969.75 1097534.125 4833057.5 2953000.75 771395.1875 2239245.5 1791891 16084779 1326571.25 21306944 8897026 1052089.375 8620818 2224220 6889278 15251447 5018309 14409763 456956.4375 7103520 1120653.375 31810064 1119805.5 14223866 26998058 1492773.375 32580594 735175.3125 5240773 5630438 948800.5 1634963.375 1944340.625 1113506.125 11347804 4971673.5 3404700.25 1589249.5 1183044.875 3555889.5 8035970 1305231 1100924.125 16031175 5420544 3884918 4191715.25 1455715.875 24891480 7273965.5 1604348.625 919646.5625 1039942.5 6509249 3201059.75 3668978.25 1515431.375 4547261.5 1251131.5 19583042 15530351 4101533.5 3602039 19791522 22917404 813616.5625 4180205.5 8486086 4192389 5724590.5 3385130 1253557.5 4881341.5 7830553 4878381.5 23742870 585716.5625 4211039.5 64900456 16596284 1829048.25 38049840 5753455 24235080 748070.3125 1341177 12927785 1547563.875 447112 7951922 5798470.5 1320320.5 2059284.875 4206572.5 3676003 1601359.875 14617230 1549241 15567392 680723.0625 1490743.75 447345 10005968 2298123.25 1422043 2503139 891074.5625 705550.25 2536902.75 13461155 5967252.5 4633597.5 11105507 1005086.375 8235567.5 3647636.5 1314851.625 7193814.5 3074657.25 38171656 713083.0625 3498452.5 3852749.5 677048.625 45573536 13178472
levulinoylcarnitine 42328108 614610.4375 368413.9375 1579235 453776.8125 417234.7813 122639.0859 117282.7344 896387.0625 353178.5625 537665.3125 802689.3125 2096181.25 473828.2188 193761.7188 616552.75 329844.9063 915587.25 898269.1875 1872635.5 1182615.625 795456.75 1024367.938 847292.6875 8941145 2455866 1687025.375 196428 3746618.75 619376.125 959307.0625 1045149.938 630222.8125 697006.125 1233391 2669081.75 3138541 831074.6875 531513.6875 1245855.625 1142561.625 1342860.875 919526 418792.0938 598091 410382.2188 1734284.625 4371426.5 266920.9375 1572828.5 815522.4375 1232087.625 1414434.75 1179415.5 514158.8125 3402122 2354283.5 865313.9375 5396195.5 1149001.375 586457.3125 4165064.5 145623.5469 229203.875 2144692.75 1171972.75 2788381 1221898.625 328668.1875 454453.375 922315.9375 4557740.5 2450408 290671.8125 845070.5 1270501.25 767250.6875 587942.1875 19419068 246339.6563 307421.75 1488827.375 19001364 1431725.875 705986.125 336223.4688 2087288.5 887737.9375 8367793 3125485.25 539139.625 342681.8438 940782.75 770173.375 11781359 466680.3125 510919 1661703.5 492662.875 721089.6875 1122096.875 2027572.25 662283.625 599913 239581.1719 404987.8438 821958.4375 692980.375 1019245.125 380482 294774.2813 953417.625 135996.1719 1471763.75 1267611.75 395207.0938 20956342 1067121.125 1407738.75 1357983.125 673296.4375 486744.7813 2135376.75 498660.4688 891350.0625 3120863.5 847650.375 325347.25 2362771 521345.5625 3790342 598173 352602.9063 7673855 423314.5 708551.75 1206366.125 400827.625 660665.3125 813883 703057.9375 2082490.75 1786961.375 400164.4688 350249.875 2481278.75 1252808.5 5148845 1587727 375704.0625 18291504 2084989.125 372109.6875 5061134.5 532778.125 2820219.5 302551.0625 1957492.625 1220893 1610191.625 3055344.25 1516396.125 316740.25 2488638.75 3344598 4513798.5 6949338 337591.375 620300.25 2021412.375 1947645.5 3859675 1206329.125 307435.2188 879744.9375 520506.7813 274341.7813 363074.1875 612124.3125 897778.5 708326.5 1698780.375 1683037 1664171 509946.9375 3061236.25 2748446.75 6818718 2098374.5 4022857.5 1935019.75
(S)-a-amino-omega-caprolactam 526728.375 343281.0313 753494.6875 770798.125 245745.0938 1665394 283525.9063 1125284.25 521555.625 1282487 1076274.25 464164.6875 648961.375 677962.25 183354.6875 789247.625 393459.2813 456330.9375 751352.6875 683866.75 533444.375 584899.0625 919236.625 424894.5938 1282404.5 608603.125 1135026.5 407433.0938 193137.7969 352068.5313 340649.5 313499.5625 843666.5 400584 796391.1875 403080.5 1079215.625 532508.875 408333.7813 288571.25 423397.1563 425841.0625 945565.625 543465.1875 868479.1875 304050.5313 2995433.25 1826386.5 737947.25 822370.375 1406605.5 1915993.625 512085.9688 426310.0938 3842705 626275.0625 415458.4688 746198.8125 801068.5 4022320.25 706618.25 1299134.875 678510.4375 744053.375 704150.25 362554.0313 756510 441737.4375 102217.1406 4366096 2009151 844802.8125 1478238.25 1830862.875 2159747.75 1896215.25 1639427.25 2164581.5 747507.875 627600.4375 1707574.5 574118.6875 705967.125 518804.5625 2407368.75 531369.25 499340.2813 1361852.125 2227983.25 2492866.5 811343.6875 267154.9688 718764.375 313670.25 971691.3125 432293.5313 923221.8125 1216026 309128.0313 347767.5 412581.3125 571250.0625 1063876 1298108.125 1167188.625 733641.8125 684734.875 256190.9531 4003519 543595.125 582154.875 829404.5625 4661494 194105.0781 346388.0938 392526.8125 1456436.25 635727.5625 498737.1563 1581279.75 2357195.75 5777281 616557.5625 2462142.5 772776.75 372322.9063 812792.6875 661087.6875 393325.8125 2610764.25 308100.9375 783390.3125 734557.5625 632152.5 155134.8438 335850.5938 412885.1563 463404.3125 1234709.625 807988 765889.3125 1128018.25 2454328.75 909164.625 312315.2188 631347.0625 845262.25 505924.9063 252065.7813 809930.0625 514405.7813 591271.8125 909953.8125 756510 1173461.375 1081396 675612.1875 443797.2813 517369.5313 200959.6875 5061442.5 472311.75 351055.0625 961243.5 839434.75 622604.6875 943225.3125 2756094.25 753380.0625 2175279.25 1217487.5 453209.125 1112769.5 802041.6875 1543538.125 472493.0625 988264.5 1689247.125 258105.9375 2202383.75 1159351 5096664 658649.25 2476423 2813569.5 855175 2602513.25 241019.8438 948837.75 887641.0625 496434.0313 338006.2188 354701.1563 436590.0625 1430381.25 1331053.125 1280869.25 756510 303985.9375 730442.125 1885166 673976.875 289881.625 4399686.5 1092030.75 702487.875 297918.5313 3189842.75 1412095.5 364174.4688 691512.625 777694.25 1400538 1320527.625 1264765.75 1195269 792780.0625 681925.5 2683805.5 2651041.75 523981.5313 671680.3125 3260799 1724547.875 488698.1875 731418.375 1127038.25 668249.375 945768.375 803953.75 248705.7344 1217586.25 2185536.75 880549.625 3335606.25 421298.625 1481560.5 5457196 3006837.5 454014.5625 2093979.25 522455.4688 6154595.5 134589.8906 1721355.25 2498483.75 397648.625 3366925 1428560.125 408510 977026.9375 2023871.625 879378.6875 1910426.5 221265.2188 3690763.25 191056.5781 437552.375 372713.875 1483089.125 621653.5625 628806.5625 722052.4375 519142.5313 318685.1563 1121153.625 6744107 2361355.25 2325377 2402222.5 162898.7344 3209549 1018733.25 552725.125 1811399.375 3014655.75 584150.75 669176.875 458281.1563 6782293.5 2070515.875
(2-butoxyethoxy)acetic acid 24793.3945 62819.5391 37704.3164 78588.4375 52977.8828 41823.0195 58792.4844 65434.7461 82383.2188 67207.6016 97630.2031 51450.9336 82050.0938 64697.1016 118744.25 69208.9219 83201.9766 148643.8594 56573.9375 111237.5234 92137.25 109710.1016 45992.3594 88346.0156 99823.9297 59676.1953 115940.125 25406.3691 72371.0859 811600.625 378771.25 43406.2813 12671215 2937471.5 142862.5 18706.6348 72326.0781 204551.4375 322014.6563 60346.3555 1788994.625 116804.8828 1629150 349286.125 51128.0664 2376565.5 510409.625 4133985.25 107713.2266 249873.2969 1039156.438 537414.5625 124486.7891 577772.5625 2077855.375 1500884 225788.6406 482147.4688 899359.0625 724173.75 91252.3906 1494473.875 111150.5 187418.2656 337437.2813 366832.8125 83450.1484 588547.5625 760296.1875 445382.0625 1545430.625 700653 204347.1563 911701.875 89521.5234 197732.1719 512083.8125 450634.875 300456.375 59688.0078 371814.8438 221560.7813 128268.2734 379300.8438 123929.8906 108454.1328 643653.625 137274.5781 102000.7734 260476.8438 307771.6563 128469.7656 290996 180185.5156 797778.0625 1098193.125 405021.25 1361512.5 2336230 285044.2813 65264.7344 1399871 313093.7188 798451.125 415570.25 759114.5625 272309.125 1068465.75 275675.375 116821.2813 405839.625 147791.7813 252273.6875 455501.1563 290996 277700.4063 1217500.875 1192176.25 163495.3125 104316.7422 366440.875 554679.125 323781.125 78153.6641 249151.4844 118888.3672 874446 621880.9375 434831.4063 307164.5 474464.6875 411160.375 124769.8281 230784.4219 166181.9844 325726.1563 98821.3438 1093625.25 390777.8438 662933.625 306113.5938 283967.9375 206870.4063 157805.3125 334512.0938 912807.5 357807.5313 49645.7852 195262.1406 363557.5 62445.9297 181031.3281 564760 631908.125 183981.0156 728791.75 418336.7813 648893.9375 713495.375 389844.6875 665357 855979 216284.3281 365343.6875 441121 1262310.875 153128.3281 289613.7188 735800.9375 421617.8125 748733.625 410108.4375 762196.5 78813.2344 96694.1563 177581.6406 290996 571349.5 305004.1563 341117.25 87088.9297 302240.9688 210841.7656 366077.6875 184127.2188 241280.7813 622305.875 207632.0156 310022.5938 281781.9688 164848.1094 670808.25 395245.4375 121289.9766 189766.9063 714705.6875 310223.1563 154074.0313 153091.0469 1120682.5 293239.8125 1392528.625 1050488.5 238386.8594 194418.4688 449721.7813 512171.9063 218624.9063 627820.8125 705082.9375 422368.6875 460997.375 182813.3438 299056.0625 514386.3125 65171.6836 181987.0625 75394.6406 758316.875 445317.25 889384.8125 90516.1953 874087.3125 292558.125 766058.1875 181557.3125 277283.875 88365.6016 63626.2148 231493.4063 254169.7188 556103 510245.2188 252797.7344 867263.625 503214.5313 253307.7344 54729.8633 801040.625 197990.5781 277292.875 172515.0781 139074.6563 85883.4609 360907.6563 131417.2969 178009.6719 296830.2188 2184315 245988.9688 118065.6094 294184.1875 462355.0313 320900.1563 64576.3008 133152.375 719404.375 310955.7188 611330.9375 301722.7188 76934.4531 626507.4375 263972.4375
S-carboxyethylcysteine 323104.1875 788563.375 413424.4688 241512.1563 487992.5938 275169.4375 422458.5 423446.9375 453639.5625 1257209.5 529050.625 288082.5938 456994.6875 193741.2344 616212.0625 281331.1875 392987.0625 551952.875 428299.5625 339928.0313 199958.1875 732779.25 509786.4375 631580.6875 3805227.75 276259.0313 194637.8906 294953.625 388200.0313 131361.5781 368182.2188 271182.7813 326417.4375 418749.8125 515324.6563 547365.9375 377298.5313 423250.75 434673.6563 362919.5625 245346.4688 232666.375 278356.2813 276923.7188 285064.2188 716230.25 314776.75 807266.625 414159.4688 381884.1875 617837.5 409808.25 352031.5313 193975.2031 329240.5313 425957.375 631200.1875 185209.2969 117639.7266 670643.25 199987.9688 151893.7344 415675.5625 229320.125 458522.8438 57699.5859 863333.875 433377.375 308030.25 59979.5664 293025.4688 55275.0313 199050.3906 61646.1758 486298.8125 331683.4688 184649.375 110504.4922 149144.9688 287507.7813 553737.8125 443072.9688 562321.4375 216101.1563 64862.8594 208479.625 82148.4609 334350.75 84964.6953 100767.7109 87614.4453 109724.6406 378839.25 533041 444107.8125 243117.4219 632082.5625 256629.0625 839338.875 100754.5625 151992.75 213547.7969 137927.3281 139416.9375 130957.7109 337666.4688 181405.5313 91596.9688 88022.7813 520574.75 432925.2188 170814.4063 177627.1719 149691.7344 152693.75 105785.9375 506739.75 189767.5 163354.9688 335644.9375 659083.875 201638.8125 304945.8438 456708.1563 270687.4688 130304.9063 243441.6406 200580.3125 729203.3125 224048.6719 846312 197664.9219 920694.75 172343.1719 106544.7031 273902.9688 114771.1641 111824.4219 1165893.625 549467.9375 88142.6875 279020.9688 446822.5 140472.375 172188.0781 135193.7656 176599.9531 332955.5 235326.9219 251698.4375 211167.8125 73054.7969 423206.7813 1256690.5 324799.4375 60012.7891 484103.9063 351756.7813 139408.75 88797.1563 72023.0469 269854.0625 190844.1875 727718.875 291382.75 253021.7344 145251.625 174115.1875 217337.375 144681.8594 231713.6094 566686.375 158729.2188 503440.875 237281.5 270682.3125 233571.4063 101153.8906 217514.4688 515274.0313 865336.9375 174358.2656 676055.75 208915.125 201916.2031 388723.5938 161194.0938 494783.2188 456508.5938 349536 903058.25 143413.6406 319327.2188 158855.7031 917880 103459.3672 582798.3125 1899383.875 100614.9141 959136.625 144368.375 297228.2813 246973.0938 140054.4063 210689.875 175721.7813 56826.75 440962.4688 203764.7188 481533.3438 221341.1719 88404 298192.125 312015.8125 357102.5 286607.2813 1125813 414182.8438 264091.9688 349258.8125 139699.125 1252641.5 220426.0156 259150.5469 179388.4219 87558.375 261444.875 209998.1406 516506.3438 336620.2188 634939.9375 123003.125 500660.5313 513683.9063 250004.5313 241948.5469 522696.4375 388006.4375 122405.8516 308834.875 512407.0938 415191.4688 194891.5156 279549.0938 93712.7891 366904.0938 651493 558019.125 649378.625 73300.1797 184827.5156 762477.0625 1951998.5 113047.5547 1358370.125 351139.7188 3866580.25 106476.5078 271077.2188 611727.5625 202732.8125 91333.6094 382745.5313 123603.4141 104250.7656 85634.1484 161608.6094 280110.5313 123592.6953 828586.75 198319.3906 631466.0625 107595.2578 116310.6406 308523.5 86985.7656 263601.3125 175469.875 539864.3125 103578.6875 189477.4531 960293.4375 481668.75 296031.8438 319351.25 101407.3594 238881.6719 207129.3281 317195.6875 714268.6875 140737.4375 451126.5625 51933.7188 94963.4219 272869 92037.5781 1162097.75 323174.8125
N-acetyl-2-aminoadipate 209824.9688 197207.1875 182977.1094 246550.7969 204532.5938 391581 236254.2344 192596.3438 371089.875 412864.0625 284705.9688 299674.375 260458.0156 166793.9219 149460.125 292749.6875 238660.6094 130015.5 203194.7656 198462.9688 196066.0469 216357.3438 326218.2188 303262.2188 379329.0625 163373.7813 328291.8438 140645.4844 276201.7813 192210.125 93628.0859 227814.2656 264600.6563 313175.0313 266273.4063 134789.4844 403505.3438 355383.4375 175094.5625 144808.2813 215801.0781 342696.25 199791.9688 193486.0156 288145.5313 259237.7344 365277.7813 174496.125 164975.1094 178497.4375 1370201.125 1208973 373416.3125 581233.5 1969134.375 1544949.375 274320 293301.8438 79647.5 2177890.75 630226.875 85624.5547 3179972.25 278951.875 1534172.25 177735.2188 972487.4375 117650.1484 420523.9375 155472.9531 1651525.75 79358.2656 345246.4063 201251.1406 2142671 906119.1875 145969.4063 438255.25 867180.5 1240760.875 1493794.625 1970327 1159373.875 1041029.563 189449.5313 1781838.75 117764.7813 571156.75 137638.5313 185376.1406 859168.3125 76742.5781 673407.3125 935325.0625 637297.75 2919927.5 4961286.5 1715545.375 1167366.125 182340.7969 340378.9688 334024.3125 1469088.25 298856.0938 227472.1875 728808.9375 321036.3125 195863.0625 155672.7813 192006.3281 261695.9063 624834.625 290327.5 313229.25 179544.2031 481070.6875 450936.125 1957976.5 320629.3125 275726.1875 832478.25 2731762 74253.1016 5254112.5 1342623.375 411623.0313 314577.5938 508141.5313 757608.8125 2028343.375 1697923.5 3812112.25 289977.6875 835972.5 112859.1094 89911.8828 661915.25 262663.25 254582.7969 1668657 232076.3438 465286.3438 1401136 470024.2813 93432.4922 153197.2969 92235.6016 237247.3125 830532 1679094.25 404525.125 796321.3125 101741.6484 693978.3125 2500870.25 540346.0625 1037371.438 528317.75 679704.1875 110221.0859 357033.8125 194658.4063 551533.625 200018.1406 2216958 1000687.188 728600.625 368781.8438 284614.0625 299552.8438 449621.6563 577064.375 2136589.25 552694.5 207695.7656 395586.375 799179.3125 693966.625 190479.9844 442697.1875 181249.3281 1083795.25 252469.25 4903531.5 899952.6875 215554.375 790256.125 280252.9375 558625.4375 1205761.5 428862.875 1545153.25 476290 2154235 316802.6875 2517747.5 206044.4531 2146664.5 1920728.375 197967.8594 1742628.625 144571.875 1224429 761138.5625 82450.2813 174588.5313 410323.2813 926182.4375 1277355 3859278 798310.3125 278951.6875 175176 594317.0625 858950.4375 267354.5 155585.2344 2503754.5 723538.625 491498.5 520773.4688 241262.25 10257271 981623.5625 163804.875 156622.5156 428945.25 1599531.75 474158.625 346156.1875 786892.5625 1380512.625 287477.8438 1233902.625 2694178.25 534234.125 1041553.813 3205215 4284977 357417.1875 502873.625 741224.5625 374043.2813 627198.5 485276.7188 374583.375 1356303.25 1295184.375 1192229.25 2084281.5 155693.8125 874013.1875 5288347 2313084 798846.5 17662858 787035.1875 4056252.75 141328.5938 304517.5 1038226.75 628560.3125 135874.4688 4235515.5 383288 786708.4375 443637.0625 1549516 1487735.5 255185.125 1216451.75 449199.3438 2313557.75 295878.125 416694 117558.375 414438.4375 259576.3594 200926.1563 402101.5625 288819.3125 164154.0469 530297.5625 2000628.75 821129.9375 826559.0625 1562007.625 1416485.25 486265.2813 103790.2734 1181594 540799.1875 2522199.5 152729.2344 315358.625 707641.375 182638.8906 4079910.25 1222446
3-hydroxyoctanoylcarnitine (1) 992266.75 1344574.25 1410338.875 820143.875 194997.6719 1367617.375 316838.0313 1392139.375 453518.2188 4233925 871614.625 2001186.25 875105.8125 359743.7813 744439.9375 1298093.625 991554.9375 1563650.875 2613176.75 380227.75 3296599.5 3713365.25 1451671.25 3155008.25 462836.7188 3280536 2774547.5 1870537.125 1504985.625 1515967.375 1031788.375 499486.3125 5223917 3021794.5 1137303 226679.3125 769976.125 2117606.25 382615.3438 1496425.375 716667.5625 3285959.5 717501.25 745762.25 5912075.5 295257.6563 2143991.25 617462.0625 1031151.25 246780 14385872 12486466 1443015.625 3104351.5 22018220 6227879.5 491170.8438 2112329.5 974673.5 4528769.5 3560775.75 3832996.25 14106045 3229188.25 12969059 959052.3125 9896520 1301288.375 9829854 3276196.5 7161688 2005941.875 2366933.25 1446817.5 8152428.5 6998134.5 3356181.5 2415339.25 5022750 8512558 10225982 16323768 8083498.5 14768123 1623423 3987827.5 2440202 12099295 2380777.5 827857.25 2828913 1248117.5 8539385 5863175.5 5301277.5 5284992.5 17766856 8304797.5 10239823 643209.1875 2639654.75 2201734.25 10975649 1987234.125 1229167 11547160 3180196.25 2523421.75 1063032.375 3204982.75 1030628.625 6747069.5 3949103 4297651.5 1673156.25 4229898 3434438.5 23571360 8218032.5 3842761.25 9275557 34228076 816022.9375 11598554 4363639.5 5134364 2934467.25 7643790.5 2766045.75 41156636 2196629.25 3167316 2312552.25 11037302 2145613.25 2223651 3349016 2151153.25 1739801.75 22691792 1338886.875 3024627.75 20701430 5435325.5 1700965 215977.1406 2754865.75 2154931 12757630 3212912.75 3207006 7355669 1148095.25 13088466 18570042 2648841 3903403.5 2149113.5 3765080.25 3394140.75 1370889.25 1733068 2452833.5 1839294.25 23366456 3276196.5 20205882 7170201 4614751 4373995.5 3224922 2718680.75 12508804 4549920 941966.0625 1536370.125 10045871 4406575 1168379.75 4429283 5051941.5 7010982 1606082.375 12840835 8502668 1693547.75 8249547 1850778.75 6600676.5 15371628 4723325 4052685 2737875.75 2871457 4212010.5 7672230.5 1566534 15338537 2674808.25 1872334.625 25411106 1239671.875 10871398 7267826 625552.125 1971434.25 1876476.375 4272523 12436708 6124251.5 8202401 1087375.375 3102282.25 13121106 7221615 5028975.5 4843813 8330438 7251856.5 4353472.5 1738340.125 1797657 28964252 19863916 2636375 2139547.75 1705546.625 5464511.5 1970784.875 3188365.25 3579507.75 11298111 3305213.5 12421995 17327536 3392033 4116853.75 17672072 5293800 3174767.25 3325623.25 10653856 5243401 2724518 2037030 2040621.75 11779362 7914884 7283114 6648041 900802.6875 9844694 10717416 4516556.5 4489121.5 12127412 2649194.5 4693679 753076.1875 3271857 15685056 3522016 2214662 13753635 3737477.5 3012850 2028281.625 5283500 9112701 2174095.5 5171898 2017301.625 15385589 2771938.5 2177908.5 1186077.25 6962527 2545022.5 3217016.5 3597259.25 1377174.75 965717.3125 2721018.75 8875449 1803499.625 4517302.5 6564532 3680444.75 9941056 4359468.5 2255330.5 637529.8125 3289741.75 6095468.5 1663160.375 7165935.5 4709981 1901357.625 9319429 12255460
3-hydroxyoctanoylcarnitine (2) 394840.4063 532863.4375 628995.75 448131.5625 91277.0391 709227.125 122195.1172 558233.9375 227619.1563 1630991.375 456255.3125 936868.125 498489.4063 130031.5703 313158.6563 679812.25 438526.5 823969.6875 1298310.875 208116.0938 1858446.5 2029520.625 637995.9375 1545112.125 178317.6094 1968380.625 1638045.5 997580.3125 716919.0625 730471.0625 630542.625 372352.875 2364037.75 1414469.375 654024.4375 91552.4531 437758.8125 875692.8125 233910.1719 652841.25 358336.4063 1121502.5 332608.5625 293876.25 2445897.75 121427.8281 697821.5 297463.5625 307565.8438 150331.75 5293950.5 3647508.75 525035.125 1123486.25 6277939.5 1677235.75 154650.4531 1083821.75 450367.6563 944717.625 1692432.25 1626777.375 4641505.5 1824219.375 3196430 456980.9375 1970272.875 583726.125 3605679.75 1464905.625 2516819.75 964542.125 885750.625 607980.625 2731247.5 2574847 1232169 905785.3125 1539168.125 2723168.25 3589698.25 6464514 2448763.25 5154744.5 763366.4375 1319122.375 973579.8125 4545265 893152.875 404372.4063 1206828.625 528602.3125 4079298.75 2194596 1576130.5 2954451.25 5238572 2746358.5 1866759.5 384402.625 728762.625 916870.8125 3588892.5 781245.375 602178.125 4798654.5 1073636.375 1004652.063 480210.2813 995521.0625 613111.875 2365699.25 1594250.5 1601988 841532.875 1558343.25 1312705.5 9170493 3253218.5 1174758.75 2304980.75 8634786 355236.0938 3652838.75 907185.4375 1830960.125 1103503.375 1907869.375 914042.25 10205433 713642.5 766042.375 1363315 3365528.25 809606.5625 730691.875 1154763.125 968197.9375 885374.125 10580937 879419.4375 1159970.25 8010405 1140545.25 929210.8125 155853.3281 1135925.875 961471.6875 4267096 1199882.375 998619.375 2064138.5 469839.6563 3927544.25 5182418 1169089 1315379.625 746138.3125 1512201 1417200.25 593073.4375 788901.25 802442.4375 909351.4375 6146093.5 1232169 8183210 2874061.75 2313293.5 1712960 1071656.125 1258238.125 3271415.5 1903134.25 446187.5313 628173 3160562.5 1706449.75 528200.25 1706542.125 1896717.625 1854001.625 573642.25 3602321.75 2925754.75 694097.25 3580171.5 715171.25 3032128.75 4860897 2252768.5 1206099.875 977444.875 1037757.625 1821991.5 1799548.75 533893.375 5120353.5 684048.75 680380.875 6867120 524671.5625 3318902 2346208.25 206876.9844 723888.4375 595439.9375 1520125 3144857.75 2071306.5 3153856.75 416699.5 1488509.5 6070446.5 2421468.25 1857389.75 1917109.875 2401019.75 2396437.5 2018884.625 546466.3125 811642.625 8562694 6515184.5 1144946.125 742271.6875 771227.25 2207901.25 629949.4375 1267263.875 1083044.25 3929491.5 1179574.25 3530213.25 4652615.5 1467848.25 1662049.25 6205764.5 1436370.875 1515212.375 1670601.5 3964017 2293389.75 850994.9375 675019.1875 1058698.125 4535973 2081290.75 2011876.25 1953319.125 478210.4063 4033162 2686215.25 1179605.375 1763493 7593249 807205.75 1048791.125 341679.4375 1170384.75 7338028 1388481.25 1071755.75 6719724.5 1806181.375 1084921.625 897098.25 2000730 2390787.25 831093 2548235.5 1028480.563 4649786 1065453 740732.375 531828.75 2224758.25 1187201.375 1334894.25 1613537.75 527049.625 457130.2813 1042190.75 1238951.875 681095.4375 1979485.125 1826664 1457931.125 2731234.5 1825289.25 906623.8125 227331.8438 1567837.125 1700588.75 722173.125 2081078.625 1927230.25 797129.625 2280071.75 4506534
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name cas hmdb kegg pubchem platform
S-1-pyrroline-5-carboxylate 2906-39-0 HMDB0001301 C04322 11966181 Pos Early
spermidine 124-20-9 HMDB0001257 C00315 1102 Pos Early
1-methylnicotinamide 1005-24-9 HMDB0000699 C02918 457 Pos Early
3-phosphoglycerate 80731-10-8 HMDB0000807 C00597 724 Pos Early
"5,6-dihydrothymine" 696-04-8 HMDB0000079 C00906 93556 Pos Early
hypoxanthine 68-94-0 HMDB0000157 C00262 "790,135398638" Pos Early
quinolinate 89-00-9 HMDB0000232 C03722 1066 Pos Early
N-formylkynurenine 1022-31-7 HMDB01200 "C15605,C02406,C02700" 910 Pos Early
N('1)-acetylspermidine 14278-49-0 HMDB0001276 C00612 496 Pos Early
"N6,N6,N6-trimethyllysine" 23284-33-5 HMDB0001325 C03793 440120 Pos Early
N-acetylputrescine 18233-70-0 HMDB0002064 C02714 122356 Pos Early
AMP 149022-20-8 HMDB0000045 C00020 6083 Pos Early
5-methylthioadenosine (MTA) 2457-80-9 HMDB0001173 C00170 439176 Pos Early
arginine 1119-34-2 HMDB0000517 C00062 6322 Pos Early
argininosuccinate 156637-58-0 HMDB0000052 C03406 60150382 Pos Early
aspartate 56-84-8 HMDB0000191 C00049 5960 Pos Early
beta-alanine "107-95-9,56-41-7" HMDB0000056 C00099 239 Pos Early
carnosine 305-84-0 HMDB0000033 C00386 439224 Pos Early
phosphocholine 72556-74-2 HMDB0001565 C00588 1014 Pos Early
creatinine 60-27-5 HMDB0000562 C00791 588 Pos Early
cysteinylglycine 19246-18-5 HMDB0000078 C01419 439498 Pos Early
cystine 56-89-3 HMDB0000192 C00491 67678 Pos Early
cystathionine 535-34-2 HMDB0000099 C02291 439258 Pos Early
gamma-glutamylglutamate 1116-22-9 HMDB0011737 C05282 92865 Pos Early
glycine 56-40-6 HMDB0000123 C00037 750 Pos Early
guanidinoacetate 352-97-6 HMDB0000128 C00581 763 Pos Early
hypotaurine 300-84-5 HMDB0000965 C00519 107812 Pos Early
inosine 5'-monophosphate (IMP) 4691-65-0 HMDB0000175 C00130 8582 Pos Early
isoleucine 73-32-5 HMDB0000172 "C06418,C00407,C16424" 6306 Pos Early
2-aminoadipate "1118-90-7,542-32-5" HMDB0000510 C00956 92136 Pos Early
citrulline 372-75-8 HMDB0000904 C00327 9750 Pos Early
saccharopine 997-68-2 HMDB0000279 C00449 160556 Pos Early
leucine 61-90-5 HMDB0000687 C00123 6106 Pos Early
lysine 56-87-1 HMDB0003405 "C00739,C00047" 5962 Pos Early
methionine 63-68-3 HMDB0000696 C00073 6137 Pos Early
nicotinamide 98-92-0 HMDB0001406 C00153 936 Pos Early
ornithine 3184-13-2 HMDB0000214 C00077 6262 Pos Early
phenylalanine 63-91-2 HMDB0000159 C00079 6140 Pos Early
phosphate 7664-38-2 HMDB0001429 C00009 1061 Pos Early
proline 147-85-3 "HMDB0000162,HMDB0003411" "C00148,C000763" "8988,145742,614" Pos Early
serine 56-45-1 HMDB0000187 C00065 5951 Pos Early
serotonin 153-98-0 HMDB0000259 C00780 5202 Pos Early
taurine 107-35-7 HMDB0000251 C00245 1123 Pos Early
urea 57-13-6 HMDB0000294 C00086 1176 Pos Early
trans-urocanate 104-98-3 HMDB0000301 C00785 736715 Pos Early
glutamate 56-86-0 HMDB0000148 "C00025,C00217" 33032 Pos Early
glutamine 56-85-9 HMDB0000641 C00064 5961 Pos Early
threonine 72-19-5 HMDB0000167 C00188 6288 Pos Early
tryptophan 73-22-3 HMDB0000929 C00078 6305 Pos Early
valine 72-18-4 HMDB0000883 C00183 6287 Pos Early
adenosine 58-61-7 HMDB0000050 C00212 60961 Pos Early
betaine 107-43-7 HMDB0000043 C00719 247 Pos Early
cysteine "56-89-3,52-90-4" HMDB0000574 C00097 5862 Pos Early
dimethylglycine 1118-68-9 HMDB0000092 C03626 673 Pos Early
alanine 56-41-7 HMDB0000161 C00041 5950 Pos Early
tyrosine 60-18-4 HMDB0000158 C00082 6057 Pos Early
cytidine 65-46-3 HMDB0000089 C00475 6175 Pos Early
cotinine 486-56-6 HMDB0001046 408 Pos Early
caffeine 58-08-2 HMDB0001847 C07481 2519 Pos Early
thiamin (Vitamin B1) 59-43-8 HMDB0000235 "DG00125,C00378,D08580" 1130 Pos Early
adenine 73-24-5 HMDB0000034 C00147 190 Pos Early
cytosine 71-30-7 HMDB0000630 C00380 597 Pos Early
asparagine 70-47-3 HMDB0000168 C00152 6267 Pos Early
hydroxyproline 51-35-4 HMDB0000725 C01157 5810 Pos Early
picolinate 98-98-6 HMDB0002243 C10164 1018 Pos Early
sarcosine 107-97-1 HMDB0000271 C00213 1088 Pos Early
pipecolate 4043-87-2 HMDB0000070 Pos Early
phosphoethanolamine (PE) 1071-23-4 HMDB0000224 C00346 1015 Pos Early
3-ureidopropionate 462-88-4 HMDB0000026 C02642 111 Pos Early
gamma-glutamyltyrosine 7432-23-7 HMDB0011741 94340 Pos Early
methyl indole-3-acetate 1912-33-0 HMDB0029738 74706 Pos Early
4-acetamidobutanoate 3025-96-5 HMDB0003681 C02946 18189 Pos Early
3-aminoisobutyrate "214139-20-5,10569-72-9" HMDB0002166 C05145 64956 Pos Early
2-aminobutyrate 1492-24-6 HMDB0000452 C02356 80283 Pos Early
gamma-glutamylglutamine 10148-81-9 HMDB0011738 C05283 150914 Pos Early
N-acetylneuraminate 131-48-6 HMDB0000230 C00270 439197 Pos Early
N-acetylglucosaminylasparagine 2776-93-4 HMDB0000489 C04540 123826 Pos Early
acetoacetate 3483-11-2 HMDB0000060 C00164 96 Pos Early
creatine 57-00-1 HMDB0000064 C00300 586 Pos Early
"cys-gly, oxidized" 7729-20-6 333293 Pos Early
gamma-glutamylhistidine 37460-15-4 HMDB0029151 7017195 Pos Early
1-methyladenosine 15763-06-1 HMDB0003331 C02494 27476 Pos Early
choline 67-48-1 HMDB0000097 C00114 305 Pos Early
anthranilate 118-92-3 HMDB0001123 C00108 227 Pos Early
gamma-glutamylleucine 2566-39-4 HMDB0011171 151023 Pos Early
3-methoxytyrosine 300-48-1 HMDB0001434 9307 Pos Early
dopamine 62-31-7 HMDB0000073 C03758 681 Pos Early
carnitine 461-05-2 HMDB0000062 "C00487,C00308" 288 Pos Early
xanthurenate 59-007 HMDB0000881 C02470 5699 Pos Early
methionine sulfoxide 3226-65-1 HMDB0002005 C02989 158980 Pos Early
5-hydroxylysine 13204-98-3 HMDB0000450 C16741 3032849 Pos Early
4-guanidinobutanoate "463-003,463-00-3" HMDB0003464 C01035 500 Pos Early
glycerol 3-phosphate 29849-82-9 HMDB0000126 C0093 754 Pos Early
imidazole lactate 14403-45-3 HMDB0002320 C05568 793 Pos Early
kynurenine 2922-83-0 HMDB0000684 C00328 161166 Pos Early
glycerophosphorylcholine (GPC) 28319-77-9 HMDB0000086 C00670 71920 Pos Early
N-acetylglutamate 5817-08-3 HMDB0001138 C00624 70914 Pos Early
N-alpha-acetylornithine 6205-08-9 HMDB0003357 C00437 439232 Pos Early
xanthosine 146-80-5 HMDB0000299 C01762 64959 Pos Early
theophylline 58-55-9 HMDB0001889 C07130 2153 Pos Early
theobromine 83-67-0 HMDB0002825 C07480 5429 Pos Early
gamma-glutamylphenylalanine 7432-24-8 HMDB0000594 111299 Pos Early
1-methylguanidine 22661-87-6 HMDB0001522 C02294 10111 Pos Early
levulinate (4-oxovalerate) 123-76-2 HMDB0000720 11579 Pos Early
hexanoylcarnitine (C6) 6920-35-0 HMDB0000756 6426853 Pos Early
N-acetylaspartate (NAA) "997-55-7,997-55-7" HMDB0000812 C01042 65065 Pos Early
acetylcarnitine (C2) 5080-50-2 HMDB0000201 C02571 7045767 Pos Early
trizma acetate 6850-28-8 C07182 16218782 Pos Early
"2,3-dihydroxypyridine" 16867-04-2 28115 Pos Early
iminodiacetate (IDA) 142-73-4 HMDB0011753 C19911 8897 Pos Early
homoarginine 156-86-5 HMDB0000670 C01924 9085 Pos Early
3-hydroxykynurenine 2147-61-7 HMDB0000732 C02794 89 Pos Early
guanidine 50-01-1 HMDB0001842 C17349 3520 Pos Early
N-acetylglycine 543-24-8 HMDB0000532 10972 Pos Early
1-methylhistidine 332-80-9 HMDB0000001 C01152 92105 Pos Early
butyrylcarnitine (C4) 25576-40-3 HMDB0002013 C02862 439829 Pos Early
isobutyrylcarnitine (C4) 25518-49-4 HMDB0000736 168379 Pos Early
trigonelline (N'-methylnicotinate) 535-83-1 HMDB0000875 C01004 5570 Pos Early
"glutamate, gamma-methyl ester" "1499-55-4,1499-55-4" HMDB0061715 68662 Pos Early
3-methylxanthine 1076-22-8 HMDB0001886 C16357 70639 Pos Early
threonylphenylalanine 16875-27-7 HMDB0029068 7010580 Pos Early
gamma-glutamylvaline 2746-34-1 HMDB0011172 7015683 Pos Early
3-methylcrotonylglycine 33008-07-0 HMDB0000459 C20828 169485 Pos Early
propionylcarnitine (C3) 17298-37-2 HMDB0000824 C03017 107738 Pos Early
prolylhydroxyproline 18684-24-7 HMDB0006695 11902893 Pos Early
4-imidazoleacetate 645-65-8 HMDB0002024 C02835 96215 Pos Early
1-methyl-4-imidazoleacetate 2625-49-2 HMDB0002820 C05828 75810 Pos Early
guanidinosuccinate 6133-30-8 HMDB0003157 C03139 439918 Pos Early
gamma-glutamyl-epsilon-lysine 17105-15-6 HMDB0003869 7015685 Pos Early
N-acetylarginine 155-84-0 HMDB0004620 C02562 67427 Pos Early
N-acetylthreonine 17093-74-2 HMDB0062557 152204 Pos Early
gamma-glutamylglycine 1948-29-4 HMDB0011667 100099 Pos Early
gamma-glutamyltryptophan 66471-20-3 HMDB0029160 3989307 Pos Early
stachydrine 4136-37-2 HMDB0004827 C10172 115244 Pos Early
nicotinamide riboside 1341-23-7 HMDB0000855 C03150 439924 Pos Early
gamma-glutamylmethionine 17663-87-5 HMDB0029155 7009567 Pos Early
gamma-glutamylthreonine 5652-48-2 HMDB0029159 76078708 Pos Early
nicotinate ribonucleoside 2625-49-2 HMDB0006809 C05841 161233 Pos Early
N-acetylproline 1074-79-9 HMDB0094701 322640 Pos Early
isovalerylcarnitine (C5) 31023-24-2 HMDB0000688 C20826 169235 Pos Early
7-methylxanthine 552-62-5 HMDB0001991 C16353 68374 Pos Early
1-methylurate 708-79-2 HMDB0003099 C16359 69726 Pos Early
N1-methylinosine 20245-33-4 HMDB0002721 650095 Pos Early
"N2,N2-dimethylguanosine" 2140-67-2 HMDB0004824 135501639 Pos Early
N4-acetylcytidine 3768-18-1 HMDB0005923 107461 Pos Early
cysteine-glutathione disulfide 13081-14-6 HMDB0000656 R00900 3080690 Pos Early
7-methylguanine 578-76-7 HMDB0000897 C02242 135398679 Pos Early
3-methylcytidine 21028-20-6 HMDB0240577 14237477 Pos Early
N1-Methyl-2-pyridone-5-carboxamide 701-44-0 HMDB0004193 C05842 69698 Pos Early
N1-Methyl-4-pyridone-3-carboxamide 769-49-3 HMDB0004194 C05843 440810 Pos Early
gamma-glutamylisoleucine* HMDB0011170 22885096 Pos Early
gamma-glutamyl-2-aminobutyrate 16869-42-4 Pos Early
2-methylbutyrylcarnitine (C5) 31023-25-3 HMDB0000378 6426901 Pos Early
malonylcarnitine 853728-01-5 HMDB0002095 22833583 Pos Early
glutamine_degradant* 2353-44-8 Pos Early
homostachydrine* 1195-94-4 HMDB0033433 C08283 441447 Pos Early
N-acetylcitrulline 33965-42-3 HMDB0000856 "C15532,C02851" 656979 Pos Early
glutarylcarnitine (C5-DC) 102636-82-8 HMDB0013130 71317118 Pos Early
beta-hydroxyisovaleroylcarnitine 99159-87-2 Pos Early
2-methylmalonylcarnitine (C4-DC) 149181-64-6 HMDB0013133 53481628 Pos Early
tiglyl carnitine (C5) 64191-86-2 HMDB0002366 22833596 Pos Early
N-acetyl-aspartyl-glutamate (NAAG) 3106-85-2 HMDB0001067 C12270 188803 Pos Early
glycerophosphoethanolamine 33049-08-0 HMDB0000114 C01233 123874 Pos Early
glycerophosphoinositol* 16824-65-0 167572 Pos Early
ectoine 96702-03-3 HMDB0240650 C06231 126041 Pos Early
deoxycarnitine 6249-56-5 HMDB0001161 C01181 22620 Pos Early
1-ribosyl-imidazoleacetate* 29605-99-0 HMDB0002331 C05131 440569 Pos Early
tryptophan betaine 20671-76-5 HMDB0061115 C09213 442106 Pos Early
N6-carboxymethyllysine 5746-04-3 HMDB0240347 123800 Pos Early
dimethylarginine (ADMA + SDMA) 102783-24-4 "HMDB0003334,HMDB0001539" "C21189,C03626" "123831,169148" Pos Early
gamma-glutamylalanine 5875-41-2 HMDB0029142 C03738 440103 Pos Early
cyclo(gly-pro) 3705-27-9 193540 Pos Early
succinylcarnitine (C4-DC) 256928-74-2 HMDB0061717 71464481 Pos Early
N-methylproline 475-11-6 HMDB0094696 643474 Pos Early
2-hydroxyglutarate 40951-21-1 HMDB0059655 C02630 43 Pos Early
cysteine sulfinic acid 207121-48-0 HMDB0000996 C00606 109 Pos Early
"N1,N12-diacetylspermine" 61345-83-3 HMDB0002172 C03413 132680 Pos Early
betonicine 515-25-3 HMDB0029412 C08269 164642 Pos Early
ergothioneine 58511-63-0 HMDB0003045 C05570 5351619 Pos Early
S-methylmethionine 3493-12-7 HMDB0038670 C05319 458 Pos Early
7-methylurate 612-37-3 HMDB0011107 C16355 69160 Pos Early
N-acetyl-cadaverine 32343-73-0 HMDB0002284 10374713 Pos Early
5-(galactosylhydroxy)-L-lysine 32448-36-5 66995551 Pos Early
cysteinylglycine disulfide* 70555-24-7 HMDB0000709 22833544 Pos Early
formiminoglutamate 816-90-0 HMDB0000854 C00439 439233 Pos Early
4-hydroxyglutamate 2485-33-8 HMDB0001344 C03079 439902 Pos Early
gamma-carboxyglutamate 56271-99-9 HMDB0041900 40772 Pos Early
norcotinine 17114-40-8 HMDB0001297 413 Pos Early
hydroxycotinine 34834-67-8 HMDB0001390 107963 Pos Early
cotinine N-oxide 36508-80-2 HMDB0001411 9815514 Pos Early
argininate* 157-07-3 HMDB0003148 160437 Pos Early
2-oxoarginine* 3715-10-4 HMDB0004225 C03771 558 Pos Early
1-methyl-5-imidazoleacetate 4200-48-0 HMDB04988 6451814 Pos Early
S-methylcysteine sulfoxide 6853-87-8 HMDB0029432 82142 Pos Early
2-oxindole-3-acetate 2971-31-5 HMDB0035514 3080590 Pos Early
leucylglycine 686-50-0 HMDB0028929 79070 Pos Early
valylleucine 22906-55-4 HMDB0029131 352039 Pos Early
carboxyethyl-GABA 4386-03-2 HMDB0002201 2572 Pos Early
trimethylamine N-oxide 1184-78-7 HMDB0000925 C01104 1145 Pos Early
N6-methyllysine 1188-07-4 HMDB0002038 C02728 164795 Pos Early
cis-urocanate 7699-35-6 HMDB0034174 1549103 Pos Early
imidazole propionate 1074-59-5 HMDB0002271 70630 Pos Early
alliin 556-27-4 HMDB0033592 C08265 87310 Pos Early
prolylglycine 2578-57-6 HMDB0011178 6426709 Pos Early
lanthionine 3183-08-2 98504 Pos Early
(R)-3-hydroxybutyrylcarnitine HMDB0013127 53481617 Pos Early
N-acetylcarnosine 56353-15-2 HMDB0012881 9903482 Pos Early
histidine betaine (hercynine)* 534-30-5 HMDB0029422 3083620 Pos Early
dimethyl sulfone 67-71-0 HMDB0004983 C11142 6213 Pos Early
2-piperidinone 675-20-7 HMDB0011749 12665 Pos Early
N-acetyl-1-methylhistidine* HMDB0240340 53859791 Pos Early
indolin-2-one 59-48-3 C12312 321710 Pos Early
S-allylcysteine 21593-77-1 HMDB0034323 98280 Pos Early
2-aminoheptanoate 1115-90-8 HMDB0094649 227939 Pos Early
benzoylcarnitine* 105450-08-6 Pos Early
methionine sulfone 820-10-0 HMDB0062174 69961 Pos Early
fructosyllysine 21291-40-7 HMDB0034879 9839580 Pos Early
3-methylglutarylcarnitine (2) HMDB0000552 128145 Pos Early
phenylacetylcarnitine 287108-21-8 101724840 Pos Early
N-carbamoylalanine 77340-50-2 426409 Pos Early
N-acetylkynurenine (2) HMDB0240342 73817779 Pos Early
N-acetylglucosamine/N-acetylgalactosamine "HMDB0000212,HMDB0000215" C01074 "439174,84265" Pos Early
adipoylcarnitine (C6-DC) HMDB0061677 71296139 Pos Early
4-hydroxyphenylacetoylcarnitine Pos Early
suberoylcarnitine (C8-DC) Pos Early
azeloylcarnitine (C9-DC) Pos Early
thioproline 34592-47-4 HMDB0062164 93176 Pos Early
2-methylserine C02115 94309 Pos Early
(S)-3-hydroxybutyrylcarnitine HMDB0013127 71464477 Pos Early
methylsuccinoylcarnitine Pos Early
pimeloylcarnitine/3-methyladipoylcarnitine (C7-DC) Pos Early
2'-O-methylcytidine 2140-72-9 150971 Pos Early
gamma-glutamyl-alpha-lysine 65254 Pos Early
glycerophosphoserine* 3081457 Pos Early
"N,N,N-trimethyl-5-aminovalerate" 14274897 Pos Early
butenoylcarnitine (C4:1) Pos Early
2-furoylcarnitine Pos Early
3-hydroxystachydrine* C10151 46173781 Pos Early
hydroxyasparagine** HMDB32332 C20631 15991574 Pos Early
3-hydroxybutyroylglycine** Pos Early
N-methylhydroxyproline** 9860390 Pos Early
"N,N,N-trimethyl-alanylproline betaine (TMAP)" HMDB0240365 Pos Early
3-formylindole 487-89-8 HMDB29737 C08493 10256 Pos Early
gamma-glutamylcitrulline* Pos Early
diacetylspermidine* HMDB0002172 C03413 132680 Pos Early
3-amino-2-piperidone 1892-22-4 HMDB0000323 5200225 Pos Early
"N,N-dimethylalanine" 2812-31-9 5488191 Pos Early
"N6,N6-dimethyllysine" 2259-86-1 HMDB0013287 C05545 193344 Pos Early
indoleacetoylcarnitine* Pos Early
N-acetyl-isoputreanine 131802901 Pos Early
"N2-acetyl,N6,N6-dimethyllysine" Pos Early
"N2-acetyl,N6-methyllysine" Pos Early
3-hydroxypyridine glucuronide Pos Early
3-hydroxyhexanoylcarnitine (1) Pos Early
3-hydroxyhexanoylcarnitine (2) Pos Early
"N,N-dimethyl-5-aminovalerate" Pos Early
dimethylguanidino valeric acid (DMGV)* 101535539 Pos Early
5-hydroxymethyl-2-furoylcarnitine* Pos Early
"hydroxy-N6,N6,N6-trimethyllysine*" Pos Early
levulinoylcarnitine Pos Early
(S)-a-amino-omega-caprolactam 21568-87-6 C02837 440599 Pos Early
(2-butoxyethoxy)acetic acid 106312 Pos Early
S-carboxyethylcysteine 4033-46-9 Pos Early
N-acetyl-2-aminoadipate C12986 443992 Pos Early
3-hydroxyoctanoylcarnitine (1) Pos Early
3-hydroxyoctanoylcarnitine (2) Pos Early
METABOLITES_END
#END