#METABOLOMICS WORKBENCH krueger_20231003_090520 DATATRACK_ID:4369 STUDY_ID:ST002909 ANALYSIS_ID:AN004777 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 SUBJECT_SAMPLE_FACTORS - 1 Group:control age=49; sex=M; mortality=NA SUBJECT_SAMPLE_FACTORS - 2 Group:control age=53; sex=M; mortality=NA SUBJECT_SAMPLE_FACTORS - 3 Group:control age=37; sex=M; mortality=NA 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 SUBJECT_SAMPLE_FACTORS - 8 Group:control age=45; sex=M; mortality=NA SUBJECT_SAMPLE_FACTORS - 9 Group:control age=42; 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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 High pH (LC/MS Neg) 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; 6.5 mM ammonium bicarbonate, pH 8 CH:SOLVENT_B 95% methanol/5% water; 6.5 mM ammonium bicarbonate CH:FLOW_GRADIENT Linear gradient from 0.5 to 70% B over 4.0 minutes, then rapid gradient to 99% B CH:FLOW_GRADIENT in 0.5 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 NEGATIVE MS:MS_COMMENTS Metabolon (LC/MS Neg) #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 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923151872 1628599424 857854528 3463274240 2040583680 2716295424 1039001536 867455488 529753472 1171132672 713105280 1318412800 2377816064 277685504 2334883840 1414915840 1293252480 1417635968 952828352 5941966848 3253639680 3065773824 1843100416 1105457664 1005425024 502595488 2821099520 1077142656 683671104 1466194176 812609024 5106156544 647868480 834363904 415546496 3377751040 582453248 472148128 3004263936 494831808 1886968192 563956352 3376493568 185495120 3473526016 5830339584 1838071296 1834986880 3152230144 319558688 596214720 3457950976 2618776832 804838464 4456193536 2999265280 1195487360 201049856 855720256 1394104448 2166381568 391541696 2280047872 1349900672 1526346752 1200310144 1523606144 540358656 1721646080 2350977280 2006520064 2133612928 1139241984 1089153920 1963468672 2251711488 1693382272 2760429056 147237776 2232739840 987113664 1895952896 3168911360 1999731072 2141754112 2609436672 718338240 3599639296 2653701632 5425307136 1755277184 1470819840 1031095680 919289856 291391040 2589573632 932366720 3630501888 4058196992 266014176 2833755136 1645097216 2016140288 1452059904 6409959936 1787280256 2137391488 6080390144 1832369792 741080832 1795049856 822938560 2552497920 918462144 1357432832 1256391168 1348762496 2085449984 999533184 2149500928 1352669824 1296105088 3452666624 2479237120 1583789568 1937115520 1957860736 2058101888 1162704896 1358396800 1532601984 2030444672 874622528 1628599424 1314864512 3077868032 5051526144 3073381120 2521670144 88753672 1623463680 1336161536 612989888 1262074624 1851293696 1821594496 3806593792 920769728 1362535296 1425620608 3564890880 3161241856 2386273024 896111360 1309390080 1725528448 1628599424 1878906240 434474624 3076490496 1462316160 1863132160 2410301696 1617015168 3847206912 1179161216 1684666368 5126726656 482541664 1491800320 3472381696 2621014784 2652554752 773145920 2693405696 620318464 1544517760 384509184 2421268224 2122882560 269786080 2337873152 768024640 2485882368 2920059648 1149751808 1817382656 1878999424 2235279104 296103072 699801344 3179567616 699666880 1742160000 2258301440 1827507840 1393690496 2135493120 1459371648 854476672 1256930432 2562807552 949279040 3927175168 237106592 1756029824 3035244800 1191823104 638757760 1851363200 2306055936 1304741760 2808486912 1293736192 58215856 2875860992 1644487808 276760192 999270080 10348716032 2902826496 349341248 349904608 312114464 654293696 205450016 2247022848 7302648832 2271604736 2890721280 2460103680 4022670848 772003584 1430083328 576040512 3996238080 1516333568 1646329472 1494690944 5328284160 1742996224 1297150592 1901942528 4208805888 1098825728 2608850176 2462136576 2329574144 3101166592 888809536 412818656 851523072 1009008192 1081122048 907491520 1207891072 1398514176 1678141952 1795653248 1231563520 1912112384 989130304 3437952512 749274048 1650698240 2272694528 2621808640 3889896192 1628599424 3825408512 2244929024 1304461312 1336845696 1373896960 3264673024 1836011648 215021744 571005760 5254388224 1173606144 2460124672 1532832896 1257372032 1284084096 2674832384 152004464 760797888 1591934592 1947646592 1849048576 1647451648 1495562624 1784642176 1014214656 laurate (12:0) 279726208 323923360 86013888 146960272 25814846 32776556 139348112 58183704 779173504 83145088 61847816 172782352 47804900 70818904 49438668 36719372 39441248 54506836 249482832 76311888 275938880 91530608 166740512 135362912 42580572 1393606144 231696608 205054832 3193586432 38405052 89867168 343926528 797228224 112455448 154644880 110674320 32061630 326223360 223659520 85679896 30160466 86517392 655502528 17258412 63466388 43220588 106333368 25642364 216688336 20032308 180814064 380301568 45920752 41313888 186573024 20357746 12816679 265529792 85856712 112367568 1002983872 186967808 42839980 27563534 57924608 74981992 310839584 29084746 65291504 167781504 176447024 84279032 46969048 23996878 67907112 73432032 178266432 136037504 55265052 90086528 58237944 358618848 178182144 242544112 83900072 106228096 30291670 259451376 596866432 48011144 145953152 135790672 150077632 197490368 389359104 147881216 104948048 60586492 31941416 98191392 40725444 157272704 80329240 110527736 140118256 31157102 237964880 81170960 73437696 91778728 135002768 62833116 54459324 260771440 173261712 75812640 204276816 60864900 147716560 112377080 279081792 86802960 102269432 46005804 33720348 281648448 96401104 103093528 44486236 111085464 59092556 121771784 93145744 162728464 26981220 35501900 120434584 52055824 53855172 88096848 69000952 99394872 252349200 71711240 105148816 14857411 119524832 104672560 70265248 91530608 54053152 126946872 175783984 125004096 64033100 93800856 248284944 121291336 185961840 145097312 49827972 47850924 91530608 82630864 30464086 122917552 109770000 91449208 192500992 66565360 103376216 94500176 57033288 339842112 28036610 75996504 96488528 336902944 111871296 76344144 185328016 57413984 198716992 20510528 156090336 74273896 64994140 74957840 48863468 201290128 158923456 62858144 76997624 77915000 128609424 17935544 56142504 334569376 35437784 39938936 117847464 267140656 193471200 89190496 65709336 74700456 51011616 161653936 52396368 107630896 29996454 69075296 91530608 46579304 27963534 40186492 223914160 37463492 382468864 76062808 48659464 125602888 62785184 40808384 44980108 502353280 96659832 27682276 30567924 38178600 81170688 26696536 162461968 272992256 117722528 646387584 175827824 162455760 57134872 113867360 30523496 117658880 117501496 37316632 97152752 221586544 69219144 217291328 41589708 33670232 51932064 206430736 74086320 101328520 624678848 38936376 25568274 41262656 70744056 96983880 158184240 100243256 54729728 70594016 95552848 81839560 131798480 35247484 274355264 50350716 126687008 111882360 130768360 103258712 131793968 134260560 65535524 86371624 144707072 152161104 118913352 46722088 22840882 38815248 337819136 170771664 103479824 85903016 86401392 109718152 229365104 23972008 106870128 37327816 75590104 104958816 114549400 44735100 37717320 79369200 N-formylmethionine 2638476.25 2938243 3206630.25 3898216.25 2536119.75 5413851 1559187.625 2026215.75 2148770.25 4367592.5 2044938.375 2710256.5 2601427.75 2230967.25 1690239.25 2624442.75 1946219.875 2912977 2159824.5 2931763.75 2389915.75 2699847.5 3857435.25 2434212 4007046.5 3339268.25 3584322.5 2162983.75 3563432.75 3300586.75 2665323.25 2430627.5 3742410.75 3399047.25 3651489.5 2012443.125 2837092.5 5217967 3075730.75 2168877.25 2064517.625 3251062.25 1833313.125 2499944.75 4479325 2668951.25 5005013.5 2621448.25 1089690.875 2791054.25 13802690 871298.375 3513477.5 10540584 39860832 17902478 2534878 3509309 1991314 22364608 7747467 3796833 15882359 2949912 23447730 3058383.5 13297618 2411893.25 8392701 4168829 10828166 2448693.75 2796787.5 4021197.5 10798894 7827677.5 2155470.75 6548323.5 6645507 13159482 9485728 14317400 12875044 10776717 3972132.75 6530645.5 1870955.875 10310956 5217967 1941436.875 5076471.5 1235397.125 9176813 8076465.5 4248536 11865017 4956736.5 8091594 17139530 1683923.125 2672453.25 5694234.5 9127482 4216112 2233184.5 4764690 3468364.25 2071411 1794732.625 2780235.5 2694440.75 11108484 5820065.5 4120360.25 3217881.75 5464149.5 5071083.5 12843203 5348006 7629147 17067968 13754872 2067054.25 13827459 13921552 7833430 4095508.75 10583149 7706110.5 17334046 7409067.5 14066132 4306838 13295293 5217967 2574881.75 7812943 5334474.5 5328409 17726796 4273723.5 6652807.5 16868322 9625482 3302726 2469869 5098360 4914640 10570691 3704399 5006225.5 11492319 2141370 19072464 29962640 6253335 322673.2188 4173685 6358438 3075768 2604827.75 2924383.5 6836800.5 3721089.75 15842335 6153298 7355297 4643424 5598380.5 3946635.75 6149246.5 5194917.5 36398560 7714170 3530725.75 3650730 8864091 6497791 2310670.5 5816651 5255071.5 13641743 4697457 20325936 13608293 4269505 9803795 3675387.25 16680512 17335830 7392590.5 14493779 2415338 10408209 6308038 22800020 3127555.5 21013108 26965510 2265968.5 15919461 3132454.25 15413873 15056551 2578074 5217967 4551092.5 4965253.5 10271896 6728342 10355361 2751307 3404600.25 7501990 6873940.5 4236280.5 3322521 22916448 11750908 8215772 6372677.5 3237859.75 22066930 14022006 4119712.25 3917225.25 5125822 6228460 7768241 6026638.5 5611396 14663495 3266629.25 16633845 20605196 9818720 7319119 20919140 20105922 2117053.75 5131804 6785123 10625531 6656312 3958008.25 3613677.75 11621237 17613238 7721718.5 13060423 1674400.375 7029771 9106454 12366130 8045869.5 22226744 7981621 19895126 2306010.75 5147815.5 22637022 3529820.5 1975593.5 16558590 4559704 6299544.5 3617318.25 6895583 3762512 4153701.5 11578822 3671292.75 26158360 2609221.5 6479125 1848032.25 6048264 5543132.5 2918060.25 5310112 3900947 2393227.5 8064075 15097858 6834792.5 17202370 27178132 5826511 27591210 5722997.5 2551849 7547593 6475724.5 7371489.5 3400248.25 5206341.5 9213714 3288106 9412240 14065791 S-adenosylhomocysteine (SAH) 73756.3047 78854.2656 74516.2031 113349.8125 47510.2266 33787.7734 157277.6563 34126.7852 59466.4453 41731.1172 63822.0781 21315.5449 47692.8398 58740.6602 108300.5859 149932.1875 59657.9766 36553.7031 44416.4219 67831.0156 36890.4336 48852.4023 101201.3281 60210.8945 95776.4219 53258.2383 66391.3359 64088.3008 81344.4609 1127162 161313 280056.3438 459139.4688 618392.5625 44515.0273 58884.9492 59576.7461 866907.8125 481414.7813 171897.375 881163.1875 68268.3438 51222.5391 355931.5 37163.8359 282677.0313 52168.3438 323728.25 61567.9375 91355.0078 77457.4375 313269.5 299405.625 40928.543 146913.4688 296307.6875 286375.25 372619.7813 410824.0938 271916.7188 164294.8125 99637.3672 151329.9688 28254.9668 300473.2188 154885.8438 259513.7813 251231.4219 285743.125 184166.2656 404809.9375 1201602.625 332478.8438 468387.5625 33167.8164 140517.2031 198968.4844 278894.5313 148376.2656 72717.8359 359738.3438 131288.0625 36040.043 63164.6641 74369.8125 100271.3672 345483.0313 142065.2344 125884.4922 152157.8281 172841.2344 158331.2031 189713.125 261259.4063 225438.5 567586.625 461600.8125 42482.1875 476484.5 342259.5938 223971.9688 109026.6563 374844.9375 408236.5625 803124.3125 145705.3906 623944.875 137738.4531 104552.0313 138758.0781 83708.4063 435909.4375 135168.5313 130545.4453 1857585 131396.125 138660.6875 1085327.375 576621.3125 67183.7656 49987.3359 111158.7188 463574.375 263537.5938 203511.9063 378913.8438 37368.6484 380134.375 659763.5 171665.8281 94597.8203 191083.0313 62714.0234 71309.6172 90993.7656 218455.3906 96438.0469 694214.75 270369.1875 357140.9688 157103.3906 135200.7813 180009.5938 110525.1094 78742.2266 419796 122290.8828 43994.7969 54434.4023 215604.0313 118395.3594 36415.0508 130776.125 161313 430620.4063 162125.125 885798.625 364989 28043.9355 284089.625 94989.1953 603823.6875 306708.1563 187134.7031 505187.9688 54989.0156 406766.2813 163863.4688 981927.3125 94440.2969 417239.875 1056868.375 71524.6797 671900.9375 54228.7773 146357.2344 312588.2188 60531.4023 152380 170246 53894.0156 575413 491384.8438 233622.4531 83216.8828 72742.3281 600013.3125 181216.9063 67092.4609 836818.875 726623.9375 225703.5469 222247.1719 128297.3281 932692.9375 271505.125 154168.0781 72663.6641 142094.2969 225405.7344 147638.3125 188903.0625 178882.5781 172693.8125 514105.1563 1073731.375 363426.125 183055.25 872420.9375 643278.75 145542.2969 334258.3438 324806.7188 260904.7813 206167.6094 85853.1875 98834.7813 344617.7188 286383.6563 665054.125 33011.4219 364535.8438 1105397.75 1082375.875 99245.0938 1237278.75 59486.3086 967823.3125 74783.5156 491256.625 97264.9063 83105.4297 136715.9844 92165.0703 349317.9375 76188.9141 280271.4688 41562.2266 32011.4258 136331.3125 41654.5547 314103 62272.4063 101053.7422 371811.8125 85023.1953 112678.125 282043.5625 681268.875 334620.2813 595351.1875 1266815.75 93185.4922 1220954.25 35489.3828 43156.4609 382999.9063 29094.0645 970118 320066 204216.6406 81158.3672 916825.3125 346001.9063 N6-methyladenosine 26061.6875 47555.1797 36725.5469 32164.4551 30479.1113 23405.3926 28316.9727 64198.6641 42038.9297 38403 55881.6602 95565.8359 66809.1719 24892.5195 41473.0273 60132.6016 53766.9922 62544.9063 35681.5781 87218.8047 108939.1328 61115.3516 41376.25 55251.3789 44293.9336 29614.1914 132976.3438 51071.543 67447 97689.3047 283595.4688 117898.6328 38935.5195 103306.1406 73029.0781 38711.0156 98007.4219 34974.6797 67447 25383.6035 101580.1953 28582.9961 36589.7734 79947.7656 22136.0547 71525.7734 74033.6641 53828.457 41647.3906 94980.1016 80054.3359 50565.9102 63331.9141 66866.7969 68436.8906 40229.6445 19886.2949 36637.1367 62648.3008 102461.9453 81438.1328 84013.125 73991.0391 96768.8672 83174.0078 82735.8906 66242.3906 50369.3516 27920.6992 45298.3164 65119.8828 39903.6289 51626.0586 65500.3633 67258.3359 129214.3438 124259.3516 87143.0547 87924.5469 69392.0547 39768.6406 131723.0156 98293.9688 178806.1406 51040.332 121918.8047 113593.9141 92252.7656 65132.5078 114819.8359 108461.2969 140104.7656 76155.5391 108016.875 80416.3438 109003.3125 54477.6641 51196.5508 60173.9883 59838.625 82155.3906 39070.2695 66871.7813 36720.5781 51425.793 31552.1035 74729.5547 43724.0195 82386.6328 73252.1094 58101.293 90709.3828 89562.125 40171.8867 124091.1484 120565.5391 46049.3008 68784.2266 95160.4219 124267.3203 29859.3496 54375.1094 95155.1172 88911.5625 67447 60281.1797 171070.125 101491.0078 126618.0703 52408.0586 60553.9297 118740.125 92772.5234 115507.4453 35589.2461 176201.4688 162473.7031 92491.2813 50024.8906 108852.1094 60127.2969 56246.1641 176389.3125 55919.2891 100282.1953 125777.5391 52499.8125 68494.0781 93871.4219 88308.4766 136553.8594 57870.9961 38451.043 113062.1016 34058.8672 49385.9922 126343.1953 105484.6406 65138.543 81425.2266 69283.0313 37356.2891 189357.2031 59884.9766 57238.7734 44407.0977 115620.2734 83964.1797 91288.1328 144835.1719 141718.3281 130042.8438 104351.1797 100176.0781 60475.3984 56385.1914 61191.7656 126736.875 85758.4688 121978.8359 114987.2656 85986.6484 93544.0859 93896.2813 68179.5547 87782.4609 40576.3203 60253.5898 60721.6133 128129.3516 73223.5938 25840.25 76030.6953 63298.7461 39850.7383 94639.8828 101094.7188 120857.0781 159327.9688 29507.002 50353.8906 72442.4844 39627.0508 64119.3359 54709.5469 57106.8555 66399.9219 45693.6875 27701.8359 52696.6367 273332.1875 149545.875 38356.1641 105118.0781 50990.6016 22263.1465 74068.3984 44587.0742 89153.5313 arachidonate (20:4n6) 136869408 375862528 406586688 195381280 198235632 213483760 118182240 222638608 173446496 174250928 475438112 237580928 205539616 204963152 110654560 209419184 210914544 135064752 557934208 78547008 439559392 207882720 171256560 120843568 102751016 291519264 526460800 379572960 354181824 180758496 217029856 191101904 344605696 331203424 207105904 65314332 263638544 289043904 342479968 98880624 138762560 245558544 213704816 98243904 317074400 124437304 244484352 324638112 198564336 95747016 235853392 362798592 208206352 281325888 87463560 68275552 59695868 391931680 316047712 42197944 116086536 166577648 84192184 17088036 30264954 161672560 143789568 141589568 134032760 78507480 56045972 213896400 185297440 39506128 179734944 177231040 161834528 92823640 86868968 47898540 235168656 47797696 39904908 108750848 43986356 118904968 171950464 124811200 116040304 411451744 353805280 368964640 36167140 253296112 198209040 137255712 196426192 241509072 179413376 119697088 76557536 149270976 118536920 246256912 559673856 83339552 331274016 371384640 201166832 377108576 936021632 175334576 145760784 735093440 217986704 68215552 237829344 106911432 165927744 142011184 26520756 87847064 103689528 536202560 155995280 86168792 175694064 72244888 474564224 303284000 102353768 81013264 185531568 138681728 149270976 75196880 147311264 158694272 62074336 179634800 79240880 169093072 260677504 261456832 255650448 39637904 173969184 240294304 81751624 118009584 147524864 73867120 320295008 45898028 150938480 148616176 58954292 223230320 117352368 79866512 210777920 229855568 177849568 382466272 82224424 286126368 199332448 195384128 93473464 168169536 167983392 174797904 97833664 336598656 84538008 231001376 260088512 121241944 259844768 48842044 115058664 66985932 133085496 32599128 187443392 290703392 41953892 258588736 68553496 133818832 111796584 37806452 141486624 128920480 186817296 66033016 92959584 50138484 67460056 78947664 187611120 212879584 38038124 213701168 74099680 152617776 143372128 149270976 42974000 181813184 38197100 629769728 315095744 125216808 25519238 355790496 225983488 130293832 151181536 134527984 35402752 268589184 209478928 28346406 213613744 596970816 430102112 40840548 37171600 40967148 33495984 41086484 177671120 110402208 114436040 170530256 245024192 192331696 45395128 188234384 132451208 316927360 83348088 123410304 135369472 185688368 45271328 26448698 108293632 412531872 208963440 124248112 169996496 216415424 180865712 45027104 68987136 123322192 149270976 46349016 20292644 160381744 147959136 69519200 120919200 115687496 158650000 147215680 204828368 90158032 72520416 430952096 56569776 302231232 106235696 288915168 264125696 185808016 114517912 76468800 325326688 99387472 54143424 76483128 359739136 74290152 46935080 193631936 94776800 108319216 359446688 53536884 34000444 122344592 118621288 87927704 148500976 222543424 154164080 9993435 3-(4-hydroxyphenyl)lactate (HPLA) 29085122 23642734 24860790 14869874 14444233 47019076 7863808.5 9922998 16879786 19429040 11586112 9364267 16592481 7269906.5 15586774 15197059 9218741 16164984 12911873 15075355 9740341 13596733 29653190 29289108 28165722 15075137 19168950 20996440 12294323 11162062 8279514.5 12063655 13192189 20792290 18272710 9526063 11156406 12351128 18975696 19453160 14433949 16854926 12376908 17177170 24888404 15630172 28575498 9754120 6471199.5 13730099 127352840 644424768 19409580 48246352 374406880 116599152 13925219 29022218 10662134 156092240 93524392 48359660 405835744 15320017 116694000 13672280 74860936 10872135 86148024 21961226 102045208 15108379 24554062 22954666 71689944 63805188 14691682 59450468 61249820 95992520 35631632 152514112 72561328 124550480 18709192 112524032 7529953 72156392 44229268 8445608 54817604 8843791 235443536 41378248 42818720 244700400 347132768 161441088 225899408 6162813 33811516 76732096 52469988 25612196 20301626 41175268 34525884 15780140 8410472 18887640 17746470 63345004 30317432 14639032 18343342 58749684 29890392 128397656 71535736 103863344 647406272 55702184 13041159 118810352 185975152 112900960 30133434 107742976 22746672 148585728 82073176 77847576 34617016 155708128 97330368 27000896 116229544 31885744 37347700 362083616 31895708 94184056 803793472 274212640 16212367 13941821 45211208 59559160 133893664 35877176 25798712 59099072 15134515 87207296 395497440 47427304 61621956 91664856 45294716 11210693 17671336 22515940 41841036 27985180 270542240 73249240 78420360 35877176 60740176 31480948 39178676 44976672 367923200 48944804 11251583 16475638 67821352 61277408 16930916 18811004 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2308034816 3707242496 3953473024 3121315072 2165238784 2539959552 2754117376 2171616000 2839921920 2724936192 2806016768 1563953664 2534497280 1717980928 3509729792 3155723776 3016315904 3179341568 474875552 2261344768 2127679360 1117407744 1908228864 2287948800 2593215232 3074829056 1780629248 1842547200 2395448320 3425732352 2979735552 3106578688 1256737920 2112947840 1923269504 2442985984 3213491712 1157895552 2522267136 2261344768 2459643904 2761632256 2141848064 3387656192 2382083840 2512590336 3742543104 1328738560 2199386624 4650375168 2472144640 2877359616 1548047744 2944445952 1514605824 1517606272 980089152 3255210240 2820433152 1290705408 2136896256 2318981120 2897843456 3139952896 1860647296 2006901120 2672997120 2243403008 1501450368 1557463808 3356648960 1245462912 2198828544 2317196032 2233163008 2662536448 3190545664 1838428288 1680183552 2400096000 2761545728 1811983232 2857080576 1231220992 2672500736 2753454592 1726865280 1169140352 3227687424 2476015104 1774165120 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6380257 3672786 3432651.25 6709562.5 2665080.5 6346705 7720887 3199228.5 3268354.25 9469025 6867541.5 3806416.5 9864687 6227274.5 1739689.25 9944826 5271319.5 2733910.5 5139035.5 13522556 3907689.75 1839329.875 2925568.5 1944132.875 2325559.25 1987742.625 5316184.5 8980754 4485727 8180918 5652983 9860749 3550872.5 3350292.5 3416367.25 6743816 7336864.5 4581524.5 5050794 9405063 5172380.5 3833945.5 7734981.5 5923160.5 3197175.5 5578795.5 5096058.5 4296540 11213715 3606947.75 3202600.5 3653093.5 3531990.5 4317095.5 4133118.75 3859438.25 4015260 4785735 4148786.75 4775035.5 4241005.5 5983149 7733689 2785705 7024237.5 7292807.5 5322727 7006165 3658670.75 7454227.5 4820458 7405828.5 3433037.25 3151918 5575972.5 5032307 2166646 1537182.5 6813314.5 4155640.75 5499339 2868763 3764250.75 3084903.5 4333005 1639530 1992674 4361058 3477582 7224629 3389923.75 4820458 3467810.75 2814551 arachidate (20:0) 25493606 29169926 26999766 36802740 17351950 26465122 22167916 16711698 17929438 38196356 40269460 27901830 22719964 16034030 26232208 33150698 17811226 26342450 31473960 17563198 49858116 34131008 27904374 28475792 17687930 79806464 32937208 27872914 38450272 15102216 18268290 16971730 29807090 25683988 18335892 25892406 23715418 43195780 18768758 15302500 15875121 24149046 22128862 18768672 22428978 22578598 18004540 16348119 32531826 17319164 34078360 74917800 29099294 27518984 54904132 10318743 11644903 40714704 30548862 12861320 48518524 26026622 18523068 13086770 14941029 19365454 25383200 18638738 32706776 19089010 17457956 27392386 19481614 22047538 26431970 25702506 31625534 24209306 30590426 22628488 25079372 17831840 35144384 41302568 15333659 40527072 20516104 53747736 89715848 25061736 24816188 27429392 27692308 47079864 38457672 125098336 28940924 18668648 25113088 25157104 19691580 99306144 16010378 30885142 64763172 17963392 19819766 25031556 31858604 42689356 55055920 22669424 36719948 69413928 21290760 18367216 23044036 25999690 41816440 49852684 25688538 27748052 20105478 27691196 33714192 59109684 25683988 25357912 49581920 59610776 46800292 19727932 25553418 59392036 20558880 37883956 33047750 32660598 12835139 25975748 21267428 34310372 36554708 26431304 42647880 8766443 25080222 23934342 12245011 25683988 22324572 47576736 25364426 19947644 18500710 24859824 37451188 29446514 31525564 18702590 23683142 19852420 25339558 31636458 14935580 34569600 22907510 24982676 44759216 29015512 39957816 27905664 25047638 34005624 21741474 23982584 82315936 26598830 31518640 28301164 55167968 18953258 23110496 12114945 41115656 31505542 17273854 33050040 26119016 31027532 27860872 22485796 26080038 26394264 28689442 21175488 17080784 43730080 13277679 23744656 22961824 23024546 39465120 38998772 26315766 25683988 33576164 29190838 17116156 51947152 19435000 27893600 30572008 19472656 20141142 41163408 29691318 17288486 48538292 32978074 11227036 41877532 26747160 15666514 25250828 54631524 14938229 13912523 15157967 16252715 18533926 13732273 36545696 41001664 24985260 32710888 29159348 44910484 24852608 18299458 21228048 28072180 35346876 21731556 26934550 39675148 32085218 24459668 55074060 20647316 17357160 27475772 23239282 20835574 52645628 25993624 22050878 20269946 25415178 21508762 26969946 21358908 24244438 41282400 17083556 20278952 27178122 40792072 55484004 17908110 36748180 32549214 22222988 31714734 22363136 34745376 28220362 29896038 19555060 13811462 26574070 18977154 12572287 11089867 36005824 23431640 22972262 12243067 25874368 17928050 20825694 13220887 13463500 15966472 28020780 36190312 15540701 18977480 18296074 15633139 heptanoate (7:0) 2901628.25 1104373 2764597 2684117 2372628 3948997.75 3989843.25 6517661 4145250.75 5199883 5505597.5 1223895 3699956.5 3308203.5 2990827.75 5141355.5 6869246 3712251 4441118.5 7349305.5 3469893.5 3808327 4279736 2960931.75 5145674.5 3620130 6705719 2808411 5735991.5 3445362 6222553 3162171.5 7382426.5 4259443.5 4907388 7764070.5 5337932 5839152 6793583.5 4379526 3583953.25 4006703.75 4325442.5 780959 5136340 6901344.5 4243026.5 5061572 3317477.25 3719059.75 1326568.125 1305420.125 1248454.125 1454269.125 1493573.375 1564072.25 1049856.875 1556965.5 1665255.5 781078.375 1351684.25 1596213.375 1188012.75 815783.75 824333.25 1392454.5 1036640.5 1249583.875 1049333.25 1380248 1435131 1602398.25 1375564.125 796190.9375 926247.5 1432143.625 1777592.25 1407161.75 1191554.875 764034.3125 1339602.125 869279.4375 1427894.75 1292083.75 1349403.625 1110637.75 1066329 1306422.375 1473758.625 1625490.375 1379681.375 1522825.75 626736.1875 1227280.5 1385085.125 1535275.625 1614731.5 1183410 1624022.625 1246896.625 1527056.25 1383667 971054.8125 1642477.375 1394887.625 1144461.75 1422786.75 1515817.25 2327787.5 1861787.125 1426038.5 1727194.625 1875812.75 1588704.875 1597767.25 1201983.5 1654489.25 1516286.75 1475036.375 1892575.375 1279858.375 1404421.625 1729739.5 1491680.375 1496494.75 2965980.75 2034005.75 1446608.625 1359418.875 1718354.625 1481326.125 1939311.25 1963579.125 1310966.375 1296823.875 1131315.375 1749224 1843282.75 2097310 943667.8125 1083386.25 1250549.75 1306264 1034750.063 1114447 1475731.5 1510966.75 1581655.25 1020935 1664214.875 1563455.125 916018.625 1241648.375 915156.8125 806626.625 1256603.125 808737.75 808947.8125 1039571.875 1279137.625 1529496.5 1754108.375 1056734.25 1856985 1475731.5 1457333.5 1368240.625 1465290.375 873186.375 1359652.875 1530363.5 1594099.875 1569098 1617331.625 1837483.125 2159945 1206296.25 1163110 1064630 1288681.25 1137526.75 1081840 1399497 1434174.625 1519551.125 1866796.125 1697448.5 1376584.625 914905.6875 1372180.375 1567654.75 1598442.5 1037706.5 1312542.125 1792970.5 1473307.375 1612454.25 1002874.063 1346558.125 1776595.25 1426958.75 1684674.125 1034583 1977522 1682399.5 1621363.375 1366190 1426613.125 1376947.75 1427185.625 1545516.5 1851745 1682776 1483274.625 1314366.875 1292310.375 1208175.625 1201520.625 1280128.25 1489422.25 1421878.875 1414340.25 1036229.688 1081569.375 1213536 1578459.5 1614787.875 1388947.625 1475731.5 1671275.5 2014311 907827.875 1341472.625 1239243.75 1388860.125 1568927 1518626.5 1483338.375 814237.6875 1621088.375 1443632.75 1753142.875 1234826.5 1636118.375 1417810.625 1933052.875 1453289 1207290 1619873 1425332.75 1271196.5 1672998.125 1229549.5 1608834 1278876.75 1307496.875 885677.0625 1605798.125 1558421.875 1358206.5 949865.9375 1178940.125 2237716.75 1757804.875 1073201.5 1513462.25 1788746.125 1557968.5 2459574 1238521.625 1518043 1644083 1245305.5 1618198.625 1266124.875 1486034.25 1696014.375 1475731.5 1739815.375 1068003.5 1942739.375 1477556.875 1403111.25 1236561.375 1473906.125 1696785.75 1902870.125 1457522.625 788196.5625 1373116.5 1078713.125 1345834.625 737708.75 1337770.375 2336979.5 2597352 1880732.375 1393511.125 1279102.125 1257539.625 caproate (6:0) 4330767 2788184.5 4427716.5 4198323.5 3845176.75 5393859.5 5407692 6965761.5 6170670.5 5230540.5 6673658.5 2626969 5505155.5 5822494.5 4621754 5998382.5 8709043 5311063.5 5368999.5 9111499 5382370 5522865.5 7098393.5 4930682 8116126.5 6607508.5 9519758 3878989.5 5864195 4500465.5 7459190.5 4291706.5 7802238.5 5102459.5 6906295.5 8917513 6075737 7680683 9428065 6518968.5 4823924 6099065 6555396.5 2267217.25 7924499.5 9099459 5666507.5 6506937 4866803 4238468 3189164 3576940 2317813.25 3510736.25 5800252.5 3014635.5 1749517 3025910.75 2950456.75 1410164.75 3999168.5 4517499.5 2712622.5 1134891.75 3889625.5 2322471.5 1942456.125 2124697 2332422.5 2535908.5 5115966 2979003.75 2546639.75 2309213 1811672.875 3854726 3790874.75 4186408 2922982.5 2195064.25 3133301 3361430.75 6096573 3305390.5 2509419.5 3515551.5 2053820.5 2917941.5 6044695.5 2629655.25 3204379.25 2840131.75 2886801.25 4670686.5 2687598 3243762.75 4024580.75 2815127.25 4411888.5 2840877.5 3394743.25 3662514.25 2968775.25 3785211 2353950 2965364.75 3817153.25 3300731.5 3421948 3856944.25 3997584.5 4424361 3266573.5 3174807.5 3064871 2376422.5 4038179.75 4895621.5 6305869.5 4316544 4826712.5 2154334.5 2813010 3967100.5 3644627.25 3771507 4553917 3884314.5 2865335.25 4700886 4024472.25 3972290 7082501.5 3040067 3299483.25 3104606.75 4518921 2885081.25 3383294.25 3853773.25 2152354.25 5025647 5656969 5347381.5 2303028 2448893.5 2551823.75 3527661.5 2169070.5 3343797.25 3180857 2432112.25 2676848.25 4078471.25 3028352.25 3123233.25 3593669.25 2552717 3685379 2284636.5 2513913.75 3017814.25 2390950 2920792 3104976.25 3473888.75 3035226.75 3368300.25 2743979.75 3718106.5 2760272.75 2505113.5 2829247 3725948 2529611.75 3597600 2009177.625 4117558 2666107 2775293.25 4171958.5 2647977.75 9635851 2987730 4088781 3603919 3419675.5 2179501.75 3444055.5 3207470.5 3625503.25 3783048.25 2470338.75 3897726.75 3957497.5 3230456.75 2247908.5 2812502.75 4137886 4124673.25 4422337.5 2718776.25 9204339 3918225.5 3118133.75 2927974.25 3113322.75 3761931 2643342 3843635 3204530.5 4789274.5 3286470.75 2620046 2327021.5 2010977.125 3147261.5 2770999.75 4145065 3285824.5 2800612.5 3085035.75 2425638.5 2108190 3841098.25 3377374.75 4146320 3088952.75 2278469 3981151.75 2437175.75 3444055.5 4117599.5 4973541.5 4074925.5 6060114 3706397 3903732.25 3381187.25 3723719 2575759.75 4289707 2959508.75 3565573.75 3012724.75 3949312 4450641 3958179.75 3151765.25 2831354.25 2783802.5 2647214.5 2511511.75 4032945 4247156.5 8518023 1806612.25 2614767.5 2704156.25 3677199.75 2676746 2490247.5 3884092.5 6487438.5 3444055.5 2837557.5 4216130.5 3084750.25 4447671 2490606 1417628.25 3261119 4551798.5 3444055.5 3543230.75 2699904.5 2942287.25 2899957.25 4388928 2195744.5 3363512 3293458 3127097.25 3083285 3551551.25 5020755 2832121.25 3842389 5128374 4692511.5 2981312.5 2208675.25 2068448.375 2799093.75 5930666.5 2983566.25 3540641.75 2889429.25 8488304 2425117 caprylate (8:0) 11463326 9690220 7345075.5 18756696 4302031 5560988 11645277 5640632.5 128900816 11329170 9330545 7562101.5 5988525.5 5991548 10433219 5607824.5 9025694 11711247 9611836 6828783 9839659 12536958 23555830 14763195 7506699 89319928 12745671 7589734.5 192568656 5305634 12951565 10639827 14861798 7882657 7803962 9552584 7600917 11716374 13522827 14374464 5913034.5 6675224.5 18329342 5115820 15367379 8776410 11856748 5744839.5 7771584.5 5559327 10123445 22990844 5512348.5 6351238.5 19263994 5550461 3258459.75 14177286 7137606.5 6386252.5 20119588 15231177 7550465.5 2653647 9893715 4639284.5 7086379 3133358 4414885 7706234.5 18248970 5005631 5891688.5 4005718.75 5422855 9817312 7815159.5 8344038 7903311 8592498 5982332.5 11058755 15997952 8366979 15968363 6710060 3665616.25 7715260.5 14654999 4695135 8630457 6265075.5 11735284 10415015 7024762.5 17443384 15891201 10834213 9199884 5296008 6710109 10546991 6667799 7430334.5 5401168.5 10659032 9114281 6331491.5 5676819 9884449 7189231.5 8302761 6948430.5 9276788 5748457 6656055.5 15222031 12652408 16342333 8575731 14847180 5878635 4179806 8052341.5 6992317 10541636 9001129 10255704 4260876 13636204 8777526 14074080 8052341.5 7498450.5 7241740 4804453 8697102 3845663 5653873.5 8513428 5479486.5 13296190 21826424 14826190 7423520 8366475 5968985 7179538.5 5596122 8631697 4282527 7383197.5 5344423 11189950 10495543 7442615 10459839 9506117 12965279 5605884.5 4464782.5 5397063 6175367.5 6965414.5 4184271 10728530 8795936 10818311 9229320 8969578 8358058 7020985.5 9868705 15545447 4335437.5 4818566.5 5120210.5 14196089 6077113.5 5211156.5 12506451 4104539 35478340 4842943.5 10424828 9174532 8561170 5176135 10106673 11561436 6498905.5 7568301.5 4598158 11942730 14495834 4076944.5 5438009 12102381 9098733 7383942 11804780 8052341.5 22560646 10925486 8612894 7601511 7742924.5 13099242 7255888.5 14082073 4385689 11176518 8052341.5 8414231 5313004.5 4985642.5 6500249 7908435 10275551 7045748.5 8210562 7648035.5 6056230.5 5019115.5 12576430 8530588 6136155.5 3730882.5 4169462.75 11311406 6766443 8830805 11413657 20336666 17310420 50918616 10439591 10715443 5309769 9857927 3691237.5 13171314 7590986 6225069.5 7659570 9613873 16047567 11074361 4643475.5 3518252 3811617.25 11187297 4312947.5 8273894.5 11585899 21789142 2669002 3615899.25 4974265 8103079.5 12131473 7256453 4458256.5 28172022 7829420 4880512.5 9365228 4104851 18117184 5134779.5 3799138.5 7549492.5 12977308 9704391 12249592 7685889 7868346.5 6755873 11545683 7697122 8228300.5 5673752 6674793 6831892 13167425 15646130 7876382 14348356 24531900 15463388 8466168 2741085.75 5500665 3359147.5 17640122 5662433 8976510 5430635 7095302.5 6383216 pentadecanoate (15:0) 65744380 118096712 94555520 91437144 82067328 88548240 40394200 52369112 47763908 59856828 119470024 76982192 43364864 61134856 44805192 64086364 38368796 53916676 79902416 38136672 106319504 80102488 81512960 38506264 71887920 85814792 132179072 69556976 121712608 50535772 48663992 36977004 95594864 51877128 56820196 70918912 53993804 210021296 48492836 39952112 47354764 85135776 62676036 46137060 59689620 51938168 58253368 60307676 69322448 47923672 116522760 144276432 66307568 99288280 95448960 26666032 31996242 99013944 73278672 39173100 154107488 65499876 40984836 20661502 51890784 51203692 82886520 34385760 93566624 65716788 67480544 70181960 51217208 37174888 49754448 68182456 53296428 84220760 48431496 70068024 54375048 47555368 71382088 98830880 30442908 99431832 40060204 67512616 91490240 79520584 85000376 81875656 56734788 110146144 140480672 255945648 62577868 80516688 72293688 58156284 39932756 136608688 56336568 94647936 175438528 40349748 113711968 77617968 66908940 70642304 197463200 77951128 84780616 161045280 80035224 61729152 73578304 51719004 91423168 68304320 69793120 85509056 60864756 119410504 86722920 83823952 68099968 72261408 170899840 113186800 75058184 90293784 74533016 74326224 57381280 54816320 78628944 76408392 50790496 80790648 59868248 91130584 125254320 87137336 98473216 34654224 65430560 68886864 38139904 44245756 76368704 99403704 108298880 56673240 89980768 107887496 112369472 144611248 110192912 37181904 69790216 52165716 86557008 83855744 36837388 105739752 82372312 55592972 95409720 56120244 89528528 122787408 78901344 123020840 54050416 71061080 161947808 63855184 82750424 60551432 84482008 39391572 53253748 38302304 75460840 87554616 35219504 69793120 71772352 91157944 69793120 56559300 60691684 106805168 66640680 47089420 52286740 137441632 45552136 63684196 80375896 72311224 83902472 80018872 72420072 57476320 55788656 66455600 63242548 72955640 33764832 114667840 94847408 50757312 52041060 169542960 95953016 67457184 88816056 75791960 26060660 93109648 61737496 30026688 67373728 194158128 92087144 39858308 52934464 39341892 41893620 45466364 58785880 133190416 118264696 120136032 95936328 126186872 62470704 49875940 53286828 96706992 78116904 75137536 81489336 127120688 115950600 63819528 85374096 132896112 64535184 71993784 75293160 77552016 144945936 54742292 49214048 58676380 62236428 66290072 74532696 67566136 53174076 54144264 78600096 68968808 61010292 106468624 85745584 52978064 103279480 94216592 99053160 71156688 67416384 85495816 72564976 60770960 43180740 50898260 76656464 50330500 35773220 28916100 139591696 61383676 174940336 55915404 76273272 58896828 63919640 30339330 55364340 57072384 45426560 81593648 69793120 60702260 55115848 64086748 5-oxoproline 55612408 30224308 39427452 35549100 22731372 49811808 32734460 34206848 42004276 40047920 36657276 41371308 39200416 50516820 30770814 51471024 37714760 28493322 40994816 62910972 41975276 60485424 41889152 43918004 39450488 25239312 49516744 33130250 34002256 30113704 38996256 28554930 43486036 44532184 49789784 60866212 34413340 67916816 37325652 59073772 36893764 30888700 41597448 38188964 29825722 50036600 48968256 30299694 43903812 35843504 66478004 175534672 34544372 51336080 86294328 63420000 22763212 46100960 51855668 60511032 319156800 81693904 113211952 20609728 88808112 194465376 43139680 32114758 49105416 21221460 108570600 112320904 53559576 42368096 102511824 110379128 38924924 52722024 40362568 40298204 47747552 81548848 60679500 76181072 29152636 66075360 69943864 30247918 27032552 66337376 59484588 30928854 60387704 39264428 37552132 43248364 200799488 165248944 134307920 37096868 31826264 41760372 62901244 46428408 48346320 71368448 48719212 33503948 32842070 90422288 105852816 53629784 78897832 40240348 53297404 51861908 62659492 64743876 40355924 77802736 178713824 94764320 23588864 116914464 65708860 59083444 64656776 58507176 51136576 94859920 60770404 80314568 28277648 49830732 70712544 254975584 87763456 257161472 19752234 70367912 265677488 12839962 228228992 51993900 35625908 32498834 206065152 29766066 35877676 72888544 48031308 39479432 26139358 96452840 122866192 34891300 468969408 113930712 72206072 53617348 51136576 41807328 102444128 41062724 153179040 50641380 51136576 77551112 84691960 41548336 134647424 53507700 125633360 31162708 38163996 72053904 83761136 78622032 65245560 67669600 26548968 105440224 164224240 94147736 80985848 38397728 34037244 78261016 61884140 38364736 38545492 73873064 77499304 88635784 34752300 100865248 42764092 61787028 209128192 51989924 170292384 59469208 52121932 148707776 31747248 53661064 201811808 167123008 37071384 105049968 25504996 52602816 29653554 55349996 66373164 36709372 33097232 146714912 46361428 79952536 31339706 68844000 182863744 32204880 41802336 43597168 50937076 47994256 34033036 54892708 41772732 218623808 42262940 95295712 62311840 28581684 56952548 79841320 78455352 42737728 29436918 44635196 45406308 40653568 41897292 51798420 69585384 104102160 57350584 67794456 28269994 37717460 101385136 79265872 51720244 253759136 38743940 90953696 36934024 34307252 80539016 58373396 44270600 60264724 35751240 61516352 39936736 43795048 158006704 29845244 52087516 35266916 74574888 45938372 49863352 67891456 73787656 44946628 48838868 29988200 47572720 134124976 25159902 40851180 86045528 62721988 44486992 42350572 219337600 36873488 27642340 51760916 66168760 69222208 64580760 51136576 37663972 48283908 71217416 43497680 pantothenate (Vitamin B5) 2682468.5 6241061 4655511 2943279.75 2712195.75 5062023 3869211 7646838.5 2035275 13753583 5351259.5 5296875 12528565 2963206.25 2815266.5 3968409.25 3355293.25 5747169 7095533 3233843.25 2877265 5742643.5 7084913.5 5084934.5 5111308 5181575 15566044 2566697.25 4742442.5 3657347 5521348 4395527 3777405 4549233 2876387.5 3430767 3970310 7648718 3628560.25 3224010.25 4840312 6989220 5244649 6951749.5 7318776 4136242.75 6205145.5 3498226.5 5038690 4287780.5 7147422.5 12848725 4309663.5 4501947 17026012 5560703.5 3231752 4143627.5 3370129.25 7846150.5 10887350 7693678.5 3197347.5 2519159.25 16000073 2341523.75 9231400 2553843.25 11829276 4496137 7030372 3372347.5 4734100 1756601.75 18137426 4647188.5 3399899.25 5111308 6072818.5 5785680 7176053.5 18922738 10055365 4276740.5 5061467 4042292.75 2753897.25 4550177 13583106 3839369.5 5216105.5 3174993.25 15866913 5355124.5 4775432 5275530.5 8351912.5 9831606 9868102 2864264.75 2989507 4463633.5 6622027 3252887 2070681.25 4640546 9823680 3070745.25 3678038.5 3417988.75 6808040.5 5509755 4764975 3981113.75 3297614.25 6787310.5 8251024.5 15879421 4228651.5 2490732.5 8550358 22344256 2257340.5 7458456 7958129 7644524.5 6357084.5 6617641 4987752 8337368.5 3763423.25 8091215 6671595.5 9152305 2615435.75 4612939 4083550.5 4449433 3222478.5 7875867 5203383 5834855 9863321 3350767.25 3925258.25 2648185.75 6594094 3399797 7234698 2646469.5 6825252.5 6346681.5 2994256.25 8895660 13842766 5279519.5 7941726.5 5643333 4963875.5 4792926 4942324 3796801.75 3539344.25 5111308 9101417 5951835 4956493 6632157.5 7795744.5 4612012 5921789 4114774 21551386 7632321 2955768.25 3024651.75 7903730 2743821.25 3033402.75 4013063.5 3900263.25 11077348 2954016.25 17863288 3294074.75 3509142.75 3179655 7745906 15886379 7469301.5 9249372 5837797 5994070.5 5823057 9344479 9582350 3186708.75 8834337 10780939 3365285.25 20388624 2420024.25 17203190 3227588.5 3145273.5 2837845 3126805.25 5111308 10769171 4647624 9339356 3423890.75 3873954.25 7883086 5455675 3743994.25 5923948.5 32561104 2897965.25 3351607 7070667.5 3004640.5 20883522 14298486 3704597.75 3147620.25 5370056 5970474 7042359.5 3138945.5 4499356.5 39734848 6292418.5 15353571 5700379.5 7101845.5 2772343.5 9602912 13087744 4613940.5 4890462 7287167 12034211 4965710.5 2854187.5 4312540.5 5179564 6314762.5 4445123 9260411 2892306.25 4552208 12453608 19479760 10497649 4914553.5 19723466 6663510.5 2218954.75 5892972.5 9703140 4996127.5 3929182.5 14204783 3943660.5 2865566.5 5138397 4350708 8455719 4155961.5 26290338 2503126.25 12896599 7293337 2972458.75 4750995 6314090.5 1642164.5 4139376.75 6665992.5 5160593 3305705 5529036.5 7818190.5 4711530.5 7136137 7526367.5 2954570.75 5453095 5008698.5 5378106.5 6541968.5 2688627.25 10860608 3335313.5 4297700.5 2700542 3968110.75 7207580 8031923 N-acetylleucine 656798.5 500739.875 261670.9063 326447.3125 314920.6875 719930.0625 429011.6563 217453.0469 343106.0625 391993.6563 350809.0938 251934.0469 434272.875 442929.875 303333.7813 318223.5625 385201.125 276987.2813 259057.6875 208429.7969 365365.5313 209670.4063 279687.6563 262226.5313 312793.4375 213797.5625 232991.9063 291026.6563 149020.6094 402735.4063 209501.7813 262268.5625 617780.4375 368549.4375 538247.375 480224.25 372041.6875 277059.3125 347987.3438 260564.2656 267463.4688 285590.6563 448397 297304.9063 476936.5 320220.4063 306651.1875 933990.375 445464.8125 391276.5938 531285.3125 1651306.625 528743.8125 193205.5938 358294.625 307199.875 866011.375 511326.3438 451329.2188 1307046.75 286301.5938 1058693.125 408247.875 767910.8125 224608.75 814837.6875 474321.375 893368.25 329676.1875 330026.9688 533593.875 825123.25 769655.25 388112.6563 544468.125 303520.0625 851249.375 1108075.375 956015.75 1037684.5 722518.25 247616.4375 743534.25 260316.8594 782546.0625 381669.8125 112828.4297 431461.7188 281823.25 707883.0625 912528 315528.2813 875755.25 568923.3125 696772.875 889450 428672.2813 399520.7813 576343.875 592641.75 616360.3125 259236.6719 413444.1875 449218.5313 388332 230091.375 508740.3438 242276.5781 735064.5 359331.5625 262437.9063 433889.0313 448397 338047.625 916419.4375 909577.1875 881624.875 1362684 1244852.875 312564 1185519.5 1160730 864298.5 248065.4688 628450.25 537631.125 1112388.75 901911.375 1166446.5 357819.4063 793830.125 556133.0625 263867.3125 534291.8125 563362.25 260190.1406 946946.8125 288153.6875 448397 1378883.5 523403.2813 198834.375 162957.7031 384416.1875 277727.5313 776421.4375 252234.1094 280881.3438 810416 258514.6094 717646.6875 1141203.875 274812.8125 399370.125 341560.25 337277.0625 325654.625 225126.3438 354031.7813 286735.7188 388142.1563 715353.4375 409059.2813 440193.4063 326176.0938 418368.6875 338490.5938 434476.9063 209141.2031 877866.1875 445266.75 172767.6094 226097.5313 607814.4375 680181.6875 515837.9688 326786.7188 394149.6563 911536.4375 498934 949209.875 1176185.625 463623.6563 365211.3125 344293.5938 691360.1875 749688.625 653038.375 839095.625 192636.5625 630251.9375 263446.2188 942058.6875 293247.25 623376.9375 912220.75 409499.9063 703397.5 525026.625 705241.0625 1103118.5 195010.2969 735745.0625 554763.375 453508.7188 474827.4063 804231.3125 632332 451527.2813 421382.9063 510953.3125 761643.25 324117.375 320543.6875 809330.4375 590978.3125 504614.25 421883.25 461080.2813 1154144.5 891051.125 331219.1875 285424.5938 393980.1563 678212.125 366534.8438 304003.25 685825.125 894855.3125 549553.25 1499819.5 852198.875 455652.4688 508757.5 1652952.5 951391.75 394166.1563 569356.875 701092.875 785111.4375 440835.9688 498419.75 141491.3594 585676.375 1005582.063 594945.9375 701496.0625 284897.2188 471279.7188 724632.75 721752.75 724817.3125 1660271.375 611277.5625 502276.9688 326024.875 263327.9688 1312992.375 545564.8125 566745.6875 1554320.25 304082.875 370338.25 406151.9063 786085.625 732862.8125 299915.7813 617673.8125 374176.0313 1900891.5 243635.4844 407718.4375 411660.6563 548158.6875 423523.7813 332705 376839.0938 338105.3125 253780.3281 420916.8438 489071.6563 761405 794774.25 837267.8125 328029 1090929.5 665833.5 399306.625 446231.4688 357459.875 635079.8125 148718.5625 402131.125 587405.5625 260732.3281 601594.625 439842.75 N-acetylmethionine 352475.5 1026655.313 1033587.25 1359489.25 1225271 2569745.5 666146.5 633724.75 987249.625 320736.9688 488850.8125 987371.75 1102967.5 830680.5625 630759.125 862180.625 897760.125 1287390.75 505981.5 1087645.25 994954.375 941907.3125 1083006.875 494244.875 826171.625 1134433.125 1643045.125 613321 1162847.625 1376014.125 816365 685081.9375 1180895.25 1345029.625 1136111.375 883617.3125 1142187 2327938.75 1250719.125 383826.375 537210.5 630588 414754.625 504322.125 943821.9375 683305.75 913586.3125 702623.875 22764.1074 1013674.813 531962.75 243217.9531 566304.0625 8617910 15552949 12655982 1258290.25 1804545 786498.1875 12532859 3219913.25 1349982.75 3431252.5 1765098 18939078 1696434.375 11003131 1724172.875 4756128 2861667.75 2144540.75 1375274.5 686793.625 2276852.75 14251099 1692524.375 1105553.75 6937159.5 5820029 10708836 13462084 6374336.5 11237107 9989019 4028789.75 1051821.5 646688.9375 7355705 3904631 210864.3438 3202230.25 129633.0234 9359699 3309435.5 150316.0625 11405132 225259.2656 69416.8984 9068373 1784821.5 1318596.375 1645164.5 5941422.5 3415395.25 1381123.375 1082336.5 347773.375 1724214.5 501576.5313 849219.3125 1517973.75 10163311 3883485.5 2583749.25 1685388.375 1293088.25 2940940 6156194.5 5308847 7303561 7374434.5 5208854 1793150.75 4344535 8035162.5 6304775.5 1376626.625 3373381 7801580.5 1712265.75 8862018 6671704 1067510.5 680811.6875 1434393.75 438802.1563 6154569 2433786.5 2139367 7731487 2141925.25 6352904.5 1454040 1485481.5 2116431.5 1199958 2232912 862413.1875 4105870.75 1784821.5 3104988.25 8881866 1369394.625 10897993 6094186 1283343 187332.875 138546.0156 2128432.75 1803908.625 1077580.75 2525868 2873172.5 1138591 5292574.5 1674029.5 3176831.25 1056528.25 720773.125 780893.8125 1257232.5 1423903.625 13486165 4719444.5 1747097.125 2068449.875 1784821.5 3654924.5 1117931.375 4990176 3703471.5 996043.125 3644173.75 9563828 8770180 2534090.75 2142132.5 1508368.5 19853212 14585401 3867672.5 14080015 1986008.5 732028.1875 751204.9375 16429270 808672 12363562 8999040 1127107.375 5581404 1725819.25 154936.7188 6693223.5 526564.6875 2130238.75 2138546 1834786.125 1457885.125 2194317 548586.6875 71140.4688 1098029.25 1260247 4301249 1808685.25 1480503.875 632301.9375 2147656.5 2155512.75 1151261.125 85929.0703 3286379 4421867.5 921780.625 1328432.25 2074642.75 1693707.25 5771187 3245498.5 2837658.25 2937514.5 77779.3516 6851844.5 6392128 270619.1563 3947287.5 6510793.5 12062048 171835.1563 2929715.75 1929652.625 7494005 2052629.75 72317.7109 2115654.5 490875.6563 12463750 5859603 9303558 515139.6563 3218620.25 5624239 9866622 7485992 18392298 244970.5625 7496208.5 1525437.75 2745461.25 11760225 2650425.75 978992.5625 2317475.75 201856.6094 5679154 397720.375 4673940 131319.3125 3945000.25 4719374 3158163.5 18195224 963547.375 2340278.75 689992.3125 1784821.5 1894351.375 1634311.5 589084 756188.0625 1461950.625 5152729 17737336 2079833.375 15817331 23220090 4897952.5 20660328 297790.4063 943216.0625 1260049.625 4643872 1684265.625 141743.5625 3186774.75 3176921 402232.3125 2946041.25 9349345 N-acetylvaline 916677.1875 657979.4375 478593.5313 691654.1875 593734.9375 975193.5625 409183.625 334853.9688 371937.0313 751968.125 463694.125 470721.0313 453066.125 287713.5625 341125.3125 462265.75 280559.8125 522308.3438 358833.8438 453664.0313 313802.375 449240.125 843206.3125 324140.1875 683590.375 421443.125 607491.5 320468.6875 575172.25 461025.4375 455434 399705.0313 554960.5625 495260.9688 581739.4375 331008.6563 608762.6875 779438.625 514459.75 454149 469714.9063 552895.6875 366905.5938 422141.875 622706.0625 535006 766451 368053.2188 314033.3438 454711.2188 2450588.75 1329880.125 807214.25 1563614.875 5517456 2220640 475714.1875 660239.9375 551794.4375 2543155.25 1443901.875 675417.8125 3304271 417970.5313 3011928 691238.8125 1450515.125 409169.1563 1524398.5 577065.875 2100341.75 442721.75 633313.0625 653822.125 1443895.5 1243156.5 445774.4063 571327.6875 885392.375 2174980.5 2529919.5 1811190.5 1909461.75 848334.875 576042.875 1173213.25 375605.4688 1326682.375 561783.0625 387685.7188 831873.3125 261750.8125 1307085.5 1601854 854348.125 1776837.25 1299640.5 1729917.5 1917652.875 393699.8438 961565.1875 996312.8125 1541539.75 761210.375 468805.4375 1241510.875 667553.875 492243.625 365485.9688 434130.25 781038.875 2017282.5 935839.25 638605.8125 792723.9375 870052.5625 945476.6875 1830748.875 1172343.625 1149247 2871888.75 2139473.25 454530.2813 2052677.625 2326121.25 1060777.625 783603.5 1317533 1357986.375 2494252.75 1093416.375 1892826.375 937516 2236580.5 755191 485107 1509138.25 895031.4375 569944.625 3888860.25 935099.25 616843.8125 2825370 1486646.25 480597.4375 358043.75 771654.5 617886.75 2094499.375 782604.9375 980516.5625 1678895 409128 2289849.25 3261074.75 882523.625 434690.9375 934708.0625 977355.75 572887.1875 578717.8125 880994.1875 1007261.438 884998.9375 2032361.125 1006398.25 1624877.5 737029 1157020 748760.375 890839.125 824073.875 2758176.25 907570 608898.625 616828.375 1243606.875 1106064.25 488470.625 1075104.25 728848.5 2445790.25 966843.375 2889749 2334552.5 569487.1875 1448972.25 747392.5 1996236 1899785 1190250.125 2084244.875 605069.375 2218333.25 833303.375 3044163.75 576048 2177271.25 3113149.25 492102.2813 1860070.75 473742.0938 1774359.625 2024013.75 498983 1243182.625 813201.6875 573615.625 1321300.5 1720733.5 1257499 499576.0313 610218.375 1364593.75 1565123 831024.6875 498231.5625 2505160.5 2108173 1176194 962322.1875 679371.0625 2970888 1560390.75 967015.625 693220.9375 832782.375 1716746.125 1004122.375 968362.9375 1155967.25 2312740.75 907570 2495316 2155719.25 1322875.125 1178203 3640594.5 2525291.25 619369.5625 1155613.875 1991144.125 1693992.375 907570 923980.5 547166.9375 1756944.25 2230843 1170780.75 1892357.875 333381.3125 1787730.25 2608337.25 1770085.375 979153 3847937.75 1151612.5 2155060.5 452995.8438 658162.4375 2360913 1175119.625 505055.9063 6221808.5 955213.75 791241.875 640266.6875 1329015.25 1764544 488803.3125 1886800.625 745391.1875 3815561 406317.375 872162.5625 694484.1875 1344987.5 705387.75 511197.0313 898462.8125 686572.4375 584970.4375 1584957.25 1292912.75 2810732.5 2649001 2470216 827348.4375 2810889.5 965504.5625 477537.4688 1223276 907570 1698981.125 419557.9688 1053893.375 1193450.25 539392.3125 2097888.75 1714941.75 erucate (22:1n9) 4135412.75 6798144 4984931.5 9094202 3004619.75 4491420 2502122.75 3245938 2473859.5 9741820 8160978.5 5831791.5 1939746.5 1827592.375 1592936 3388018 1279358.25 4945187.5 6092377 1297195.875 8683328 3828507.25 4805799 6033050 2592226.75 8785767 14336200 5458784.5 5297152 3401423.5 2168582.25 1472911.125 6733540 3375875.75 1650386.125 3191621 3926092 10172336 1652808.625 1557088 1052131.25 4702293.5 1696401.25 1438829.75 3619125.75 3166120 6224152 1578907.75 6936725 1458869.75 21196432 57084720 5487709 13230260 39583400 1832454.25 2312272.5 18046210 8387709.5 7851273.5 21100074 12551098 9312109 2939699 7288963.5 6969654.5 7972837 2291298 15360460 4613785 5696943 8018217 6618023.5 7862499.5 10636887 17875970 8070994.5 10827496 14202024 7294131.5 12878642 6651988 17656980 16788468 4287756.5 21555438 3497198 20911440 19016202 10762296 14627443 7897021.5 5440756 16795992 10247822 58287500 10074794 6694137.5 15821908 4586569 2404885.25 21511454 6943356.5 13105403 23882848 2119316.75 7189678 8829654 11701144 10280827 19592030 7811202 11342742 24648092 3932189.25 4820349 8992935 7846339.5 18818570 14267967 10679087 11151844 4120858.75 11305914 9000863 34899176 12676112 11719924 16784876 26170108 9234608 5268471.5 10246073 16440744 7992295 9958883 12651461 9881980 4490612.5 10952945 7003152.5 11335941 20998428 13783993 11671408 878699.5625 7132709.5 7897021.5 3941279.75 5915926.5 6693554 24913494 7373833.5 10280904 8367773.5 10015933 16623264 8492192 8379516.5 4182026 8473108 7223254.5 10499015 13309664 8176027.5 18690280 10032973 13582184 17832348 12333864 15255236 7897021.5 6814999 13785264 2617816.5 6448966 57140952 9837992 8522000 7285454.5 26942580 3672188.5 4592900.5 3639081.75 24671270 10556786 5372236.5 12606923 3716521.25 16339453 9278460 7261119 5157701 9750399 14532656 7467197 3000794.5 22546176 3900307.75 11005346 5948244 5596634.5 14684351 29683260 5070079.5 12509480 19890834 11575243 7897021.5 21061958 6044083 7783280 10227028 10286063 4765609 16769912 9286361 4384907 19962338 13048083 545523.875 19606800 13883936 2641734.25 10130774 22094714 5816947 1905358.75 2986287.5 3298982.5 4789778 5344889.5 15410228 14651373 13189928 14139475 15479108 39505332 7502823 4120295.75 4038628.5 7310918 18849842 5950762 6906346.5 13748308 15409857 6890592.5 13266599 7397389 2514216 10983977 6561921.5 5213059.5 17431554 9467008 4507708 2630236 2839538.5 8364515 8299861 6199761 4665895.5 39816228 5401086 6658770 6372711.5 5594305 20100640 5586445 11146961 8725809 16946756 20966086 8764491 6942662 5190337 7699508.5 4239388 11171009 5916702 7942769.5 3320185.5 4430753.5 14270333 10126500 13816432 5576554.5 26470546 8192231 6732585.5 1033261 2143547.5 3436997.75 9859042 6875053.5 8706803 7302107 6036748 5929624.5 thyroxine 645534.375 663508.4375 464216.875 595733.25 659401.625 556336 476485.4688 529564.9375 760052.0625 353326.0313 573264.5 752327 833868.8125 394783.3125 493456.5938 518134.5313 482196.5938 746520.5 413869.8438 674676.125 714354.8125 556613 614156.75 283325.6563 765220.6875 1154126 750237.125 671204.6875 725959.8125 537876.75 644795.875 519225.6563 668676.875 673636.375 669463.875 422721.625 616264.9375 929326.125 534461.3125 535864.9375 400618.625 534835.125 611557.75 496825.0938 443588.8438 475224.4063 559795.0625 436472.9063 598832.8125 299964.5 223057.9844 529722.75 290409.4688 286715.3438 300731.4063 121853.9453 118585.5 414747.4688 386225.7188 195691.3438 415507.875 103617.1719 151727.6406 490045.7188 55582.4648 663935.625 221587.1719 196636.2969 280390.9688 424534.2188 396208.8438 175178.6563 216921.0469 291085.7813 519440.3125 224711.1094 125307.3438 274506.3125 425140.9688 187875.2813 169439.1094 308843.2188 87256.0313 444106.7188 128872.625 381671.7188 398119.3125 254449.8438 477141.9063 102572.3359 58451.7344 459786.2813 207177.9219 121702.4922 564623.1875 140289.8438 431294.4688 115987.2891 156651.1719 451346.875 521074.8125 326781.1875 142028.8438 266325.6563 495899.7188 226204.5781 923224.125 419352.6875 397348.2188 439416.2813 534775.875 209804.7031 470515.5938 42779.3086 148862.1406 196034.6406 112899.875 374629.4375 179074.6875 374160.6875 47834.0117 155830.3594 192682.4219 385855.9063 274521.5313 379743.9688 237933.2813 472345.9375 60439.6445 395588.25 375789.8438 258718.1875 218436.8438 257860.1719 608912.125 186008.0625 335093.8125 306575.6875 394344.25 305618.5625 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481160768 375284544 678010176 665398400 455893216 854791488 654288064 550063744 472399648 407531616 606330752 467825696 593205760 251936864 623162304 525561504 550394688 495533120 565339264 314110016 675971840 400387776 511351424 446003392 525757280 517174592 485545344 752150976 438830560 434121824 611510656 344035904 394732800 479544800 536959040 604483584 367701920 780059776 1091139200 345925312 723269824 596238080 903790336 758112640 480130048 774895744 622400000 447252512 806520960 382575520 594899520 745820032 509447680 714291648 677071808 712029952 752546624 499522304 665471040 320016640 718897152 345925824 557487232 480635136 423892640 399085120 466367488 343661664 648613568 722725568 500107936 336769760 453830656 646678208 619267584 650644992 539971264 714927936 614708544 377372000 574631872 613352256 555390464 701144704 535468896 704831744 485900896 426295232 565331776 471759712 312358208 575077760 448295872 780989760 769060160 794582144 575009088 550392128 591951616 512796384 552361408 712524544 459502976 485569376 489648928 747476672 610468288 537254336 648920896 "5,6-dihydrouracil" 186175.5156 192334.9531 79066.8516 172570.6563 184104.3281 208595.1406 270757.5 237871.6875 330844.8125 184840.3594 229628.0313 184529.5625 159724.1406 66569.5469 123600.3594 198575.5781 292826.1875 325024.0625 103608.9922 523231.75 145899.1719 339646.125 311533.6563 259802.0938 198062.0625 445453.5 459490.1875 468426.2188 1038743.313 489012.4688 194025 248265.0781 250192.1563 292699.4688 324970.9375 412319.375 288526.9688 233647.0469 224650.5 500569.5625 297492.6563 584595.125 157287.1875 592013.8125 143715.7188 2984793 424842.1563 1352537.625 493286.0938 639059.8125 159237.6719 179990.4063 145344.6875 260289.5781 717680 458669.125 295863.6875 231180.1719 135077.9844 203698.6875 279410.125 181823.7813 3254836 484820.8438 256801.6875 352664.3125 934686.125 578933.1875 294252.8438 497414.2813 179296.2656 194134.5625 226655.5469 237855.1875 289527.625 1218792 285304.2813 415192.8125 256210.7188 221915.7188 238639.875 272181.4063 206506.4844 225600.5781 106719.7734 251710.6406 439766.25 269333.5938 433453.8438 326226.875 221533.9688 245224.7969 1985796 336225.625 327046.1563 236835.7031 538159 181424.1719 215018.2656 359123.4688 175291.375 241981.1875 190516.5625 406357.0625 341263.0938 161346.6719 219400.6563 216517.5 392270.6563 413873.4063 167414.4219 1063922.25 214307.1563 1616612.25 350052.6875 588307.0625 430030.375 742895.5 183328.2344 366695.9063 289804.375 318905 136767.5938 1049854.625 252847.4688 71194.0313 347375 291434.7188 96751.2344 210543.0938 395475.9375 553114.625 140841.2188 1230744.5 249049.7656 506460.6563 181295.7031 210686.1719 1305948.25 134713.8594 216764.4219 515439.9063 237036.375 382840.3125 88273.4766 331698.4375 339284.4063 204368.0938 520633.375 148795.9219 270757.5 258576.7344 502341.6875 262700.9688 76010.8516 442492.4063 168829.375 271192.9375 223589.0156 172474.7031 714704.125 362793.4375 438371.3438 315277.375 urate 228125664 116517160 342587584 179434704 196053520 336365216 161805680 230662912 170725200 326685408 314376960 142413792 263803584 154040800 218211360 226355408 200774864 247575712 226760592 274046976 197734560 228289376 233070160 366148960 340233120 198947392 219387616 239565216 217430560 272669856 347471584 133209448 260535072 335258880 263670288 1910064.875 316197792 383733312 292444224 163861984 178822176 241264992 226355408 259050544 285606752 240396192 231404832 198365600 133983552 207243728 388457408 413402112 216702112 172890080 359465152 240327744 143035136 134915376 133153336 288646624 326110208 207276368 347338720 68251752 306507328 88086856 238668432 102926880 317082048 208709424 369973280 78960376 178711056 105461248 225052352 225776256 169986944 193133760 236368608 265328976 438431936 284355424 232135520 236259088 115153648 167050384 85327152 215949392 68348312 98927120 81816984 45916968 314146464 343851328 231730304 240192544 422973472 511740352 212716816 90360192 359099520 179262432 231702112 167787712 57264552 395859136 128578144 70264224 227109280 58317364 462571392 273965312 151369376 278845408 198223008 153154688 220353200 505265280 134699472 133818688 232082720 448178720 123889328 297483328 187330960 99654608 323608256 247092192 463927552 347365376 140268096 204887056 290995776 250795008 171725072 117606072 284364704 102903080 128557952 390154784 288136160 193112288 507707360 202878992 83600416 178185760 113728928 109196544 271673152 168697776 228746320 193915136 135160064 351746720 424355776 244308672 88070576 142821216 241388928 160927360 192369376 205499056 182075216 150196032 534031648 106325704 200993504 148395056 151800608 218234240 118878232 160864896 310347296 309664960 150753936 110615944 161637072 219547632 147386224 149709408 144169680 348441440 63922620 376360864 397032672 177889216 377756096 166960816 353468608 288483392 271909920 216132000 143202512 180176736 245016928 317349664 210383888 322091104 402029664 164277600 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34656956 60457352 168600032 17945704 9900628 176673136 199405328 19115484 2725236.25 41194256 868742400 29617602 60803592 60449920 876952000 73289088 84876840 591650368 9964983 51829956 342980512 57087148 155489280 44347440 24179542 91608928 694934080 11987224 403210144 45118832 7895373.5 26384018 32939788 41797956 138930384 54742764 232478704 25313164 57715516 1019345088 42902436 66198988 84372968 30324368 54638868 21335674 16559789 31625716 40669924 841479104 789124416 71780712 65309936 331215712 163701024 809258304 29378050 893531328 12087464 745535424 17729886 22808978 7972139 697830912 20179576 37630996 42266932 142060080 96374248 2373854.5 62330312 23180756 1755959552 62597896 28939414 43026268 54690816 152943264 55661904 97821952 37143756 433697344 8407988 105366088 621459904 29845522 311318560 109804024 209573296 73093256 7556010 17541158 9991114 91563560 382072832 21495618 33932600 301955488 811063936 1282107136 413990784 1228774656 10250523 2646817.25 38045572 103744320 275450880 84048112 41051644 52582264 39128164 368281824 717437568 11083285 291073184 9787857 114355224 129414912 41877280 2035740800 93416048 42334664 8284092.5 158657072 25274094 15828589 23195668 123836656 39519124 66292572 7767586.5 148892976 18827618 2305304832 40868864 2522306816 2857442048 32560136 19066816 827731072 347249440 77467000 2123542.5 215683840 113237592 133784864 45029016 92155888 71868424 81469448 38780836 993205952 96869312 133225832 117736008 54623724 77768912 36245020 182133904 80690328 150822320 619436160 295847680 404432608 21326988 174392992 330475104 7360694.5 47316784 18926336 104278808 23038142 12076598 14321271 26723636 392321152 267021136 137434560 8635444 12386209 54234160 2372479.75 2677617.25 16439819 281636544 7676805.5 875575.0625 16699753 6585496 93088760 97529856 241894544 49076120 46629276 197881520 597428032 17136746 3102396416 705062.5 3536011.75 155067664 7980040 32707774 31626210 36509920 19114804 25635648 171466304 33819072 73382952 24304442 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694560.75 199953.3594 1029627.688 69178.1641 1154313.375 1019895.313 239541.7813 4111374.75 3843903.25 864724.0625 77933.4063 4178102.5 117805.9453 2114202 389928.7813 316377.1875 1831065.375 228754.2656 27050298 398690.0625 176185.0781 259206.6406 401659.6563 1332200.625 7065851.5 11982038 107221.1094 500726.875 199190.3594 557921.375 7151649 333385.3438 910248.3125 634970.6875 1221590.25 1190290.5 124972.375 71053.1484 3400352.5 2575537.75 3728745 853991.5 1147726.375 457602.875 433176.75 4632326 7812618.5 2200657 43180332 37202700 303251872 9690181 43402860 449640.8125 804576.1875 67035740 2221936.25 455703104 8782444 6164732 144617440 11161216 299939264 26424762 48359280 4680860.5 136202912 1490447.125 19239132 11368394 24559564 1242835 2065121 50422564 11738239 1648390.5 494490.25 10492511 269213760 23782070 43511192 21121470 80899064 29973400 11810001 295701376 891047.9375 3445148.75 64145112 8655033 21741038 33564148 3376152.75 5644990 112233144 1564882.25 189474512 843263.8125 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408248.7188 59281.1914 391159.875 2450075.25 487924.2188 74410.5234 133645.2969 198827.6719 40272328 320320.8125 1234810.875 202739.9063 834230.375 55264.8125 43463.5898 302075.0625 130174.1016 316170.875 218605.0469 333769.125 112701112 191394.8906 1310277.5 33266656 1488902.25 12774953 88436.1484 3081314.5 484129.75 701402.375 109563.5078 2416190.5 491038.9688 190248.1563 69890.4063 2596547.75 280656.25 272913.3125 1926770 1453935.5 505517.9688 112731.8906 818610.9375 1356155.75 266418864 685775 130571.1094 60702.1133 49401400 30680942 638396 103294.7734 9493249 64158.8086 97981200 1172311 735121.625 46014.0117 25849580 4156800.25 303466.3125 157145.875 308947.6875 3565911.75 543905 6694085.5 3143922.5 517472 294710048 430690.6563 13081011 34734.5 77853192 2776883.25 324758688 250016.1094 71498.9922 21864200 639700416 130549.25 530087904 93634.0469 2214768.5 36039468 256910.4375 2635460.5 358612.5625 541128.6875 205036.7656 1791596.5 102820.625 570297.5 62225.7188 433095.25 138080.25 2494161.75 192092.1094 33036.8164 86044832 7533728.5 105868216 8876802 174851.5 6035513 200668880 432191.7188 801335.5625 405851.75 27275.4082 4765402 130042.0859 4054336 49256.6445 3397925.5 21675296 55464.7617 8392986 799892 eicosapentaenoate (EPA; 20:5n3) 8484513 21490670 81492896 11552577 10578978 15717940 7090602 9517218 7963926.5 31605686 35936424 21273992 8356859.5 19784718 17766790 11221760 15099690 8884783 43292880 6130499.5 20672526 24359854 38890516 6770559 13910939 14307269 54119620 14107399 22849544 17607466 19610308 14597270 27513240 11223244 26173264 4308553.5 15158466 25821646 19432864 10167386 7881669.5 15347039 11837897 5441987 17249484 15969261 21782944 30483382 17015108 8433847 18140348 19433494 10996615 20544302 7526121 4004707.75 7316300.5 26925282 19860104 2834755.25 10472110 16960132 5961350 3865187 4267971 11446905 13575089 8775042 7792157.5 6929734 11107010 24468586 7465815.5 2669610.5 8600398 17454740 22875478 10274809 2815412.25 4124744.25 18733782 5281791.5 5178570.5 8878779 2859336.75 10709545 8296378.5 8817791 6603149 24607190 34849524 43163856 3003488.75 30862750 10421908 12620135 20350670 14362238 13461834 5915479.5 7606709 12678289 7563653 18011542 30067818 7644775.5 31703404 16779242 8948103 26698172 77534808 13641238 18891022 45139788 19619538 8277539.5 18019958 5928797 12801167 23069486 3621100 9072733 8981836 35918436 14190820 7354261 6387329 9155002 23170348 27068830 7112281 8433809 19398056 8048708 8500449 4328364 9943924 13250013 8418438 15547464 9276676 17237334 26083622 26822820 19456102 2801439.75 13104897 12158464 6521990.5 9855865 8558761 4702669.5 42896444 7134403 10996409 21546852 6744335.5 28043180 6707705 5249201 7760831.5 10693059 15025058 27840012 6398929 15619345 7563785.5 16145855 7731829.5 18088664 17061640 12000301 8164359.5 29467054 12487548 11221760 33633968 12105146 14777528 3410500 8508512 4498799.5 4795446 3332681.25 32070290 19655680 6874290.5 10013029 6204565 14017261 9628370 5392027.5 8834429 6444087 17162152 11924135 5672932.5 7605790 9455760 3544895 11061646 9696594 1820907.625 22939122 4884593.5 12783205 15428681 5589841.5 3387707.25 11299129 2226029.5 87994808 15406246 5635330 2409730.25 24087718 15141245 14647160 15559376 10394344 3264471 15749817 9469034 2800835.75 24570610 58067916 51186436 4152562.5 4188574.75 2304172.5 3214333.75 11221760 17455438 10075909 5623061 23695806 24085852 18374956 7317983.5 10201794 8976377 22115468 13076637 11799381 12120299 22236590 7812219 3288224.25 14774399 46105360 28036724 10430978 5330607.5 20859572 11869355 3082803.5 8227037 7549162 9930540 5051683.5 2172675.75 9895394 14837295 5191248.5 11549125 8630826 24710870 12406326 20652024 8429931 7649241 31043144 4779449.5 27502748 11221760 17269822 13543663 6351538 14224676 6117422 16586370 6202751.5 5193986 5358739 23418946 8976346 3757590.5 11710112 14425536 11349779 36837580 4544615 3297504.5 10918337 10649821 8103207 11806889 14295791 9561144 1198273.5 tricarballylate 13547.3477 36957.5664 29130.2363 17503.8555 71755.4922 31860.8789 37995.5156 38253.5234 24420.9766 36538.8359 55678.707 98693.9453 61920.1836 38090.8477 50832.3906 59754.8086 77471.6406 59555.7031 57554.832 36886.4648 45932.5 61915.0742 28124.5645 43056.4531 31629.9414 62022.9258 25860.3457 71620.4141 70960.7578 56769.9023 32337.6875 18308.1875 47510.2734 34626.4531 67168.1016 44767.1172 533747 69236.3359 102317.0313 87365.3281 33249.0391 76452.0625 44083.6328 52429.5156 32773.6289 34041.6719 45661.2773 81749.2422 51973.5625 46332.9414 33494.3555 18101.0801 35475.5078 79365.4219 109803.4609 26701.5879 79591.2813 49097.4219 77740.4063 128437.4766 40815.8281 51435.5547 51084.4961 73063.2891 55713.3906 71235.25 64869.6758 61250.8125 62687.1914 65573.4844 52994.5938 46169.6797 55357.2578 63434.9844 68621.3438 153585.9375 58437.2656 48530.6523 71826.5469 58373.8242 128418.8594 118542.7031 63015.4102 40130.6289 99775.0313 446734.0938 55226.1406 31706.9199 50302.0156 47628.0547 134054.4063 85350.3359 121083.0078 86944.8984 1429317.875 62017.8164 283573.0625 40624.3047 133722.4688 52649.4727 45892.0234 67222.2422 156281.2188 31298.4707 54905.2383 56338.3359 67792.2031 68968.2188 45710.4219 45955.4727 368085.75 67599.6563 87367.6875 48598.5039 88599.5 187882.7188 89887.1094 44124.168 91097.0313 61969 55778.2266 46196.1484 65527.6836 37560.3516 192978.4219 33098.0508 384844.2813 49062.3477 42252.3867 70277.6953 134759.5469 29005.5078 67688.2656 45756.3711 38975.9492 75727.8516 68763.6406 167412.3594 60926.4492 430723.1563 169544.5 88374.1484 1959754.625 59113.7383 97769.1563 47753.9609 38408.1758 63872.8867 160831.7031 42001.6172 89122.4219 79069.9375 66785 36559.3711 52173.5938 85288.0625 49205.6563 161457.875 36024.418 79601.6016 185957.3281 38476.0039 242627.8906 240437.7969 96790.6094 99453.5781 99663.4219 36964.0469 71865.0469 42635.2773 82919.6094 251174.3281 40028.3438 65990.4297 61366.4141 88785.2266 52694.3242 55674.2969 120577.1406 616443.3125 100011.8906 815704.25 77054.8359 45962.0391 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23622284 9985307 226526224 9645584 8932492 30943592 20001226 12700718 5316096.5 71877288 27995078 29207894 3888582.5 5363532 8216798 30177278 20254422 13618539 13559378 22011934 4975904 12345731 17397848 17774514 25000180 19091452 13758269 10716321 24053792 20491630 35746620 5441510 22744868 14260176 10615696 15415660 4543389.5 41194460 23252114 3-indoxyl sulfate 18881338 15220077 45989604 44641912 18765170 81432256 24634836 69214400 56583220 154841360 62715968 120853200 43691128 61003092 15012673 35085880 29546324 30802818 25955854 30902618 48422268 103926432 88522256 37423248 51811984 16093988 102423224 55690344 109707688 59255456 5545584 40163188 102384768 123123448 122591928 29476950 36529352 92685888 73381880 80680504 31598228 121005184 61319512 43022176 95799872 33398032 55374728 38743412 47286300 89709952 90363920 66548528 31193474 48582992 113921600 207871904 18987630 10804097 25367718 86164952 19710248 28536042 59662812 16431399 552611648 17298548 90411848 23504562 42298268 26843408 42481696 27136728 4360691.5 22731556 566739520 45119828 16841918 50633936 26554376 201056784 265488688 36872288 57209976 60327884 37379152 11134414 30727830 107215184 4584761.5 32876514 10266129 33570060 33277704 31814758 29378772 53039528 212204816 92494136 160485584 59777152 3652095.25 9560059 40081140 28269272 5173463 133962568 26928588 16410118 60940476 24723520 50856388 47887484 16781862 57050140 25553682 63096840 92400888 332820384 14514902 61626116 18575494 387223008 12823763 82916608 48862744 17923178 38654728 47998988 126873856 320070336 10011789 914508928 52014176 183817968 15096620 17811304 44796440 12703695 47286300 427791392 25068358 3039864.5 39013952 138779280 4740711 15347679 1888877.5 32739990 53483676 49736960 41058620 56952620 12673629 69929792 258065808 85482272 4305383.5 87374568 35733720 23617976 25999160 11061514 46054616 34501576 341650400 34077636 58896568 16489761 2327668 21253338 28600502 43014256 467472064 17867702 92628752 23455474 23216206 15818755 4718792 36729764 30089260 458889216 77916528 344087104 12951656 22263140 191908736 27115084 87258448 139442096 77525328 137787568 22736208 29553614 22400490 423726528 47286300 230996496 339822720 31913220 1225545088 35656364 8248758 117336880 597111.125 15260925 6283042 3229259 197481712 5038340.5 153929552 65222028 20860110 36775060 65869376 29764448 38870844 383620448 15325110 60688544 70142064 18275556 501038816 144239936 247079.875 16459552 63887972 171212064 174926928 73485640 63887432 158072000 13651668 178533248 491339264 117340080 29374426 219090000 679184832 50281168 38947520 179911008 24358062 178437232 87527352 35704492 373350848 131602848 70032120 809802752 37973656 76350024 1216190848 1490865280 14517451 92908528 149536544 926743232 28386132 73972056 324278816 46616428 10026737 234887936 84089432 18012896 47286300 323243808 267687440 41987248 92812584 32857746 227738736 2973036 17321042 40590176 144646144 30394680 43439164 18816086 84113376 17223018 63675260 479630560 275699840 232288256 155945728 24712934 109016256 62553364 25615102 610591168 22087042 563948032 5416807.5 83361000 64042396 7826496.5 1062477120 230258320 4-methyl-2-oxopentanoate 145604672 200860704 133093520 133211472 80021336 204751280 119488688 150789440 111553536 134942816 129158712 125536536 97615240 75045048 150940768 189235360 93495344 226353328 62664472 136600736 94854264 126970968 84568944 185014640 123797104 150148832 110393032 97429576 99979864 156859312 63501236 74148752 80922312 87920816 132571600 71970472 176203344 135495776 135154640 84425352 69056056 82886024 76393840 82234104 172697104 84575560 82345696 53888404 61969432 114196376 68630568 72548168 89116552 102057952 77082840 26018962 45631968 206875632 128488008 60505396 52234520 143251488 71034320 34212500 26629666 140732784 69419184 70610464 43944356 84568944 75870696 87820912 123552232 124828072 70974872 63024808 86787264 40619340 43010400 115084872 83798888 81970616 46815944 48648128 50789912 42805624 82660352 60802448 110077768 90421888 46297592 96245680 65310604 80368280 117396040 121177080 49787172 133201528 39612912 68046696 103845336 123706512 72190752 114342264 72250704 105647072 66118256 151288576 99993856 57674996 125540680 84682672 100781696 87093248 59129204 71883704 82292232 83852072 143480768 98768248 93532928 53367480 93734856 148936912 40591780 58763676 97853536 57285156 46637548 72406176 110042304 91825960 66657088 93653648 253255280 94610608 100894904 126606560 50182612 62750572 73067728 75394680 101084752 69493648 138513456 81824976 113419896 90418992 72742448 126859232 50374920 34045836 98794752 31764170 132835264 92876968 111413440 64670792 84568944 47091692 87663024 111144912 103251136 153687760 19079232 126654048 56614860 128565856 73794320 53687372 76342032 44881528 88965680 107212272 59257968 88077160 30989222 49214928 169122288 86013768 51084832 30777102 50069384 109650032 106613160 113989584 33832688 86357288 98464648 94489176 83573952 88751808 105392856 130288096 84370056 43486504 38342484 43222616 51182288 105621880 58010240 61987184 80202456 122089576 44435224 102615864 80706256 117525416 23448612 80189600 22300518 135916656 79880592 126924400 56252660 62101088 76390288 108546104 73145344 137274272 66539260 143579504 54293752 130041832 147173504 74524232 131570112 85098936 102630808 52272428 67067568 62485340 75826040 108933016 41866748 57814672 114117064 46818008 42699792 156666032 90781168 99467960 61653196 69160528 74055256 92190240 95577528 55759104 35211580 38831240 40658672 143010384 69862104 41771288 109655832 125982696 68725016 47355536 98085576 68674632 86081800 142185424 112755288 152270928 49841224 54340360 118937712 79477664 121673792 53526164 65951400 270076320 53017348 131189016 84568944 179306896 138232192 159306832 106379792 48925308 132380280 44825700 70768160 39198424 171544016 149219904 79708824 182810112 26098502 126566288 170946352 33109840 47059044 73407992 178910672 45862404 81721144 89562040 52934316 17019998 "1,5-anhydroglucitol (1,5-AG)" 16026958 7245562.5 82527624 18121826 146117520 29521874 114985216 57332744 216877120 22646006 252923344 17326182 300562048 195858400 57604924 78095240 278999136 34564360 275550336 322572704 215883584 47998644 9444090 634213248 382518560 450019264 111189664 175578416 88205272 35004704 198598384 124640520 17505386 165742400 99019192 219171248 155065600 127873392 319494016 41581864 42830288 20792148 201601104 192669392 75516552 144868176 124605584 129193608 6895029 59015024 124498592 152700032 11739392 62575388 57043416 2400452.25 101626360 2531756.25 2974981.75 93188376 3944154.5 1607356.25 5551392.5 6743485 32355148 1588352.875 6482565 398079840 134496032 118390624 220929760 13301071 370308608 5701235 24695764 10329625 263696896 6903682.5 9376184 17751450 10018413 16861030 8954123 12386724 79564888 6997035 3534379.75 9916440 5193541.5 4170742.25 9967777 4794419.5 4286769 10344866 6878921 21522224 93935872 242954896 7793266.5 6077443.5 215928816 8926540 36302376 8067860.5 3145978.5 142696544 4535823.5 7124046.5 6493288.5 12701310 258227616 226139904 11835438 4322648 218294064 7171727 158837504 76253760 4658400.5 24886576 132095248 35649312 270890848 27250926 88626864 4876391 3447370.5 162522848 193562160 37260224 17317852 33982340 16178266 10357827 6647511 7788025 16400899 8504627 12130744 388177088 19687672 9985021 36302376 44911756 9925996 588803008 9725201 243459232 170224800 18219200 18320132 8097597 2947804.75 165337296 212121952 9530785 3705217 2603234 6186678.5 16183352 3235229.75 2931465.75 4376471 3069130.5 200199968 5855020 36302376 3549524.75 164709552 8450223 2521509.5 40426516 62300184 106202056 6532419.5 13323481 12414473 163969840 2118409.5 19067922 4676884 234536240 114451512 36302376 15160621 88628000 185324832 3382513 317886944 60116376 3854425 49357980 1003708.188 10602416 9724550 20564168 9021971 75312128 70621840 2251717.25 56271232 7880724 3252767.5 7145428.5 279000544 3791262.25 3246969.25 85176240 90445032 5900877 3981980.25 50694328 1082095 187894688 44478960 29088634 2785296.5 23741136 12802326 34695288 241603888 6987290 38496952 12496876 190133568 30013796 219662576 151792320 102233760 424734656 362446112 180374080 446381024 155182096 171730256 210741488 66643600 62445896 79980768 95961696 21630836 154529856 189404992 35312584 32228876 143659232 72473608 12833200 49907580 27266406 128992592 456036768 83771656 37482100 13131093 68265976 6075884 19631610 4860763 83375688 71146288 54430932 155137968 40249604 145808864 14116113 159700656 206867824 170972784 5376178 15882406 4390832.5 9864555 1373208.75 59144088 3013469.75 6459673 2007049.75 146309200 3153721 73960824 82182144 64535056 2911343.5 115687744 149278320 16647679 74396200 103146496 257217632 379372064 107860184 309947072 45637856 422938784 30015116 8561742 234933328 31617762 255206496 1-stearoyl-GPI (18:0) 6954845 6252362 7416676.5 11048785 11581218 9308375 6600341 5216710 8827809 5384691.5 25950436 4404809.5 16139719 10583727 7135564 14966980 13954446 7009066.5 15145136 5468283 14941683 4502760.5 12639295 4787260.5 6509676 17170128 18230548 15094340 10610753 10944795 19902888 14176473 12157938 16838294 14508280 2689554.75 18465548 22847294 17416218 5755104.5 9336403 8482386 12642963 9605111 10678720 9993163 14453501 21688598 6948412 9633293 8907702 31250998 3972462.75 7734234 15051317 2179845.75 2176208 3969167.75 3336922 1574864.5 8867196 3571454.25 4144773 1689423.75 6799126 3787246.75 4312527.5 7365803 3796832.5 2767167 4641093.5 4303759 5907709 1455379 3479266.25 4934156 5582802.5 4063475.25 3740194.75 3842623 3719343.5 2786828 3714328 7139327.5 3277013 9710349 6479865.5 7337927 3623102.5 5855978 3757114.25 6665913.5 7944590 6182656.5 7586531.5 10685798 3972173.75 8156767 7468154.5 4067123.25 1907440.375 5079959.5 3030136.25 5121023.5 11400436 1271265.25 4687318 4569570 7190287 10225832 21058692 3866249.5 2783296.25 25804112 1559813.375 2270407 5309578 9265108 6409293.5 2954134.75 3807781.75 7363127 3552389.5 4144021.5 6273955 3342622.75 4594137.5 3164657.5 9228238 9079136 6264297 1757113.5 4089542.5 16689212 7800630 4038629 5573438 4397850.5 4317082 7989845.5 1976954.125 9399088 9036649 6151186.5 6006515.5 2989536.5 4859621.5 5432982.5 2850079 3285406.25 5223068 6911977 3300358.5 3242916.5 7873126.5 2114100.75 11714323 7450404.5 3193216.25 2420352.75 2793356 1924418.875 2971978.75 5977033 2638597.25 4656053 3005026.5 2712114.75 3677722 6912937 5480656.5 4594206 3096040.75 6629924.5 8850314 5267494.5 10780792 4726239.5 3494591 2292439 3386090.5 1722654.375 5544196.5 1787520.625 6890201 6386844.5 1850273.25 3733166.25 6374871.5 1655511.125 2048657 1542502.625 1290227.375 4488391 5670512 5344910.5 2202621.5 2889524 951081.5625 2246578 1755205.5 4827815 7150003 6967129.5 7259661 4364052.5 4934156 2749107.75 4048859.5 6551662 7155045 18236034 3724346.25 2323682.5 1838002.375 7526183 2131409.5 6273577 4560910 8145477.5 5320260.5 5392757.5 3662081.25 3390713.5 2684887.5 3825117.25 5406993.5 1459434.25 1198669.625 6728603.5 1567092.875 5105818.5 2539933.5 10063561 2484493 4934156 4040746.75 10531474 2878102 7658878.5 4201505 3599184.75 3858328.25 5945378 2474686.25 3513982 5075250 4237174.5 5599617.5 2075073.125 7335030.5 4612521 2080407.125 3299496 4076140.25 2756920.75 5972315.5 6394794.5 7499913 3103248.25 2390225.5 8395307 4162581.25 8306965 2980603.25 2682481.5 1465864.5 3406047.75 15050488 3415722.5 1312001.375 11727002 8359064 5993999 3871099.75 3845798.75 3090143 9841533 3766367.5 2743641.5 8031865.5 2374721.75 2541131.75 1731701 5007617.5 5679559 4002506.5 4860694.5 14089279 3038264.5 2839255.5 5662689 1674768.5 4481598.5 6687656 4274054 5943483 4934156 5637584 1104913.125 docosahexaenoate (DHA; 22:6n3) 95260200 486212864 356031200 150879152 142020640 210324464 57188672 75517648 79800480 190914304 270530112 223652944 101746768 116655952 53533508 165715600 142933696 107254608 332064416 51784328 250551600 167654800 179137120 62892204 122131288 250208224 601146624 205687696 240237472 155031312 116675032 106998344 238925936 129674592 214166448 81233432 139152368 276757728 191774496 73268992 82672448 207460912 130104112 38392736 237018656 78799152 229852848 217453520 195262960 48478424 184782736 370052096 108233336 179043952 73084328 34188620 25741582 208124816 120103272 31212218 115758752 149136672 43560268 17456034 34434624 73887200 111969288 54540328 80211472 62043260 90761112 111149112 87798936 21863226 84985328 100834904 130060960 97613144 51847536 35662564 104315752 61696476 67286408 97884808 14395534 112303880 54940304 66552956 127412328 191762208 168406384 174929328 23974976 150753152 172398912 357830368 128797160 190305616 114112568 50547196 39786408 140073712 70772384 159917072 410145696 28866318 207505712 170504592 86751504 117834992 592733760 153404160 147908464 454583936 96632936 60659064 123065576 31839484 130795328 122274512 22516168 82444632 58650124 283448704 125012728 69734600 70154088 66123656 321260128 162071168 75971032 91613040 132014504 93250056 83250096 55277156 92552880 110654360 58780236 69955072 52481220 139137456 215269008 285960480 186970416 13141310 106292680 122459648 51399700 102008624 100926200 36460820 254346064 48821588 94602256 122226464 125942856 251499664 102280768 38109488 70683544 93345296 151047312 192926096 29905720 207866368 119781312 135514704 89845240 106214128 100877328 138209968 65431492 281849216 54095580 100541896 264101632 133700736 131921568 40624104 146169264 35176528 60178572 17719976 172044560 150744192 31774424 95961160 58819644 91679912 88308920 46750288 49805112 104024272 162199440 61273064 56499548 129150664 57284536 59381448 111656936 101746768 31278544 154821520 49262388 78342200 111323080 89540768 37716128 111086648 17098558 429669440 137098256 55780152 32799902 246524928 143302528 68375296 189989488 81941472 14036291 168972544 69579408 17755306 114941320 432929120 280028960 28868508 29004608 21373376 19761594 12359895 173436784 172628464 101746768 168134752 210801792 244109792 36673824 128787128 58673368 216455872 81115408 135908960 116616704 283557664 72798864 23473558 97677344 421551136 104129928 87640856 101746768 140501552 134289056 32696170 59597348 65685716 100237648 45471600 13301192 79203272 71165016 55653548 103642384 81244640 189454992 125256424 200221152 47359932 59336444 272399936 116436224 255356640 92398392 127276384 90963456 95021240 87807752 74688432 188719600 52603456 50978896 36937616 250884960 92192904 84191016 119213496 72366864 86748120 194857968 20127524 39617812 81970744 103823936 71828392 96117568 92994496 107204648 13593406 alpha-hydroxyisocaproate 1800076.75 1616275 1165085.25 823466.8125 666952.25 1986598.75 829784.375 1530753.625 1219318.5 890209 934172.4375 1003060.75 1237354 634735.875 2042268.75 2285698.75 1183922.75 1529980.875 915811.125 1502401.125 973574.375 995156.5 1109088.125 1545116.375 1642998.375 1288483 996686.25 3111670 355930.3125 1568760.125 716820.6875 876121.375 1299475.75 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25827064 6614545.5 33817956 28040648 52246976 90996480 16533688 55139708 66911924 43535328 34186044 66257532 23165514 7133692 13397911 44772520 28285232 29613202 43217304 44941180 23471342 1154397.375 26902110 29561358 19417046 15163144 118621048 5710196.5 32013760 18451792 40364188 23021148 30187644 50766520 6767620.5 9908400 58097288 49925272 16474434 7737750.5 60689472 14266507 12053666 1705757.5 21633144 57888176 23834390 60983148 47477292 30318406 23052774 39544908 28283186 200304320 2086862.125 16408174 52435752 57825368 27179096 1779297.125 31518274 32477472 9452299 141837424 20414564 12415867 15370455 20090156 28590130 24515306 38859040 13278173 60985104 12265587 39120892 5483881.5 81838480 532230 25025532 19992512 195524.9688 17202584 51950312 26886774 28108202 18947398 36135360 56371180 6159539 15447607 488183.9688 9847173 13435086 18914734 32189944 4487198 7433544 28908918 42281404 25274122 66006508 156318896 2801783.75 50394708 62734168 51352532 17233746 5619143.5 88258376 63671616 11937068 72922920 43575884 10311431 4746957 20446656 116057000 7612208 62403944 25025532 35223808 27253000 16458700 25567406 19680214 58215576 20589628 77748824 259321.9531 34272372 5774242.5 19221174 71097336 62739048 32841180 66833272 62780272 19738384 32562594 2353332.5 65829940 16577011 46435400 16307151 7629798 20968398 2146203.25 52233688 16197922 27284978 34026384 9593133 21147018 25025532 9943686 40630376 14135951 49493136 19233264 40148164 75107520 5489170.5 42255952 9536570 5273181.5 20718716 45236324 24379222 48295664 21272782 3593429.75 7044103.5 26849942 42990712 58378636 41032936 59460344 47590064 24217788 8402329 25025532 24035286 64443668 2529254.75 13927076 46478264 21598184 88359168 9226516 27169290 31070454 16839168 972822.6875 37061780 45002008 17342644 208920432 6780739 6816370.5 12475227 80120608 33166498 72004888 4828394 3295223.75 13912279 2049315.875 11339145 50297768 7117587.5 62560448 54420348 14165289 26779316 28226934 29450796 12304963 551361.9375 26397194 2151532 27656126 42891728 19334216 19765570 3231512.75 12493836 648523.0625 6232634.5 16157707 36931968 107683336 2276348.5 18448946 12841360 568056.3125 17644402 4006817.75 55081024 104007760 1977840.875 9516182 43777388 22022282 1649589.375 3955420.25 2712685.75 16895698 10939086 31241622 3351991 13266983 14845919 35837148 16873014 21990154 47990028 8872401 14678912 8425753 8181889 4279777 27029914 28011066 563846.75 38791064 21009090 1879827.375 6305989 29888666 17025202 3196198 45561636 8556111 46332604 8864927 1-palmitoylglycerol (16:0) 54251332 45400188 29685936 151240576 126699984 44468320 71729008 21091746 66002052 50612540 236835056 42125368 66689128 54861128 78046808 19068052 55129708 31827662 108689696 22681048 50769756 30536654 42466532 48647828 41073804 85358112 57767120 72181984 62032580 69223824 93753304 67227128 57433004 75269728 62764856 46941204 55888808 87596144 40222916 22629912 70926752 80639312 30416072 24489850 66179256 120356152 84002704 110710416 84743456 87625592 29512672 48704148 74097288 25500980 29913890 22017860 98721040 94289008 26842506 92546992 29239740 25006842 22725822 74130168 62736048 23512716 46600276 51043152 62477212 94353592 53440896 60199312 58629852 32584632 67089880 50777956 25775910 96088528 46769956 28679628 38483436 28275796 43781908 53002540 17123404 50670564 42345448 37942160 27088898 30196354 28359094 53375240 29186662 66265176 22037986 61437532 75029512 39214960 66090956 18795118 26738396 28654742 22968408 38879416 52905512 28054586 37387432 24091228 27878712 45623124 93493712 14910540 40394784 100035768 47959512 30899496 28027686 72921944 36120444 30027756 74669536 50716852 50754612 79287760 61453428 45516404 33893864 31535070 47574956 120504728 86849832 30899076 19746298 59734256 44362148 15454629 113350040 128741912 50448532 21017942 16947614 82957512 31491558 83605536 47052164 13032948 18745390 30725988 58412160 50234656 57907140 47908292 25072434 38057608 32950396 40985100 24417172 45865188 34878900 22368014 35488608 25681582 51776936 27613400 35304176 77398096 90484112 86383232 32682194 41007452 63055332 53700796 31358334 26690574 29145138 58657320 72143032 60753824 54724028 30539634 53948952 26288194 40495788 54115384 39619004 61016512 29056666 27509832 30747546 24204878 32873890 35062384 37326328 50061900 88088264 52387900 68545776 36820416 57141908 52191448 45624952 50298008 33357824 60253556 48692464 100304800 103198848 22075048 102355776 24453054 75421880 131418496 23927688 47052164 22609946 85884104 25115380 54053812 59398556 88714208 24841380 47158400 42689196 44364704 42774136 62068832 25637802 56029648 56910988 51626000 25954722 64891392 13228433 22681912 58002728 37337004 37059864 37505304 22704452 58632512 46119624 29923342 47052164 45901364 95436848 28797374 27493746 24280676 53140136 297027424 15330103 47450820 95479952 52791652 46497500 41622616 339176672 52969172 70439256 91102504 81723560 21566356 47879276 100502432 43749784 55675428 43780196 50628464 72668008 33035418 11365436 60268964 72767608 192920896 22364320 25793290 29681518 25378290 23401224 24192438 38167836 113919400 127720800 50190796 25939160 24983622 74980488 64186836 53499936 56171612 30202092 70481888 47052164 27742880 89704976 17067078 13187897 28663834 72881328 18863546 tartronate (hydroxymalonate) 309795.4375 330755.625 2188525.25 2110980 4199077.5 1510704.125 716561.125 669647.375 3159746.75 369319.7188 2034383.875 2185646.5 5661395 3406943.25 2699210.75 3378097.75 4155217 2634129.25 1681518.25 2570525.75 3572984.25 3806559.75 2495238 1786049.75 1088966 4795170 760540.6875 3094160.5 2120230.5 735389.375 6826820.5 11364015 3432611.25 3101598 4705637 1425608.75 3323276.5 3958745 5507108 2761790.5 4088404 2857984 3116791.25 1144924.75 6081153 2771074.75 2826461.5 4961240.5 3006818.25 971585.75 387232.2813 342686.75 945876.5 293251.5313 970368.0625 1545697.125 885579.1875 399798.2813 243303.6406 408702.6563 450157.2188 313592.4375 403812.3438 470298.4688 396857.5625 368237.25 543408.875 568061.3125 369448.0938 394552.6875 256177.6406 646233.625 369979.7813 273720.9688 1140736.25 202115.5313 423373.2188 483968.7188 161413.2656 268379.3125 1848046.125 364638.1563 4678739.5 762603.125 802333.0625 731184.5625 204385.9219 1373223.25 1117285 1206768.125 769884.625 516033.9063 364215.6563 611657.5625 871287.75 304993.9063 337758.4375 649248.375 299403.1875 1948288.125 1601347.625 875029.625 565891.5 930255.625 396287.5625 269914 738808.0625 1760880.5 1187872.125 336342.5625 210441.25 599234.625 652159.625 354738.4688 204533.4531 687181.125 672796.625 660903.5 409849.0313 582052.875 611491.0625 567714.5625 940990.25 651841.5 319016.7813 438345.4063 423986.375 416698.8125 1850863.5 1322601.375 573034.75 1330597.125 909357.3125 334414.9688 662570.5 392139.7188 333176.7813 383717.125 815034.1875 296602.6875 258373.7813 587003 312586.8125 288854.25 1193803.75 250699.1094 448421.9688 394778.2188 374972.7188 161030.2656 647030.75 363540.8125 445073.375 1485223 341090.7188 271307.25 496951.2813 946368.4375 392934.9375 2657301.25 524477.625 487790.125 348912.7188 476166.3438 866834 173594.4844 309975.9063 2662088 533625 1055021.25 596838.3125 628809.625 251922.8594 349719.6875 564880.6875 175748.7813 407279.5938 660903.5 953359.4375 357069.9375 442278 260554.1406 1067936.375 2279107.75 633800.5625 651170.875 1256229.5 350855.5625 1727748 1609199 801635.625 1406526 2274362.25 404997.4375 200148.2813 429706.0625 285177.5 557549.0625 666096.1875 338352.625 6812985.5 1766195.625 494260.6875 1392330.125 609278.125 721176.5 793175.75 1049985.75 492960.2188 527933.625 1821969.125 1300027.25 642858.5625 881920.25 1048754.5 1395542 1589190.25 603178.625 899580.625 352712.5625 1420088.25 397489.8438 433715.4688 1436688.75 798296.125 160377.5469 1008198.188 688006.4375 347449.7813 1361194.875 1203120.125 630123.5 1797449.25 679608.125 825031.1875 1185690.625 411522.3438 398453.0313 642198.8125 921515.375 214368.3594 280713.1875 205007.6406 1809966.75 438469.8125 1698843.75 501378.375 1055869.625 4868216.5 508341.8125 oxalate (ethanedioate) 3190420.25 5968437 14872432 15934027 27035954 12615145 5972525.5 4587606.5 13916421 5511654.5 11468072 17394414 23529520 16907778 13140587 15328262 21382054 17172192 8924277 13747665 15254557 19787686 19019634 14357664 7642460 30690308 7241905 19046168 24950792 6457500 40599424 44330400 23375814 23352856 25397476 11538638 21897800 22225890 25109316 12146987 17455542 13734094 12450723 9939678 17050248 13357660 15251688 24218902 15423342 9726152 10947082 6401226 4221103.5 7993631.5 7554658.5 3815259 5780328.5 8045156.5 6720145 12416283 5994325 4741966.5 8177577 4273801.5 13669194 5653968 12031323 4577291.5 3758912.75 3467504 8270009 5500962.5 4112824.25 3012489 19346868 5364671 6999034 5394282.5 4324741 5817021 10719459 7799670.5 8607007 6601274 5112203 4890317 4124457.25 6575834.5 4030418.25 7551360.5 3652204 14885322 14167058 10367019 8273211.5 6101602.5 20669538 10222134 8632643 5811112 5048355.5 3753965.5 6334791.5 3677195.25 4033498 5672325 4244568.5 4932175.5 5938375.5 4138329 12679486 11123856 5282427.5 7730953.5 7515847 4964952.5 9054283 18183658 5169930 4415590 14245445 27929300 7992297.5 3979590.5 8662239 7479841.5 5720002.5 5270285.5 8558253 14242974 5655601.5 15872056 6101152.5 8466064 5930040.5 6720010.5 7479841.5 5920874 6973981 14617446 5020646.5 5925772.5 8305504.5 6825665.5 9905679 10175941 6894019.5 8256011.5 7311400 4733957.5 6533470 8995439 6988862.5 8698615 9632019 10184387 4444182 6198867.5 6548648.5 4585526 4771818 5463535 6085208 4145087 15427687 4720145 5940703.5 5251947 5424660 5049183.5 4952371.5 6948852 18855286 7860477 9540534 6081089 5308820.5 7479841.5 4515931 7422799.5 5153809.5 20636218 9417363 22220632 7260108.5 5351127 7619576.5 4701178 22116592 7016616 7216763 5370184 3959653.75 6586955.5 4677861.5 34461984 5231121.5 9111843 15509645 5828060.5 30925912 3121645 9895311 4830910.5 5665834.5 3411733 3512459.25 4526238 7183957 5840690.5 7963719.5 5034408 8292723 5531145.5 6896108.5 4826667.5 9109380 23983044 5859152.5 6982028 6605425 4385914.5 21587188 12576885 4162276 10556470 10535909 13819008 10824805 13022823 6830600 7222035 5420761 6196168.5 8584018 6034677 7228808 16409051 21652970 18403828 4516823 14444664 7068649 10833880 7853567.5 7001622.5 5675046 7854135.5 9123075 19021342 5232513 7154149.5 50929148 20693050 8307810 14797845 15151550 28234036 10046581 8349793.5 9307321 3975631.5 10563061 13588577 6590860.5 4048657.25 11578556 11358529 10440037 5298867 31178352 5970444.5 7479841.5 4955098 3594295.5 9493943 10649882 7264484 10151131 4943042 5477187 7471139.5 4632765 7223882.5 9514692 7152265 9993220 7488543.5 5881862.5 6591771 6455603.5 5966892 3225696.5 27670838 4255384.5 13460429 5364570.5 8344744.5 66202620 8110033 HEPES 1858506112 1969233152 1876971648 2240823808 2421195776 1736701056 1528478848 2394868736 1909153024 1659499648 1826348032 2405646336 1797861376 1294135936 2053410176 2147874304 1937398272 2016508160 1841659392 1845911424 2082267008 2150523136 2037879296 1591422080 1401017856 2115297536 2080940672 2023807232 1948739072 1919414016 1873102208 1590808320 2471895808 2197066496 1869130752 1974870784 1906773632 1908239104 2044584192 2026829440 1674463872 1848608640 2288812288 1969474048 1765922176 2162244096 2214845184 1705155456 1747019392 1810329344 1887599104 2061120128 1668964096 2113172864 1784694912 1477790208 1813862016 2172722944 2199064576 1921558144 1968867328 1949223680 2412230656 1999241984 1897669376 2076988672 1774189440 2077333120 2674764032 2201046784 2538077440 2153744896 2001098112 2080902016 2622118144 2338243072 2222217216 2125670784 1909542272 2273928192 2085668608 2097152896 2096868864 1999241984 2138988160 1892522880 2045174528 2468650752 2058504704 2091282432 1812563456 1823016576 2300139776 1673264640 2041097216 2139831040 2001632128 2125129088 1504297728 1628204416 1779238272 1762782080 1853025408 1752192512 1558527104 1728016512 1885045248 2049297408 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1974733952 1790534144 2154734848 1351668736 1791356672 1733814400 2004615552 1694117376 1712619776 1797897856 2080293888 2907066880 1690908928 2201787904 2202671616 1686147712 1806748672 2352170752 2046603520 2213347840 1806332288 3278540544 2180125184 2221709056 1897768576 1999241984 1882130176 2146457856 1998451840 2163645184 1542425088 2548602112 1559632896 1583413760 1356498304 2506099968 3091709440 2029251072 2081610624 1735190272 2070594176 2161171712 1992259712 1682852480 1707162112 2091833984 1716284672 1878389632 1566469376 1882011520 1711294848 4-hydroxybenzoate 297053.8438 355008.1563 143750.375 159035.7969 130316.1719 326031 82675.7969 278995.5313 313863.9063 262681.3438 524520.875 263761.875 433817.9063 72723.0234 327017.4688 409078.125 105868.8516 155460.2656 1308726.375 6826195.5 111997.5 2417840.25 6071499.5 258707.7344 492691.8438 83002.8516 247325 766951.375 204947.3438 717404.5 3576950 404373.6563 111204.1797 257982.8281 122388.4844 105742.9688 677649.125 1247209.375 522356.5313 387515.2188 38173.2305 210758.3281 941684 24304.9902 109849.5313 39173.5938 322891.2813 260792.7188 363871.6875 3016605 148697.8125 971778.25 329170.7188 610570.5 242371.8125 368768.625 339454.6563 1511162 350750.6563 194342.7969 331126.0938 318850.7188 149801.7656 259473.125 448383.9063 205539.6563 694851.1875 158717.6563 220009.4688 920661 202220.1563 165582.2656 54293.3047 567972.8125 166808.4844 252213.9375 597171.4375 176782.1563 326031 687657.8125 7000319.5 149352.0469 32464.4922 1450489.375 332687.1875 212610.6563 324313.0625 849011 136063.9375 543556.25 698693.875 326031 768098.5625 285468.5938 355570.5938 138225 1613488.625 370500 329856.375 378129.1875 1291514.75 602115.8125 1383648 209601 152803.4688 533797.3125 172708.3125 5047134 719615.875 377701.5313 817110.625 179046.9375 835916.5 186305.1406 162474.6094 459055.4063 164460.5469 saccharin 1144579.25 156223.0313 3866120.5 835114.125 119374.7813 90542144 80932.1797 120107.625 204247.1563 171880.0938 120587.4141 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11066665 15868931 4188325.5 35846700 14981186 10781863 6378614.5 10131846 8843998 73164.25 29343996 6115047 11542069 9022877 6024565 10547146 8270151.5 15272442 14743090 26267194 20991850 17530132 60780004 41767708 16366130 9324828 15718188 3828039.75 19368662 41754696 12412569 8745885 3484837.5 2304053 2438320.75 13868690 67950208 25514120 52967516 8238951 28307370 37558740 10149035 15652966 47375808 45675044 3157698.5 10145993 34103724 12929015 39360432 7090311 25388562 9134394 14350422 4145382 39200184 26248630 35768312 93021152 27999798 6870449.5 5819430 26122700 16468886 34561840 611874.375 419877.2813 4066687 193221.2188 11898615 60628384 2295614 27162692 10507056 57807112 29911820 3298859.5 32504264 14155619 30980352 779361.5625 18732430 11844975 14245261 22608040 628243.8125 12499544 39585088 5974572.5 12955026 51876624 1344745.25 7088425.5 4365927.5 148863.1094 6178702 3837992.5 16050753 9948992 2526044.75 3204912.75 36019788 11250144 449124.5313 2929560.25 396270.6563 6566123.5 15396427 7509919 893803.875 4147634.5 13003517 9219095 6721621 7431862.5 591262.0625 3879266.75 3105077.75 3702562 13343955 13950256 25880878 167640.875 34773592 7962807 1026149.125 252657.6406 48149204 6351671.5 1324900.375 16842650 11171530 24830328 indolepropionate 484802.2188 835935.625 1435336.625 2812772.5 1397178.25 1824364.125 3980153.25 1219780.625 2237090 6435651.5 6023037.5 3021866 2629109.5 1215095 840668.0625 708866.3125 291220320 4371259 515768.1563 4195757.5 1791323.25 3168317.75 883917.3125 584991.5 1424401.25 1351220.75 1214096.625 1230821 7274410.5 680476.1875 5064933 2048507.375 11693450 3697634.5 638027.875 3564576 1916582 2644191.5 90947288 2020679.625 2095590.375 918680.9375 1580335.375 1753584 694909.0625 803029.8125 612313.875 176679552 546201.625 2718809.5 73041.2188 549358.5625 378720.5625 6650830.5 865724.375 1567043.375 250532.7188 500158.0938 62054.457 293993.4063 370306.625 206330.5 415590.9063 31258.502 144999.3438 499636.75 68485.1719 539326.9375 141797.0156 21796.3535 79632.5 223923.9688 134154.2969 452729.6875 151452.2969 485036 81272272 38644.3477 37631388 269767.7813 307398.125 248887.8906 84637.8438 1242064.75 212944.6719 740842.375 167125.9688 6049984 45359456 2285615.75 865903.375 104978.8516 646360.875 37592.6758 786012.0625 824362.8125 153735.2813 42439.6328 1409782.75 354207.6563 1309074.375 320953 2142205 1324769.25 1225697.75 158320.5313 2125707.5 88763.4063 817984.25 252806.7969 107732416 733856.3125 428866.6875 536957.0625 1460037 293741.8438 250204.1875 4517009 404407.5 593926.5 193174.8594 1360885.25 343074.75 2131052 726878 707273.875 101070.3359 5585558 525551.25 357168.9375 115258.3672 268740.2813 1038450.125 305580.5313 214949.8125 277374.4688 351979.5 362122.0625 755580.25 44137.8672 745642.8125 151419.4531 887746.3125 54358.3555 484347.7188 280178.6563 200533.4219 902745.875 82827.9844 262061.5 21604.8594 127169.2188 398062.4063 51574960 741836.5625 2620885.25 654991 180318.3125 196365.125 87795.3906 978665.4375 176293.0469 66383.8516 760312.6875 418026.0313 604449.8125 507199.3438 765906.25 98440.9844 198925.6875 639014.1875 232781.9063 1138378 319949.9688 715028.75 2436782.25 268017.0313 231330.0156 346996.4688 1071489.125 49802.4336 145204.5 102425.7031 107090.7891 68820.2422 768333.6875 613721.4375 593926.5 74067.9688 751880.4375 498671.4063 146733.5313 1556264 114172.1719 394107.1875 46428.1563 784478.3125 817988.5625 1011642.438 2430171.75 867041 221344.5313 1453862.125 352916.4063 2304140 4556181 121414.8906 704660.25 242079.1719 31813538 173364.6094 2108371.25 279049.2813 472969.1875 751200.8125 571866.9375 893168.1875 176843.0781 390796.9375 541492.125 310574.375 1847945.25 125096.5938 3331920.75 276543.9688 161930.9063 154786.8281 4859990 1028107.813 1810135 1338715 118624.7578 213735.6094 431491.4688 994699.8125 292199.5938 1998901.375 281054.1875 37311.6484 583403.1875 21535.8164 818087.75 188231.2813 177982.1406 186238.3281 214386.5156 2282107.25 1066125.875 1984051.375 88596.0547 1800260.875 382141.7813 769104.9375 123370.1328 638494.4375 1607818.75 295228.6875 650167.4375 437067.3125 713059.4375 4309769.5 23524.9961 1127405 161335.2656 257786.5156 52308.4766 3370999.75 1738099.375 N-(2-furoyl)glycine 1533235 4300299 1559048 185739.3281 422609 533115 762166 136617 339880 258866 163671 258951.0156 432273 338473.1875 633284.1875 763426.1875 109850.9844 344795.8438 400899.5625 389359.2188 1877004.125 200120.9844 60358.7227 339880 556848.25 1747404.75 892563.8125 107336.2734 9288423 245446.3906 367159.7813 2201701.5 171912.6875 472983 320350.5625 193573.7969 50440.2969 396223.9375 397480.4688 288659.75 75626.1641 2647359.75 36678.5391 301303.25 1334639.875 660031 120260 221371 162235 2249595 126669 81440 1267111 251782.9844 358562 6469278 102528.4453 86318.2813 107792.5156 52697.1172 125321.4609 47326.4648 298855.375 557337.9375 89200.1406 273825.6875 2667890.5 492130.2188 1201689.875 188895.8125 81978.5703 311135.5313 73650.0547 444140 549677 341286.8125 490424.3438 175244.875 473321.6875 312600.2188 172718.9844 1895079 72172.2188 3328890.25 5077407 73644.3906 4962358.5 525854.3125 689011.6875 127675 277173.7813 310637.8125 513796.1875 299043.1563 797988.5625 145663.3281 1037338.625 339880 41241.4414 145710.5313 836962.9375 1344073.875 4829295 dodecanedioate (C12) 1463339.75 2333892 546750.5 2296980.25 373102.9375 261915.3125 1463478.125 635862.75 7775688.5 9134062 1123284 4737238 1441293.125 721675.375 1495404.125 534888.5625 965151.3125 930909.75 1324612 1953178.125 6178454 4362777 1481941.75 4930306 545767.75 55795388 2037269.5 2595305.5 52954136 685883.0625 1705407.75 3073236.75 11939722 2412719 2476306 472401.4688 409453.8125 1848031.375 2865166.75 2104710.75 653518.6875 3367932.5 7913984 619961 1641585.25 922022.625 497502.8438 390275.6875 2496848 456377.5625 3843966.5 38395700 542700.75 544197.3125 2960895.75 1113721.375 201966.75 1887198.75 705917.1875 1323856.625 5936056 943793.8125 337079.4375 489997.1875 194687.6094 402487.8438 2693001.5 724628.5 426528.2188 3692325.25 1503974.625 1230465.875 549857.75 375766.0938 4688686.5 595152.1875 2020843 2704247.75 519037.75 1008026.563 975361.75 6395194.5 1085782.125 1747198.5 3018445.25 998774.8125 182922.25 744968.75 3628990 629423.625 1654560 714566.5625 546369.5 1587725 1466183.75 2739913 4242952 11642051 656562.0625 1517346.5 423939.9375 1006078.125 834341.125 699225.5625 588401.25 1640709.5 2889143.75 1019471.875 598831.5 726243.1875 1836308.5 3484886.5 1005950.438 1252373.625 973514.5625 1373442.875 5075685 1634242.75 2154434.75 1105934.875 10257844 504215.8125 395109.75 667086.625 567485.5 16563343 1041218.563 3162860.75 1038980.063 983728.4375 1539262.25 2480937 775181.5 3238690.75 984554.8125 617306.3125 1243140.5 801685.5625 496685.25 1062336.5 419970.7188 2862799.5 5198557.5 341532.1563 1369359.875 439669.125 1075027.375 1437124.25 1186422.5 897847.125 751826.6875 583106.4375 3287629.5 1952150.5 3014565 1460609.75 21440644 8757232 1465489.625 1089776.125 389853.5 227484.0781 479310.125 1370117.125 245932.6406 840291.5625 2181624 760159.125 1318548.375 262009.0156 1229830.375 990352.625 1875500.375 15951106 548787.625 714161.125 1228875.75 1430236.125 801483.3125 608153.5625 1395791.625 417741.9688 4168952.5 147664.4531 912456.75 4304494 3592983.25 716121.5625 1635164.625 2890334 1186422.5 668324.0625 826681.375 1046143.063 3260556.5 577278.1875 505224.1563 3651235.5 550539.625 209620.4063 4123400.25 2409526 1805832.125 410977.9688 355434.3438 397215.9063 304155.375 396694.5313 1186422.5 911544.5 171414.2656 976577 2079394.875 2078250.125 629185.5625 237331.6875 1912735.625 162052.1094 7271284.5 814246.5 717245.6875 771767.8125 344397 149773.5469 537299.1875 2837872.25 1830700.5 382164.8438 1150791.875 446626.8125 885760.375 530000.625 1859315.125 5642982.5 8508805 3425486.25 2784394.25 1617649.875 1511801.5 1513751.375 272860.125 3576739 1471475.375 559574.1875 1997479.375 2407931.25 2875812.75 3693326.75 919127.3125 865979.375 379553.5625 9485027 2213181.25 4704503 2233106.25 697638.125 182654.0781 1138354.25 690591.25 2381691 399857.5938 868636.0625 483596.125 1513970.375 1264343.75 2398911.75 6882956.5 1186422.5 95105760 446706.2188 509558.0938 2382083.5 3198227.5 680919.1875 3014307 882701.9375 2506550 2360367.75 2886805.75 822110.875 1265254 1766735.625 581559.0625 496230.0938 3227787.25 6455431.5 738088.875 562664.5625 1259123.625 3034354.5 1950018 1033327.125 1007668.688 2367240.25 511441.2813 1256643.5 701110.5625 825874.0625 1578932.25 2688642.25 N-acetyltyrosine 240250.2344 386648.6875 117133.2578 78326.8359 85975.5938 439461.9688 179787.75 94987.1719 90083.9453 163801.1563 199376.625 216052.9844 148265.1563 100079.5938 133567.0469 155336.7188 197150.2969 137511.9375 125933.3516 72864.1641 223439.5156 208788.75 201468.125 195843.9063 360783.125 182519 98382.9297 101009.1875 92770.2266 98492.0078 336027.6875 208676.6563 127187.4219 120389.1875 155787.125 266505.875 245840.3125 141157.875 150341.1875 116912.5469 274184.7813 246802.0938 318113.9688 668866.25 80889.2656 134641.1875 1083608.375 3728516.25 274562.1875 231343.2969 1441711.125 412036.0313 96368.125 224122.0625 114637.5703 2207762.25 1154557.5 326351.3438 1019271.438 186889.8438 830314.9375 109017.8438 572520.625 177698.875 391308.7188 680199.0625 2172582.25 153655.6094 408544.5313 123737.375 717575.1875 384380.8125 151227.625 269035.5938 246922.4063 1683847.625 567753.875 1029618.313 525975.9375 594714.0625 179768.125 409615.3125 67097.1719 692669.0625 235783.7031 151812.9844 313601.9688 111928.5547 1305575.5 236650.1563 406966.0625 1367312.625 3126911 1133742.75 1208901.875 110149.2969 228925.4219 623887.25 323180.0313 211448.6563 172838.4688 535118.5625 157021.3906 199215.1094 255265.4844 218404.2031 355222.8438 324108.0313 137923.2969 190162.6406 499239.7188 171713.2656 1034798.125 534403.8125 489788.375 2531405.5 717626.9375 116371.3594 424430.3438 1445804.5 945385.25 185104.125 764576.75 360633.8125 1689586.125 586236.25 1364388.625 171409.125 805639.0625 213523.1875 229278.625 308253.2813 113950.4375 1381378.25 351618.8125 335710.0625 2199930 633174.8125 70999.7109 100778.1484 226021.125 734123.25 211776.7031 112083.3281 517559.8125 83080.2188 610568.8125 1073108.75 147714.875 318391 713564.1875 514592.9063 83648.2891 227210.7344 401188.2188 1212359.375 343181.6875 777881.75 156648.4844 769261.0625 461823.7813 335328.9375 724022.875 1537917 345806.2188 106644.5469 241962.8594 729431.875 291243.375 88930.6484 252688.1406 339372.2813 1005685.313 255569.625 1396263.5 532950 117337.9063 529806.0625 133168.625 886696.75 686572.9375 226283.5156 568334.5 218107.3281 1405758 201700.3906 1085019.625 892026.4375 3008214 173567.9063 495396.0938 117002.4219 2007236.75 473134.625 239377.7813 661443.125 367733.6563 362397.4375 544138 1416477 1432402.375 137483.5625 134913.2969 406282.4375 342736.8125 368073.8438 7588105.5 512091.1563 297805.1875 308920.1875 176756.0469 2688803 1105974.125 131388.2031 115745.1172 183530.2656 543447.375 443476.6563 284103.125 617269.875 3009650.25 509037.0313 2512892.25 1767493.375 279373.7188 425636.5313 3238411.25 871490.75 96000.5703 158857.9531 500164.6875 499878.8438 318668.0313 244570.7344 109141.1406 713171 1022120.313 568441.8125 687691.8125 386406.25 444124.4688 328528.75 207736.0625 1809462.375 317763.25 367437.875 131103.1406 300021.5625 1429502.75 402609.5938 65979.6797 165245.7969 250377.4375 158879.1719 303590.2813 1274103 77614.6719 1267436.75 136121.0313 1933282.25 253637.8906 263221.9688 166164.0156 281935.9063 34368.3477 179022.5313 310430.6563 335153.4375 166110.6875 456802.5625 1784596 441999.0313 518790.7813 73261.625 1273959 576178.125 175846.4375 245169.9063 356939.625 486580.2188 209662.4844 192893 381569.625 296898.5938 577274.3125 "1,3-dimethylurate" 336411.375 1082377.875 569655.125 375072 595873.6875 359146.9688 673403.1875 540218.6875 115416.1406 362551.4063 438983.8438 550390.4375 648050.75 124642.6797 550732.5 121076.5469 365075.5938 675861.9375 461951.3438 254182.4375 166569.8594 126987.5156 760959.75 679159.25 2561134 134060.875 579575 683815.375 910223.5 130773.5859 372584.8438 338402.9375 544889.125 377559.1563 136707.9219 159988.6875 63291.6289 3438902 11942376 847656.75 273984.875 373561.4375 183182.5156 2638221.25 1413215 184417.2031 203314.5938 92903.6016 191834.0625 52210.9102 891868.5625 328140.75 220826.8125 399767.1563 63177.1953 529226.3125 69368.3828 407052.5625 219158.4375 33976360 57587.4492 385068.4063 406626.1563 633671.625 164125.75 58074.6602 303254.2188 132069.7031 610490.8125 114941.8359 400286.75 39418.6563 163491.1719 349857.25 4997581 26614860 906265.8125 8871115 39271.0234 448244.0938 1161559 608899.875 96260.0469 373814.4375 1357872.25 129272.8906 1432004.375 138898.6563 850495.125 149980.1406 583356.625 573040.875 2607760 48100.3711 110026.2813 204611.8125 510981.875 169804.125 376582.5625 108890.8281 1604331 3-hydroxylaurate 1364286.375 2488233.25 738533.75 987314.875 277720.0938 896697.25 387249.2188 1244572 606868.8125 2647436.25 731167.25 4130854 402816 905134.375 679911.6875 2904414.5 614857.375 1491854.375 2375063.25 212867.8281 2538423.5 2572527.25 741770.9375 1134784.25 589286.75 2774634 6168908 4062822.5 3880877.5 1317494.75 287374.1563 336274.5 2943266.25 568426.125 906285.9375 823262.4375 498728.3438 3320023.25 196207.1719 922876.5625 675140.6875 3085971 808390.625 372523.0313 3898563.5 435698.875 2538423.5 179282.7344 2078693.25 132286.8906 7580627 17848578 1275187.625 2408690.25 5745101 2787474.25 256122.3594 2303980.5 1375475.25 4516183 5488788 6182537 4522391 872140.8125 2588614 1893210.5 7631522 902329.9375 3133608.5 2214436.75 4241077.5 1385373.875 1904796.125 1245384.125 2054582.75 3131374.5 2246232.75 4415015 2493158.5 3143244.5 2684318.5 7669915.5 5342196 4868183.5 683853.25 3184820 2193590.75 2537948.75 4025795.5 1321490.375 6086737 2079572.375 3684116.25 3796547 4911867.5 4004710 6947739.5 5472071.5 2506654.25 1211698.25 2644813.75 3592424.25 2334033.25 4076770 2299800 1209605.25 3784714.5 3413198 1072535.75 4339130.5 1139455.875 2272795.75 2825438 7081444.5 2594259 2434718.75 2546817.75 2811124.25 11195504 1951063 7542138.5 3230395.75 537000.4375 4234316.5 2425818.25 3943691.25 2474634.75 1952187.75 1411072.25 7060672.5 3986849 1447476.125 3241566.75 4393606 2745463.5 2936998.75 2423457 1591377.875 1692970.5 2678510.25 1440157.25 5731518.5 10769145 2109083.75 1436314.5 155192.9375 2698733 2052975.375 2930189.25 3719132.75 2895735.25 2720862.75 2978688 5801874 7492394 1663918.625 8642662 5149713 3991673 1212433.5 1894919.75 1847574 2424767.75 2739767 1732881.5 4288453 8579039 3782046.5 6083956 2389239 5775939.5 2875925 7707432 6972308.5 366093.625 1615533.375 4898179.5 3502043.75 1720221.75 2338858.25 6795402 1299848 1355203.25 1070644.25 4702172 2230945.75 1413763.75 2158298.5 4366158 4651208.5 2730840.75 1420157.375 1707611.875 3113369.5 5406824 741324.5625 1779241.875 6903387 1666315.25 2091457.5 2833191 2102656 5992863.5 4453948.5 654055.4375 1985013 2305440.25 3902309.75 1253743.375 5121456 1185754.5 3402880.5 4836550 2747789.25 1300437.75 1937254.125 3683920 2922962.75 9219698 2538423.5 211243.3594 3367929.75 2292702.5 1698730.75 2574707.25 4521915 3772536 742704.25 1167644.125 1289837.125 660606.625 1766975.125 4540074 6320648 7803422 2335246.25 5024583 9608688 1954096.375 2193868.75 764524.375 3298125.5 4225283.5 1328298.875 1559334.25 3262632.5 4887905 8581198 1667850.375 506045.1875 906908.1875 5621195.5 832172.375 2364113 3079861 3752097.5 403812.5938 761735 596577.75 2415089.5 2995388 3696308 1402338.625 7882914.5 3278403 2645714 3065049.75 1257389.875 11867526 1866186.125 2601660.5 2833379.25 6875468.5 4160338 4246125 2373964.25 2370904.5 1320025.125 1717828.5 6435286.5 1135869.125 1327926.125 1558557.125 1683342.625 2884883.25 3736188.5 5773256 5674331.5 5973464 5372424 3982393.5 144401.2031 4056222.75 797094.5 3298776 2538423.5 4959553 3927407 1570527.125 2674698 pyridoxate 2468193.5 5233368 5907745.5 2511599.75 1951611.875 10588809 2787139 5549213 2247612.25 19736554 5479263.5 3305612 19302014 2576825.25 1937796.125 4688408.5 4453565.5 3086580.5 3913283.5 3738466 3552673.5 3683382.25 5406913.5 3599311.25 4388306 47773584 20000658 3665781.75 5821656 79114528 5007657.5 3260162.75 5266569 6507506 2279246 1289220 3070019.25 6509773.5 5406913.5 4335288 3737523.25 6326802.5 7574484 3951651.75 9850151 6499963 3167226.5 2285956 6562963 4098650 33308332 5580458.5 6673321.5 6023789.5 25924216 3983257.5 4339964.5 2544228.75 1798844.125 14446741 3640653.25 2798642.25 13053527 4085225.75 180496272 1910053.625 41553256 2839742.25 3019686.5 6177847 9999070 3325308.5 3825019 2031317.5 65118708 5328358 3148780 4148688.75 21222722 46271616 29021488 12877290 23513382 5843423 3825907.5 7297528.5 2062945.25 18105520 4408884.5 13878562 1353075.875 1801179.125 12748355 8890741 9905576 4706899.5 641344448 9983280 13569016 3357671.25 1652342.375 2303905.75 3427943.25 3173954.75 1346512 23571052 31938494 5315893 2193457.75 1179755.5 2642496.5 12052927 7801902 8794218 5406913.5 4462321 3194842.75 47537176 6418577.5 4521363 5937652 68290944 4011260.75 3559992.75 11456591 3495768.5 6773477 4766726.5 45336596 52924752 5526669 36113260 2442904.5 25155382 2298382.5 2511072 13772859 2886879.75 9009547 111867576 6198612 10516011 10734645 6979730.5 2409664.5 2237322.75 2994084.75 2610695.75 3811455 5026073.5 2628654.25 5440126.5 2152758.5 15667097 28477112 2150973.75 1734514.875 6063540.5 6000425 2063153.125 2874955.5 3266155 10585229 2376938.75 18802288 2653485.25 5406913.5 5197541 1956720 6356626.5 3840143.75 2450551 110509128 4170488.75 7387003.5 2837774.25 4834244.5 3042433.25 2219834.5 9186953 49839276 29597452 7058793.5 12743959 6013456.5 2445412.5 7941593.5 4138894.25 15708736 6307250 5791876 3964334.75 2398229 13886022 14036013 154926816 5029351.5 31453502 44019072 3495977.5 123777408 1667530.875 16900014 7409332.5 4611253 2584703.5 3356924.5 3525947.5 47376600 8545598 14890723 1437697.875 3753939.5 12330927 8983329 3256488.75 3005872.25 36439776 3304125 8541408 8795005 1407390 110149720 19366620 4386363.5 1869649 3735643.75 7427474.5 41745096 1375329 10853064 37650936 5262377.5 8638109 29847944 9530568 2789560.75 125472520 102848368 2657487.25 3597393.25 3629416.75 15875959 4222340 4148191.5 4419666.5 7293907 52026928 17347220 24235892 1785066.875 39117028 17358894 93311544 3278167.5 9449585 14983258 354083072 2270274.75 11398835 24557064 3086761.5 3510365 27757316 33976592 2292454.25 719156.625 9267843 101581008 5313640.5 124046408 2143267.25 90884512 4885184 3164287.25 5744222.5 7965581.5 3209333.25 3234344.25 1893352.25 6765143.5 5755823.5 2577451.75 90723720 2200936.25 17556962 13649051 6165153 6229323 3413079.25 3564838.5 17969778 7647343 16981516 1010897.875 4352690 8553518 3287945.25 1371862144 5559117.5 5-hydroxyhexanoate 305616.3438 339540.4063 165824.7344 176203.9531 636028.6875 73900.0313 382517.3125 227646.1094 446329.3438 116160.0859 260835.5313 191146.1406 303830.7188 366902.5625 291941.5938 576979.625 319415.4688 411397.0313 554837 375736.3125 1067986.875 293328.0938 248320.4531 419541.0625 381454.5938 377942.0313 547890.3125 284449.0938 362541.0625 234714.6875 225383.2656 693162.5 351928.125 353879.2188 446969.8125 1439387.25 8024646 872562.8125 3642861.25 610463.625 102337.1797 501593.6875 753145.625 903201.4375 378986.0938 935854.375 1209643.875 563154 810108.4375 783331.3125 157531.4844 789226.8125 287198.8438 687527.5 1736432.375 696567.625 1063704.125 548384.3125 559427.75 914326.875 2086477.375 956343.8125 954718.125 427612.125 1174190 541708.8125 430873.0938 157599.1719 783653.625 352031.0625 552718.875 200376.9688 1742262 8111399.5 1138450.75 2285153.25 128071.2031 452738.75 553263.3125 406941.2188 307933.625 203471.0781 302291.7813 459360.8125 373771.8125 447046.3438 970448.0625 1098540.125 528387.5 196367.5156 438585.9375 583282.3125 738989.8125 2175156.5 454515.125 901267.8125 2423407.75 1047809.25 243638.2031 2094215.875 4005106.25 1638424 445962.25 1139465.25 542167.4375 1212462.375 645623.1875 1843044.125 549328.375 905698.3125 367088.7813 294404.8125 1485690.875 376810.2188 922732.625 1510985.25 451072.2813 949862.25 3002703.5 1155138.375 200615.6406 282716.625 464449.4063 599912.625 646303.375 550344.5 1279871.625 476187.3438 2499801.5 1245092.875 685615.4375 1617915.5 1125493.125 408503.4063 270400.8438 264457.5313 689867.875 942464.5625 970035.75 970719.5 815713.9375 216518.25 497737.7813 777582.5 4063891.5 1522099 127473.8359 290835.4063 1161853.875 847720.1875 216642.2188 563154 809551.6875 392612.3125 445808.9375 1318869.125 258433.25 450494.4063 377569.625 397839.6563 1416004.5 848382.0625 604793 170081.7656 974856 2196953.5 1623303.875 218381.0156 1054969.5 1233405.25 414077.75 976765.8125 2394109.25 805668.125 413288.3438 467537.4688 1420008.75 403022.375 1906418.5 836037.5 254923.6719 1691863.875 2179363.5 578417.6875 133437.125 310232.0938 1134943 519552.7188 389690.625 116271.1641 1286874.875 446893.8125 535360.3125 254854.3125 337358.125 261568.7656 680791.0625 347111.9688 4874623 704952.625 2406259.75 4933053 615915.6875 1707849.75 1748795.875 2185347 436201.125 157836.2188 1315845.75 1181975.375 333892.8438 546756.3125 463434.875 913872.25 2805792.75 606190.1875 282629.6563 2153398 543459.1875 1174120.25 728685.3125 4508291.5 389539.6563 743714.5625 667813.5625 2371452.75 378814.7813 8155502.5 461128.5938 833313.8125 695724.8125 377748.875 3164269.5 190674.3125 383310.4063 2582980 471278.5625 1345746.25 617300.5625 1128342.375 432004.375 581069.1875 266926.75 508465.5 312869.2188 538621.0625 954527.5 694898.625 289936.5 4565276 776235.4375 566880.3125 1318078.625 438893.5313 468015 433562.1875 977689.3125 338398.8125 1432907.875 506019.7813 propionylglycine (C3) 153417.5781 239286.6406 243794.9219 426288.9688 284890.4063 1133863.5 110763.1719 226490.4688 188385.2813 209570.3438 630167.9375 542874.25 654883.875 983335.5625 375040.5625 427504.25 208951.2344 105089.5859 113064.0234 121070.2813 243586.1563 300422.5938 820528.25 507138.2813 868543.125 261397.9531 112020.0938 120092.6016 147918.9219 189034.1094 248733.2344 365040.125 419488.125 264014.125 285169.9375 146605.8906 410330.625 368507.8125 147226.3594 217510.4219 476860.125 279664.875 159592.5313 261935.8594 214661.0469 344517.3125 196085.7813 185537.7813 187634.4375 202875.7656 187529.0781 512526.75 935966.6875 246311.8594 378853.0313 240280.5781 182184.8906 231834.3125 215215.4219 282812.0313 176513.1875 462492.3438 376891.6875 66489.5234 607431.5 282198.5625 120065.1328 339157.1563 363599.9688 530204.6875 237615.8594 465085.8125 159969.125 558468.9375 144904.25 200062.0156 178812.2656 191597.8438 211525.1875 2830005 262322.5313 144633.1875 305799.4688 433990.9688 563081.875 203560 175777.3125 114257.0547 78209.3828 146220.4844 185922.2188 415185.8125 239545.0469 126563.1563 176005.25 77957.8359 700219.125 383725.4688 296913.3125 250677.6406 264380.0313 504468.2188 273551.625 927922.125 442523.9375 118706.5234 376071.9688 167031.8125 139790.875 182114.3906 99570.8047 196924.5938 203353.75 193179.7813 385824.7188 544710.1875 296832.8438 453794.75 162694.6563 38279.0977 164127.3438 251867.5313 288509.8125 114482.5469 382891.875 135321.3594 488412.25 239454.0313 174030.3281 271308.4375 265713.7188 739467.8125 558756.75 54584.0156 321280.4375 394932.1875 324830.9688 176157.3594 166663.4219 89673.9531 70267.8281 222032.7969 244675.5 235899.4375 315350.3125 141024.9219 232128.375 285071.375 172034.4219 199358.4063 413717.0938 662044.1875 161819.3125 309547.3438 356314.1563 173805.3594 357534.6563 300513.0625 384195.7188 143248.1719 233470.0313 168993.8594 396316.7188 123049.9922 81964.4766 273652.4375 116091.3594 257222.6094 25670.748 334009.25 436505.375 216965.7656 862732.5625 592286.1875 377144.7813 161905.2031 189856.0313 238138.9531 626555.0625 193098.8906 180973.4844 245764.8281 254979.5313 510075.2813 487922.4063 59632.5742 376303.375 341803.2813 280772.625 244675.5 141067.6406 72136.9688 281708.1563 319322.5313 151269.375 307721.5 115003.9297 191340.1406 514823.5938 19054.6504 227953.0469 440709.75 158456.5156 247491.7813 butyrylglycine (C4) 142499.9688 152084.5 97657.0156 321267.3438 76076.2578 304306.7188 152229.9531 83479.625 96390.2188 125591.1641 217653.7656 123401.6875 271241.2813 144265.8906 165042.6406 74858.3359 168285.5 208849.2813 103602.2734 280569.625 152826.5781 181648.3125 211335.5938 253873.7656 134060.4844 116254.3516 168286.8125 143604.9063 152115.2188 144190.1719 140216.625 312226.5 198043.375 49524.0391 43229.4648 327256.3438 112201.4844 254439.9375 152084.5 173846.9219 146248.9375 287899.875 167899.0469 163107.2031 85182.3828 190965.375 390458.8438 376751.8125 71829.2266 251545.9375 72929.3906 118025.4531 588206.8125 139168.7031 75874.7266 447354.125 54274.875 125886.8359 231967.6094 84449.3516 129315.0859 597058.375 167597.1719 161220.7813 122967.2188 130923.6797 194817.7969 151939.0469 146151.1406 165459.0469 112351.625 90113.6484 153974.5 108426.3594 125540.5 215076.4063 127020.0781 51032.9648 861228.75 142138.2031 161062.9688 87019.1094 364812.6563 497984.75 207570.5781 100572.375 167379.4688 41615.6523 61558.2383 88635.3047 98641.4844 119559.8828 4043998 158716.625 169046.0625 146425.9063 153728.2656 128663.8516 190724.0469 293117.0313 315513.9688 125497.9063 425672.125 125802.6953 97182.1563 125922.9609 91831.5859 191418.0781 213499.375 257025.375 619375.5625 159564.4375 157728.1563 77962.8047 123290.125 53438.7305 94176.625 100598.1563 114828.0938 70551.2578 148969.5625 330590.25 330708.3125 148293.3125 264458.375 99619.1563 112019.9297 229751.875 124650.4063 66095.2266 210303.8281 177046.8906 208452.3594 116425.1875 355226.3125 124603.6172 113102.3828 145886.1406 101125.0859 136310.3438 161741.9688 278801.1875 106868.5 179073.0156 150329.9844 399536.25 138079.0625 278261.875 159592.9844 156634.0313 615702.5 273164.6875 85566.7891 258359.5469 85968.9453 100112.5 261464.7813 330256.0938 138538.9063 335629.2188 140954.7031 166445.9219 102920.1484 110578.9844 578329 231439.2813 123653.4219 114886.4922 399011.1875 80454.9063 201603.4531 358978.1563 135030.1719 298854.9063 109710.4609 277489.9375 131090.3594 208050.2969 128033.5313 203031.9063 275507.0938 213013.5156 225614.2188 152053.7813 499483.6563 246885.5781 92070.3672 74147.9922 129216.3125 149663.8906 160799.2813 258007.9844 67309.5469 96853.9922 223509.9219 75392.1641 106591.8828 496458 120613.2422 131196.4531 773416.1875 228552.4219 246247.5 88260.9297 162469.5 117040.2422 90186.6797 112738.7188 349268.875 63789.3516 216606.2813 236388.3906 169706.3438 330966.5 45379.1602 175711 146994.9375 260774.5156 57690.8438 139386.5469 74361.6484 113458.8359 79187.1484 312789.8438 192744.6406 239175.4531 139999.3125 182869.625 107483.0625 133238.6406 424214.6875 154842.4844 430241.6563 151342.4375 1000330.625 202726.2188 2-methylbutyrylglycine (C5) 31603.9258 137213.9063 144542.5781 130938.2656 97520.4375 165631.5938 79370.1875 84808.7656 139332.0938 138342.2031 50277.5625 59945.0391 105078.5859 223564.6094 124649.6719 90241.5703 87966.5859 61017.8711 64405.8125 149245 232002.7031 260750.0781 78133.1797 248896.4219 372429.8438 128636.2734 64686.2188 1137812.5 116550.5391 194616.6875 165223.1563 149245 1072779.875 151200.5625 264210.0313 281634.9375 149244.0156 44836.293 136342.4063 438707.125 74896.1016 792174.375 206110.9219 393102.1875 80291.3828 66294.3672 714571.75 3507126.5 149245 84252.7188 31020.2891 57256.6836 370536.5625 960561 51727.3438 52974.7539 84240.3906 239104.6406 413788.8438 571797.0625 197333 65034.0625 149245 84874.6797 132372.5781 388644.1563 125037.0313 735150.5 1353651.125 173016.0469 75521.5234 428464.75 126862.2813 105538.1016 149245 139655.9375 175401.9688 99126.5313 120792.4141 28482.043 1048329.313 101366.6094 296882.7813 235099.1719 516378.4063 270453.7188 106168.4688 213922.2656 140272.2344 609504.625 111624.7109 1128545.125 286697.1875 1069179.25 660693.4375 2046426.125 238770.9375 252780.8438 159648.7656 93905.9063 140477.8906 264356.5938 127215.5703 75208.6094 424691.5 232261.9531 320577.9375 375973.2813 54249.2969 173499.8594 1337264.625 3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF) 19240364 43812240 101383160 17395138 61153596 56199648 45347776 36122716 106224568 27831304 139715728 37756536 108267472 63787240 125147232 56948068 134342448 98762032 146790400 230688384 133195096 153880096 104587640 60709448 117055616 53908660 108113472 21361964 71819344 141610288 32547716 62765624 104940248 61601280 188801488 10835211 94514768 139395248 201811632 60709448 37190356 114218352 61587820 84070992 86085968 132844200 45365084 60813156 40129540 88940008 156174640 36805248 101915456 357775168 187177856 289119232 20129002 10576278 55326284 288958304 71639920 60265288 21703474 30461706 504734816 27444618 56299336 53300112 49801076 52691836 97476552 160033056 20380292 9289735 164948272 60709448 114752088 49845092 21642350 72392720 95120184 176223008 26531612 43394980 11025541 18133648 54581524 20737574 24973840 59566824 25374406 47893964 40969600 97889224 68039448 28079778 77877184 261181808 340083488 5811842.5 77601784 22781572 64510832 42439776 6033285 52901004 121586128 15490811 32158900 41436688 54097296 280276064 215817344 50745288 45457772 87918936 180738352 9194261 42018224 130811200 9203411 257328864 65154748 101303608 361347136 396095.6563 59889928 146178368 260553680 74872008 6860763 224482304 87580952 36287312 59439764 6793431 40204780 18329476 27831240 528265920 61077624 47890480 51965636 142443552 16865328 25140530 176574464 113156944 180672224 13135940 132186312 19924222 185134384 113063568 194124864 165997088 7284202.5 67188912 35189260 24083112 37111068 61395760 52337568 62138984 328506496 69446632 47178680 25168166 32699866 25910466 13472347 16956984 112894104 218838176 72383008 32439440 39631604 26074318 21883510 35143392 15585011 1030616576 20353468 334511776 40960812 22754246 121617544 7713661 86802208 109392544 69127488 54819392 13329402 6128129.5 12114011 142948720 21554110 153149744 107285168 21668652 299406048 5707919.5 7056807 46036632 60709448 19729152 11931309 6124680 152542560 7314050.5 3139190.25 232389760 14253026 131639808 111264048 16655461 53382228 266634784 7672759.5 59195804 487582016 2106100.5 140751648 45234964 155487440 23522400 201294752 194193872 106109592 14613685 25563196 8370422 132417928 142806208 78154424 102647536 24403240 134109352 403763008 54855420 136599872 465748864 39246300 300208576 127585496 53417112 123187696 18708282 60669576 272336672 135096464 111166048 285095616 571087360 50993768 15282619 150899616 270677280 33516442 74485112 20686996 88205160 58408156 3716145.75 274572256 21739276 390973664 629612480 36981236 56134072 31250804 88081928 187060384 32340006 19872898 33844240 54066624 41684884 91616520 17099458 76765536 50111700 81564840 380911264 38567008 180791552 12875363 83938024 152147888 134145784 125195360 307329376 5011431.5 314013536 40954312 66255492 10602607 58999132 397932320 213559088 docosapentaenoate (DPA; 22:5n3) 12546622 68216072 56121004 16123188 11943675 36771400 5041866.5 10104673 7731276 21650808 24644480 31385112 6312895 14339270 5770498 12902623 11346967 10331755 33696052 4568400 26034732 20866618 17083734 8617322 12209727 24639002 90656544 24276496 23870234 16935702 13401189 6280154.5 47432224 9887735 19797050 5726371.5 9591246 45463540 18454954 5957570 6993402.5 24438418 12033970 4698767 25723270 6320577.5 29738272 13975785 18002126 5959918 48691332 70405576 15369446 30040504 14897642 8519865 4006264.5 41375944 22971026 7732748.5 31581056 42007112 12335532 3082392.5 5540352.5 18830596 23921848 4618846.5 21481156 9359185 11044793 25836712 11786255 5826585 17708212 30839034 18929546 19991556 10440939 6377226 23525280 10690082 14340891 22426720 2559408.75 22952672 7152174.5 12934375 28529526 37632920 46950216 28829404 3343994 52009016 28725508 77838192 24753840 27881852 21630124 4520681.5 7104888.5 24077692 11449085 29417918 99519664 5832031.5 50284092 31549098 11641278 28975490 133731184 24971728 41977372 126893704 18894272 10711164 16224926 6755857 23903996 30151750 3959466.25 15627059 6536915.5 78130608 29697268 8834259 14349437 14827190 51442120 42037044 13236636 14624941 21148414 17157218 10486496 10260727 16834106 17059766 10583367 15581514 8671521 27619440 36508708 47755440 33458878 1500408.75 16673156 12695610 9185698 17386730 16206719 9262818 76133768 8673992 15154220 23878186 19809906 72543640 16474172 4364410.5 15031888 23151242 22956314 48114064 7231417.5 28012750 16957880 19306080 15630175 16224926 30908506 17864084 8014802.5 68401392 4370928.5 15610984 110810960 19292214 33182184 3379208.75 31103570 7010454.5 5227930.5 4247483 43946948 24089866 5567288 27200090 4655918.5 23317524 26100150 5604900 11362029 17830858 32327846 11380642 8006051 41757128 8235804.5 9639263 23882158 18054152 6867226.5 36139996 7217565 14934381 20748510 11449747 6241156.5 25077118 1943013.5 126226992 27742966 10205048 5658946 50400056 26024156 11894571 31304520 18154898 1485378.875 39297880 21747576 2551334.75 29238562 105983016 58416484 4095491.5 4018242.5 1617246 3971061 3265303 24353976 25892636 14799549 37831048 30421896 103253840 4287915 12038044 5635425.5 30532858 20716720 17455948 12003088 59518860 9393229 3738209.25 19734800 97606952 13244706 12973107 14485944 16224926 38271032 6081770 10196495 8275868 7947348.5 7362301 2357077 14848813 7239297 12101061 17651600 12939414 29239624 14744755 42910536 8610896 15620803 39697148 14960976 47931508 18087340 27371458 16224926 14986041 12487168 12699019 26613216 11714258 6293722.5 5979495 58881060 16326665 10408162 19648026 18064842 12599893 32348228 2734409 4849426.5 13848563 13546645 21707420 17012696 16548958 12438792 1155967.875 docosadienoate (22:2n6) 1867444.25 4073640 2590992.25 1644001.125 487568.4063 2593250.75 687223.3125 1143355.5 957791.625 2918246.5 3348619.25 2464991.75 528872.625 704048.9375 472373.2813 1450712.375 452772.2813 1926327.75 3200861.5 411241.0313 3916944.25 1703178.625 1321363 2089188.375 1045283 3288129.5 6645087 2396622.5 2321933.25 1461916.625 798834.75 508655.2188 3313513 1196992.25 750710.875 1145795.125 1217808.375 4725105 670824.1875 659589.25 397730.375 2442205 636429.25 487738.6875 1536082.625 685236.5625 2813140.5 817538.125 1938000.125 578551.125 6189334 11531044 2054833.25 3631728.75 6756013 474623.125 466154.25 4614158 2675239.25 1579058 6071710.5 4009511.5 2411651.75 457849.9688 1162775.125 2166524 2579475.5 576706.9375 3725233.25 1713367.125 1625621 2806332.25 2136280.25 2484879.25 4153345.5 4487889.5 2202085.75 3187742 3515636.5 1778216.375 3570600 2373255.25 4906225.5 5184273 840858.3125 5290715.5 1072409.625 5458654 6672232 3179824.5 5278016 2398815.5 1416573.875 5281998 3829375 17671302 3390860.25 2820517 4262073 1626006.625 896634.75 6312576.5 1898127.875 4507619 9685331 653826.5 3284353 2770863.5 3227377 3084927 10798392 2698715 4407647.5 10989891 1600348.875 1392949 2295583.25 1902116.5 5859016 4222678.5 3055623 2460584.75 1329678.375 5353870 2801773 8846491 4223723.5 3476933 6433317.5 6450530.5 2601269 2122976.5 3295589.5 4328391.5 2401299 3214742.5 3710593 3088665 1736589.75 2882973.75 2425513 4092653.75 7753550 4838472.5 4527085.5 224788.0938 2536305.5 2583707.25 1198057.75 2149599 2289861.75 5243843.5 3670409.25 2412747.5 2192312 2813603 4700832.5 3209575.25 2601269 1222165.125 2791714.5 2882214.5 3017043.75 4985997 2265012.75 4199272.5 2668913.75 4405737.5 4590805.5 3557017.5 5067660 2746407.5 2039198.75 7623197.5 764662.75 2681466.5 12866993 3726764.75 4164173.5 1729342.5 7713031.5 1178917.75 1387138.125 865156 7309807.5 4256422.5 1358782.375 4882138.5 972839.75 5091773.5 3996821 2211232 1710418.75 3066640.25 5234237 1541019.75 1015828.813 6784259.5 1201563.125 3623228.25 2401760.5 2322664.75 3004634.5 8687088 1932985.875 2913262.75 4394760.5 3873478 1870019.625 6872731 1182651.625 2998706.25 3993111.25 2601269 1400424.75 5283581 3286860 1305422.25 6551406.5 3160015.75 126095.9844 5834946 4026126.5 619566.125 2591017.5 6954795 2745429.5 627917.5625 750648.6875 854148.0625 1568120.5 1203678 5795902.5 5008993 3086510 5232169.5 4930757.5 12188553 1459840.5 1670814.625 1198147 3162873.75 4010787.25 2110151.5 1671129.125 6185786.5 3060061 2312505.25 4061832.75 3070070.25 962432.6875 3621361.75 2908654 1853859 6788061.5 2373821.5 1001167.313 1009112.375 1039306.563 2248343 1807577.125 2110836 1538387.125 4873163.5 2073034.125 2328588.5 2417976 1343624.625 8543385 1382957.5 3829894.5 3095426 2586121.5 5479859.5 2766414 3335847.75 2035087.75 3104406.5 1148710.25 3344744 2750073.75 2315253 490193.6563 777890.6875 4561550.5 2609287.25 2754584.5 1773903.875 3676080.75 2467076.25 2899157.75 273770.1875 871462.5625 1493029.375 3070432 2564984.25 4030871.25 2601269 1858569.375 1150126.75 adrenate (22:4n6) 36667340 91562264 42636036 46524564 21847356 39627680 14089696 39134156 29972454 49230000 62250428 66929192 16735929 28863368 12882429 38763364 20200116 34658600 72131664 11824774 65201776 43238592 36790472 32550390 25856560 64455288 120706816 62750668 59694264 33760560 22661148 17500106 81187832 32123294 24035990 32006664 30492166 70410616 26939626 21174514 12630066 53324420 27373958 19171198 113248744 20076164 60174980 30420218 45125444 17551854 83880768 134510192 34185356 43973456 32372644 23282448 16625864 86214576 50873960 53147596 55006500 61296088 42965724 5914304.5 22813988 46876956 38226912 13925776 58547396 17123692 18602066 51414884 50729108 32633886 70799608 69063840 35623180 50458488 48619944 13940477 70658632 24723826 40593964 72325584 12019225 69285088 23161056 40006988 92347232 89989240 93726320 64180284 6336372 100984488 72305552 100338176 59764288 73533584 70344784 36547872 27705178 67215552 59543308 91139752 168285392 17916314 90169488 75499464 45075452 71953960 161145696 62420744 67408456 200914464 50325752 34751160 45868920 23406446 72746528 62804520 10807385 31274276 24784870 213315488 71983624 31830134 64305472 40937836 121959384 93700672 42041696 24386768 80110968 48833656 45594744 34891492 53471600 60777724 33509512 42098152 45125444 75484168 81512248 85158792 101354824 3448349.75 56231248 41157216 79719720 43676540 58608420 29495672 98227720 19150456 45125444 60251016 35277284 91642336 58091868 18972624 63555000 76109168 61622820 117436144 38608896 85231704 63053480 61512076 30528264 56451296 71490832 72081968 28993882 117233960 13902573 72263880 116725824 57918176 92978464 9353651 81685760 23089308 17619612 16315825 98611576 84635880 22953746 83310160 15498431 60308340 59439636 22239374 35330128 67691144 75689080 31896900 31494350 45242656 25139740 40819500 58204112 65837532 25288492 101644800 16161850 38756964 61809476 38636120 28406568 71978288 11475051 97468512 73624536 30868750 24551966 134708544 83655736 34614088 79525240 65888524 1917187.875 115243968 80480880 14743615 53123608 137900496 59684796 9202939 9590472 10409993 24520206 26239926 135682912 48738096 47831484 68307512 78716640 112923808 13482708 34545248 36108916 57017536 37445288 41394496 44053980 69485472 16536180 9226982 34579520 102769440 38584196 34232884 45789200 31520864 93138800 27112308 22591206 33225522 30379788 17377308 13518101 43073332 22345010 46277424 45125444 43420196 48658540 37750588 67291064 28126370 45377516 83872968 43986096 82184240 37631344 56287756 76275240 57511592 29781750 51279596 41180028 36106456 21367282 56755088 99193512 35439948 33071022 47538604 47857488 39749512 72942088 3995781.25 16391085 18600042 35103076 35835272 57283040 52609328 40870860 9292755 10-undecenoate (11:1n1) 3166767.75 4693331.5 26261354 2662499 3760776 4344503 1629797.625 4395402.5 3507638.25 12350482 5196434 8330890 4254796.5 1430226.75 4409492.5 2882035.25 5943509.5 3992449.75 9724998 1832120.125 13535889 16034593 2554161 5653780 1803279.75 9622277 15921622 5861450 13926948 8046630.5 2381159.5 2365013.5 30767676 3875594 9686099 1365264.125 3133824.75 7626740 2742664.25 5404530 4052019.5 7806983 2658059 4732846 10988868 2280737 3664738.25 2742994.25 2265876.25 2350920.75 17865648 48199896 6804829 38385564 19562102 6169515 1677287.625 6723995.5 12312032 17695160 9968282 21361818 5478553.5 5407336 4491187.5 5906422 12248781 2222511.75 13218618 7267895 14289826 7713972.5 12758217 8396816 6937266.5 8172851 7702435 11244937 7189732.5 3044493 8424297 15178892 15069875 12403044 18936944 7761128 3894593.25 10672201 8496980 16974026 20073712 3886912 4977861 6683490 5920380 16671923 18002310 27753266 12583678 3907236 15112774 9782316 5021082.5 4929886.5 6129187 5591734 19113888 4051633.25 8751323 7990086.5 4965497.5 15437231 9206940 6597979 7519194.5 10686018 6171419.5 3463531 37261628 49561240 14522869 3496780 3796255 20113552 4439146 8299242.5 6036355.5 9911901 6636352 19473102 6359504 6639839.5 7990086.5 12288307 7244461.5 3642484.5 8531797 8644862 6011367 17120942 6515419 16563314 23556158 19852210 8191499.5 1690688.5 14700040 8140911 11948380 6350189 10831528 8260937.5 13737811 6743339.5 15901625 11414738 4613746 15060220 12085613 3480068.75 7655180 6453346 10659149 14143970 2477166.5 31578070 4225509 21035060 11766240 11931170 7990086.5 18683836 3716545.5 16126491 2659489.25 7868502.5 13679678 7592158.5 7232046.5 4118538.75 8717684 6772453.5 3635317.25 1916220.25 8086476 7184162.5 11224256 7257932 9523352 12239271 10641477 14905439 2498418.25 9405577 23549310 3144039 4016048.5 11672820 12729050 4257408 6111809.5 3716796 3962421 22139620 2366030.25 18241242 10213478 10997794 1536072.625 20035812 1538802 26487398 5863869.5 31653912 8076522.5 9630286 6345676.5 6852789 5056464 7990086.5 2359264.25 10924488 5731314.5 3624952.25 15239978 12075430 37789704 7099413.5 1574957.375 2210240.5 10305815 1612848.625 23313900 16109640 14087052 10319684 17122710 10922124 7218825.5 15623215 11337007 17556380 15115018 26641200 3651686.5 11262002 30312592 14328931 2902543.25 1961570.25 11730906 8151974 4418312.5 4223981 18051100 13042300 918874.5625 2267461.75 3394517.75 10185207 3450983.5 15767476 8489588 21916504 15873752 17939498 16973028 16784628 29081102 3530417.25 4539406 10844303 14320703 5710260 5589171.5 4320572 10503066 16414386 7352201 35507112 18824576 5861678 9694292 6693440 11635636 8627972 6195314 33491374 7072668.5 21701368 16439533 296934.3438 5370280 3804419.75 10887795 4131467.25 10235448 6943781.5 3082666.25 5275535.5 myristoleate (14:1n5) 15791554 37593368 31399320 6315520 4889306 12595671 12229148 24239098 13858262 37862100 12047722 49799504 4134606.5 54160648 4828356.5 27325246 7019556 21712364 25942140 7646311.5 28950218 41572768 9022630 11982396 74687176 44035648 116163520 46284288 13504618 22752990 6847460.5 3982143.75 66095864 6314565 11190777 34025972 8357376 94584232 19604584 4426284 3855332.25 44758156 12507395 4320159.5 28045292 6919863.5 205334688 11858367 37396552 6695771.5 313275072 343894176 20935060 161394368 242548096 48721716 7175163.5 69847088 35865828 93102792 363403872 75573128 57921520 5351710 166139328 34124384 204649424 9051605 77628496 50389580 119892256 56167628 37326476 15108706 106484280 135660784 39699560 211321568 38243732 165188528 28469762 220878944 100283736 96238056 14656368 108192232 18187138 123033016 76583928 69598472 214404176 22547480 69325704 83930248 138785744 63669472 124875840 121659248 80006752 42189228 71864408 53809524 102856472 80108728 108565792 15524717 216311472 72841632 50741064 96500328 128628808 119366936 73156992 120904856 120656128 67077980 220722544 48741732 155781952 65011212 234634624 210489616 75805392 135002640 60129192 118542112 63349896 88705816 38267064 122703928 45031028 150313024 158149824 134243648 61074432 21096970 52008996 41421620 43439248 161420224 75121072 114031800 350142784 166738912 76758816 2122274 72710112 113952968 72666840 44599860 69098272 60651736 89037912 201971936 333506336 91657592 246330240 187010096 105155384 14061172 69583888 53080104 164123328 60964552 27032944 128967344 276731904 103978440 155624080 33725604 45302340 164226208 126772896 456403104 3869513 77084216 173478624 189133936 45096364 58997564 126255472 51444544 111218112 39866408 82201832 140708928 33766096 75770432 86012288 184145904 50648284 59477552 39880172 141226416 119311608 17788698 29648214 211931760 75189152 38475904 150565648 67095152 101648752 53718240 48714976 31139768 13837316 135885984 73857776 97828312 9594178 178060688 97318328 111806456 28082642 40084288 110044240 86360584 166519568 64474080 4205935.5 50463076 77980032 30444870 125280992 288234656 266025472 10236489 72710112 42656260 37144976 31490838 156301648 191626496 301158816 124176536 359221888 229826400 187706304 47099248 18275092 175291760 249397616 40407284 80813240 114712464 193872464 296841952 27938794 20338596 58236500 214913856 65962352 144379392 128758704 44718452 17008624 18267522 5067472.5 91187464 129704752 93884576 26518126 82744688 119208456 74033208 175319792 75416376 335061920 72710112 173043952 76371064 282036736 72710112 247693584 47445644 32889606 24357418 41248672 142714336 44851224 34555952 34956404 103510008 282516320 117717160 214306960 143531728 222664592 202908800 134765392 3400331.75 267530176 26292524 115004512 68294184 202619136 67346888 134527152 168129408 sebacate (C10-DC) 1064684.25 533558.5625 890922.625 1262149.5 1042096.813 1479186.25 1156795.75 1379888.875 1379968.625 3679723.25 1187644.75 1383644.625 936927.5625 864650.6875 894143.875 992152.125 1635306.625 920710.375 860851.5 1466771.625 1629356.875 1195669.625 1639731 1235610.625 1226318.375 4569643.5 1274083.125 652567.75 4554665 571685.6875 914389.375 581091.9375 1926618.75 1073824.25 753561.5625 1258500 858069.5 1251029.75 1062704.125 901998 692679.75 1001693.25 1205953.875 309598.125 1112458.125 1394714 707625.4375 631623.375 700470 559170.0625 3890560.75 27145546 435400.3438 505231.25 7689138 1210728 128128.9531 1048567.313 288509.9375 1652686.5 2289350.75 692460.0625 364487.7813 88569.9531 375334.7813 1945469.75 185286.2813 337685.8438 856305.0625 618613.4375 341733.4063 384227.3438 950852.5 6025924.5 687766.9375 1158256.125 2773479 791798.375 885140.0625 444504.3125 5055658 764374 1555340.25 325727.3125 969944.6875 370995.8438 2181753 370331.4375 1088268.375 235533.8438 314294.5313 1911695.125 334106.0313 1446368.125 3317087.5 15734966 852844.3125 479140.0625 232016.125 811965.9375 706192.75 845327.6875 506159.8125 666483.75 1422821.5 818777.8125 365742.5938 414053.7813 1490441.375 3948928.25 1632419.125 563819.5 205226.1406 1157721.125 3257582.5 1144879.75 2048970.25 695667.5625 1887563.875 443145.4688 209165.0469 794696.125 816179.0625 3594916.5 540455.0625 3593139.75 752393.6875 1695696.375 1138858.5 2246227.5 579732.4375 979497.1875 1339748.375 656622.75 962253.8125 1172502.75 256114.8281 2429472 161305.9531 4093586.25 2323925 416826.5625 817316.125 124280.4219 602946.8125 402668.0313 833483.3125 383208.4375 608269.0625 580336.625 2441621.75 1331463.5 4664347 1403986.75 9704177 3742032.75 889642 205069.7813 166090.4531 292614.9063 430664.3125 895066.75 400571.2188 398788.25 1925242.125 1070565.125 1667520.625 120323.0078 671520.125 673296.5625 2224276.5 7371222.5 241790.5156 454302.5625 1654417.5 1113683.125 315617.0938 240912.6094 1169652.375 283701.5 717341.0625 226848.4688 499719.4688 2205282.25 678797.8125 890639.25 1756174.875 3847547 1338207.125 719784 647986.4375 1235293.75 3461806 1888714.75 231284.1875 3346442 747920.4375 135103.7969 5353714 428296.2813 2241502.75 316009.5938 168393.4688 155027 351171.875 547961.3125 1828923 1199113.125 253132 1007451.313 1073514.625 2702270.25 541512.1875 372786.0938 657791.75 353436.2813 1753560.75 774142.1875 304226.25 1278907.125 962087.125 283688.3438 1051415.25 608553.5625 1637692 258142.7344 765571.375 198766.1406 269394.4063 534096.25 889642 3119354 8176847 902286.75 3110713 2013617.5 3798226.75 389066 189343.5938 758602.1875 951565.125 521610.1563 452565.4063 1432683.625 3707042.25 1987260 1013987.938 311014.8438 111250.0078 3535830.25 1771668.625 2275700.5 1675849.875 3025344 161659.6563 958604.1875 156517.1563 1842726.125 213710.25 418807.5313 196387.5938 700675.5625 1948946 6906703 1276374.875 18672884 318067.4063 711784.6875 795879.8125 4480730 360230.125 2775088 164373.5781 889642 933364.625 562162.75 333189.1875 341643.9688 888361.375 471602.4375 549165.625 1571682.875 4217875.5 2582310.25 586383.3125 3211948.25 2841943.25 760809.6875 482963.0625 724740.625 786227.75 414554.0938 534990.875 4864707.5 604080.4375 1485770.125 2264175.75 daidzein 116059.1797 3167637.5 150857.4844 85195.375 773655.0625 16915.0742 15554.9072 152539.7969 25145.9551 842925.9375 171303.0156 136722.7656 29618.1934 195411.5156 125008.7344 53180.1016 68903.9297 51283.7148 101544.1875 83117.5859 81257.375 136340.3594 100587.0469 92693 79300.0781 43424.5977 219271.4375 497631.9688 64470.6133 53128.543 103403.1719 956588.875 100190.625 89701.5078 121459.2969 48607.5078 76179.0156 96788.3047 119430.0625 37791.957 504744.875 81703.0547 32846.2109 83841.8203 84798.9531 I-urobilinogen 36658.5625 404883.125 30415.4492 583554.8125 31537.373 37213.4531 377903.9375 97689.1719 427526.3438 261747.875 1281555.375 148846.5469 732032.375 109118.6484 286986.4688 70376.1797 44275.6602 206570.9219 54813.7344 101695.8594 116604.5469 44426.8242 46523.457 208545.625 227193.5469 210499.4688 125316.0547 1783435.625 1364723.25 1485263 268454.5313 3271471.75 289666.75 338394.5938 170733.25 329417.6563 182994.0469 6946513.5 1707584.125 28763.1152 426658.9063 547549.875 79645.0938 496091.875 159680.2656 10289345 1470521.5 12157733 396123.25 1357236.25 512491 182447.7031 202667.8281 4661861.5 66178.6563 832015.3125 44797.6758 564100.125 166712.5938 256681.25 251326.1094 136971.9063 100233.1406 295585.3125 130395.4609 185991.3906 499870.5313 1019461 977185.875 207955.1719 1116869.5 250245.7969 143906.2031 1047449.313 87746.9609 383258.4063 771667.875 143651.7344 9590122 1595056.875 182875.3906 3768511.5 72806.1328 4345863 1876082.25 117178.8047 194001.2969 68583.6406 204280.7656 1364700.625 180190.3594 261198.3594 1382370.625 734101.3125 225197.5156 264265.9688 511573.1563 292733.4688 3028899.25 956585.9375 4065517.75 87150.1719 481822.2813 289635.0313 22418.7363 1568251 146745.2813 872996.625 189533.4219 184957.0938 469852.1875 1073678.25 3751026 155822.875 540718.25 117853.6172 136073.1719 4266840 190417.0469 584483 84688.7578 233837.9063 783998.0625 594524.6875 7111509.5 194183.7656 1566083.25 443100.2188 339984.625 6146354.5 568497.5625 392121 3794464 1463591.875 4295664 387582.875 1825974.25 308674.3125 435094.5938 1018185.875 387916.3438 1041590.313 710604.9375 763041.9375 24927.0234 200301.9063 249378.8438 5751922.5 462928.0625 169084.5313 4234004 622958.1875 60226.9258 254645.0156 9469711 77544.2578 70744.9063 3875871.25 198943.7656 681899.875 614468.6875 5809276.5 1042055.5 813129.8125 603574.4375 150996.6563 37353520 372049.25 135133.1875 5698216 87885.0938 832338.3125 7151436.5 413919.5938 167862.0469 1972985 415126.4688 709287.125 532862.4375 476738.7188 16159704 2000918.375 566245.25 822831.8125 2208089.25 176007.8438 175208 171147.9688 14720384 182070.8906 392121 585940.75 1011259 637497.9375 162457.25 242460.8125 392121 3683888.25 1306604.625 1216401 36084.1445 392121 349771.0625 243564.875 266142.3438 3713816.5 1188285.625 392121 121052.2969 stearidonate (18:4n3) 579058.8125 2571106.5 4088594.5 564419.0625 1218504 797913.625 1260442.375 841918.25 5239338.5 1141696.25 2377308 4124688.75 1007925.688 1526738.25 436043.2813 4889173.5 391349.4688 2472344 10931910 3979876 479001.375 2270556.25 1677110.125 4947927 1906008.875 3423470.75 1843338.75 834407.8125 180192.5156 4675418.5 4075109.25 1946942.5 1620137 6878650.5 807214.875 716028.0625 2366312.5 784634.0625 3876560.75 592836.25 3386225.75 463127.625 5830699.5 658451.375 2466381.75 5299682.5 519648.0938 1619930.125 1583271.375 298855.5938 2207764 905587.0625 453156.1563 2017789.375 1547246.5 698437.5625 746962.75 446549.5625 2981764.25 546598.5 1189185.125 3595682.25 1974111.625 1157530.375 1791492.625 3322381.5 3016393.75 638916.3125 885633.875 581004.6875 3527419.5 833233.5 1143687.875 1264095.125 1149484.875 1216830.625 1066704.125 2492292.25 1230969.5 932307.8125 1745988.125 1485520.5 1473450.25 2839507.25 2074948.875 689583.875 158972.3438 938484.3125 1618277.625 557864.1875 1262213.625 2452747 55758.875 5603249 946162.875 596898.125 1218555.25 4204543.5 2944825.75 2090157.375 1717853 3250192.75 954329.9375 4196810 713285.6875 3075644 1940218 2360964.5 3420453.75 1241467 1475710 1911749.125 1405283.25 557942.1875 1163078 1969226.25 2404649 679362.875 1972982.75 1848648.625 1305954.375 346192.2188 2483590 677879.5625 1286948 2614295.25 3994481.75 1598053.625 976484.4375 1082580.625 746401.1875 6910637.5 2254364.25 3524170 3504955.75 2622138 8145300 1491767.5 145736.125 381394.7813 1107980.125 883829.9375 1214997.375 326150.125 2128348.5 759836.875 1124740.625 1539908.375 584882.625 6292990.5 1156819.25 4879744.5 3398286.75 1057741.25 789131.25 652309.3125 663956.9375 1046190.25 839760.25 3205442.25 1327764.875 1459652.625 2462316.25 553392.6875 1882336.625 439327.6563 2605730.5 821543.3125 960817.0625 913505 2355298.75 3323207.25 1216656.625 690523.9375 224911.2969 608909.875 1286417.25 2888981.75 1967966.25 1623952.875 1167564.5 236958.7031 1457470.75 8140942 3892010.75 1292954.75 298578.4688 776117.125 4571788.5 4357570 1475710 4408671.5 2813257 3347792.75 791933 2963890.75 4133536.75 799443.9375 1678844.375 6359527.5 2694339 1034579.563 3008656 2760992.5 4894924 571929.6875 3093430.5 2376028.75 220727.5625 877692.75 276990.6875 1681476 914734.8125 1519158.125 2093968 1371158.75 3545115.5 1152090.875 5632812.5 507763.7188 1592522.625 2177362.25 2827892.5 2496170 2869177 1865995 898205.4375 275675.25 678583.5625 1475710 756326.75 750397 4910837 1277196.625 1299730.75 1950585.375 1715476.625 1646180.875 3796349.5 404484.1563 1775260.375 581399.4375 2314552.75 1353366.5 1118742 882272.1875 1187639.75 5-dodecenoate (12:1n7) 4255896.5 6457866.5 4655035 2507057.25 1810239.625 3324627.5 1884884.875 4771478 3394727 5430829.5 2877849.25 8392254 1086643.25 6379789 2062850.375 4950081 2824895.5 3839979 5530234.5 1749927.125 5906100.5 9577223 1429448.375 3409216.25 8899080 11799668 20186694 7150607 6645875.5 4142082.5 1285599.5 1761052.625 14875677 2383642 3548859.75 6564464 1628402.875 10876230 3086536 4333979.5 2869269.25 11560683 8250009.5 2480230.25 7161295.5 3909513.5 17454870 1942697.5 8623123 1223418.75 66545652 107355024 4526816.5 19897324 46138776 10187451 1778488.375 11467039 5645331.5 30127484 67767496 15036076 19946868 2648758.5 28950874 7948717 40827888 3097443 12380943 14081861 22156074 7667863 8604274 3544395.5 17045860 22268148 10549113 44751288 7500349 29020408 6502680 49925612 28540694 26111308 3409771.75 18544258 3049253.75 28455160 22276212 7543373.5 59932288 4490557 20330622 15985194 34049344 15791028 28881016 29882578 18427426 6375292 14312102 12701585 15816986 11392277 14954569 3754352.25 36278836 13769720 7320440 16414133 11737929 18557898 12115096 18557810 18267476 14436659 37721400 9847010 43781940 14124423 71310728 29456906 10111925 22684562 13251558 32977556 8985933 21036016 5375431 26933714 9557557 31585724 24279042 34135524 13251558 3704128.5 12450148 6186037 9556219 29512762 10558882 31318384 102935344 29208616 9510639 640533.75 10572915 21779080 20996242 16131761 12210148 14172863 15370281 47388644 82260904 13316189 61104984 35901676 18431296 3876813.25 9156209 5679495 23125302 9106164 5333775.5 27111876 66735108 17776976 29346160 5102395.5 8960675 38852340 16782514 93768976 1047227.875 8777763 29956272 40589412 8364831.5 10262175 32537828 5300221 22776238 7634228 21966992 28566436 8693035 13251558 15066089 41238152 10415546 11421456 5846814.5 26134774 33869328 6058939 6469347 43558268 12245156 6556526 25117904 9861407 27855874 12656093 6850879 12176030 6125851 35327772 14748487 27299732 3458534 27960988 20233952 24562320 7562054 7182240 20113660 16976796 40674864 15089816 1002943.188 11455213 15082515 6704566 17242520 32094514 23554474 2042916 8095086.5 7209952 6060443 12557486 41842432 53678520 92562392 22777308 50447508 52293360 15141966 14347674 4243094.5 34737896 44429944 11656546 11481287 20801052 40198580 86925584 5832510.5 2677989.25 9748444 56289220 11232520 26723502 35438672 13741505 1433591.375 3608586.5 1683257.75 18233202 32192942 26295544 4284554.5 27144008 25029616 14365139 36452484 8842183 92204320 11991172 18901664 13251558 72476792 19140450 54712584 12307270 9851899 9451283 9808671 38189440 6733186 6786197 6829686 10083974 34148876 21392282 31660168 35836704 62804920 59474092 24243128 1154606.375 70438344 5119307.5 25927384 12599477 43194756 19826776 13385195 26527626 tauro-beta-muricholate 655882.875 49163.7109 851762.0625 207651.4063 51040.0547 48623.5313 20485.4746 26521.082 58289.0469 204268.1563 1105875.375 91019.1328 24930.1641 50847.4453 136119.4688 127285.2578 412870.4688 90223.1406 894218.8125 613806.1875 11663461 313913.7813 1036398.188 143800.8438 988880.75 26851156 42819.9531 315614.5 141314.3594 369004 7894713.5 12234749 6476624 81003.0078 455021.1875 122916.4297 84597.0781 64136.6133 298423.4063 163205.7188 972726.375 5810862 489137.6875 162058.8906 912839.0625 144480.125 678147.8125 29254.1445 221568.9531 843115.5625 259100.1719 2464717 81035.1641 845209.0625 2569032.25 79094.5156 62546.0781 21166.418 286761.625 339218.625 3518510.75 743674.875 85943.25 857373.875 190209.8281 431453.9688 166528.9688 3819019.75 126008.8984 86619.1953 454345.9688 28760.4063 768856.9375 247396.2344 1945611.375 1251115.875 9044847 92303.9609 327712.5938 1627936.5 410598.4063 60404.9922 177118.9063 77790.5703 86000.6719 3601939 1012055.313 398614.375 60900.0234 1817713 1020658.313 343444.8125 177082.9844 129235.6172 1508118.75 29468328 5382380.5 27348.7422 152703.8281 541124.75 147097.4375 282610.375 385394.625 4795497 295459.2188 1116920.875 3050131 4199089.5 1222953.25 48081.9922 46124.9609 540807.5 1218035.75 100270.1172 108646.7422 352613.4063 1317027.25 349340.5313 5216651 111102.5938 88356.2266 276989.625 19118538 845052.25 314623.2813 664999.6875 859693.6875 252613.6875 4362395.5 298530.3438 30444.8281 1857483.25 46963.9648 64114.7422 268935.3438 186421.6719 1308711 603246.1875 498988.4375 1931200.875 968625.1875 2008076.125 305312.0938 125597.8047 181199.0156 205024.625 2668262 1112926.5 274672.5625 8897944 406445.0625 1045872.375 12774789 242625 4772858 538924.0625 2712403.75 706906.5 5235297.5 304651.9375 141486.2656 38213652 1896144.75 817054.625 510108.3125 30767432 33162.582 331243.0313 98167.8438 274994.375 144133.2188 195935.2969 465360.5625 3713696.75 1979632.5 100097.1563 2862598.5 1113422.375 2569621.75 1476917.125 1211792 22764378 117220.2188 89201.8672 2107338 277591.2813 433356.0313 397578.9688 198237.5313 136912.9844 296228.0313 148184.875 2369111 3452968 398789.4063 89709.5234 53153.625 394563.1875 506286.4063 548652.5 313380.375 1302303.875 120250.375 N-acetyltryptophan 512100.2188 499320.8438 316371.1563 270221.25 278967.5625 566974.5625 268499.25 230248.9844 105352.9609 196377.375 307324.1875 280010.8125 233279.8125 100967.1094 208432.8125 207614.4531 216184.6406 294185.1563 335034.4375 256800.5313 146383.2031 464955.75 440242.5938 222984.5938 390099.1563 124335.9688 329990.4375 187431.3438 119989.5234 244873.5469 287666.0938 162108.9375 209041.9688 295084.9688 292713.8438 160547.3125 208299.2344 264818.2188 302011.1563 219564.0156 189719.4531 224441 165866.7344 351853 223666.7344 252259.0781 1929181.5 175233.6406 158948.8125 211477 108015.4453 154075.2031 173517.4688 118700.0078 246812.3438 504714.375 128193.9219 269159.625 166432.375 335258.375 514495.7188 140786.375 892082.5625 159751.4375 225220.2656 102572.6016 174833.6563 155798.4844 101925.2969 97909.5625 120811.3984 288589.25 621461.625 397399.6875 198326.6406 144376.3594 98827.6484 184620.0781 571667.875 363320.4063 141001.125 129649.9297 87520.6641 238123.1563 142897.9531 208610.6719 117899.8281 65586.2656 110926.2656 168717.5313 318337.1563 194684.0938 291934.6563 537709.9375 452543.5938 668918.4375 184189.3125 142846.5469 208345.4219 628253.1875 166405.3438 251518.2031 117749.7266 305621.6875 95061.7422 252382.8281 65740.4766 113568.4688 397783.1563 410888.2813 334168.7813 115603.0703 112572.2422 82424.3984 174253.8125 259505.4688 377484.4688 272395.7188 81949.4219 155698.75 133621.4531 220182.9063 396562.8125 171598.2344 245485.3438 143674.1719 326945.375 508443.1563 402833.1563 1791783.875 114347.9766 136797.2656 117783.3594 176628.3906 316396.0625 118512.9609 2155676.5 38290.875 129632.8281 166551.6875 94007.9609 61507.9805 219335.0938 110499.625 157730.75 1210404 188714.9375 194656.5 166717.6094 117416.2891 198616.4844 215079.7188 83496.0703 157112.8906 314817.1563 124608.5547 172229.8125 250898.1094 159438.8594 244872.6094 256106.625 151331.5938 376258.6563 410859.7188 182526.4844 143533.1406 145373.0469 197277.6875 197221.2813 121403.5313 220693.4375 119929.3516 197650.9219 187414.4063 197330.3281 138611.375 828097.5 307336.25 715539.0625 197528.7031 236856.7656 136108.6563 86010.1641 895555.3125 179322.4063 199874.4219 832431.6875 206433.0156 261411.0469 113960.2422 748483.375 112123.1641 224723.9375 478125.7188 206408.5781 354929.2813 221878.0469 330389.0938 122465.9141 272732.5 432569.7188 170096.8281 109590.0234 122919.0313 189778.1719 336722.0625 113580.4141 127732.7578 167544.5 328959.8125 230799.2656 83074.875 634726.1875 158930.2188 254109.3906 242843.7344 176810.2969 651744.125 197358.5469 154089.3125 172217.7188 109243.0938 1133299.5 214699.0469 215431.0469 802062.8125 2763045.75 428957.5 573209.5625 393777.0938 169194 415790.875 1348336.125 607004.5 216611.25 269620.5625 395511.7813 331341.4688 211477 73914.4063 150703.7813 176828.1563 372864.2188 304278.9688 625102.0625 137755.4219 336856.9063 853115.25 623191.0625 298274 1760653.125 168237.8594 716326.9375 329797.7188 126172.9922 487914.9375 320084.9688 229987.9063 5309688.5 56814.5625 203219.3438 209386.8906 347814.6563 113927.2734 151303.6094 1206909.75 273389.6875 663103.75 71251.8594 59159.7109 208749.4063 321257.6563 100001.4141 244086.6406 100152.3906 642899.375 76515.8047 86341.7734 581327.875 80516.5859 130784.8984 197733.7344 137255.2188 442183.75 439051.9063 292817.7813 211477 198358.5156 1829199.125 203618.9063 342439.7813 323465.6563 50683.3242 943449.1875 298305 N-acetylphenylalanine 1099746.625 1080500 426218.875 432812.8438 478610.2813 1443898.875 336760.375 226451.0625 143232.1406 335066.5625 385468.4688 304734.3438 319183.125 130044.2813 228258.9531 264861 211610.9375 342686.4375 256144.1563 229673.2188 152112.9531 378697.75 352770.625 241692.0938 354078.0625 201397.5156 428036.8438 270966.7813 347749.125 317915.0938 374730.8125 289554.875 280646.9063 568525.4375 396655.3125 183437.7031 399580.2188 490576.7813 449949.4375 331688.4063 351300.9688 407320.0938 315523.8125 503817.4063 496587.4063 446550.9063 2302252.75 222759.0781 246513.2813 321934.8438 4954453.5 9435309 1868434.5 1271853.375 6991116 3011587 338033.6563 1044969.125 440926.0313 11589424 3395074.75 3666967 11531115 931547.3125 4437062.5 698925.1875 2173347.75 366380.1875 1390405.25 820664.125 20139130 889716.8125 4785268.5 533848.5 3588979.5 2009412.875 640927.375 749143.1875 685437.125 1903001.75 3288016 5989421 7171903 1185800 458056.8438 2764061.25 309338.3125 1337946.125 786738.75 357661.8125 680486.4375 386072.8438 5765372.5 1468392.375 1210191.125 5182462.5 23558250 4859288.5 3578586.25 420567.0625 2615549.75 3440289.75 1387132.5 589279.6875 377870.4688 4046305.75 1838023.5 661616.5 361316.1563 728658.0625 1772435.375 3858717.25 1237862.375 828416.1875 808452.375 726364.375 510521.9688 1806673.5 2348349.75 1708885.75 2847000.75 1624390.75 346003.8125 6070115 33701392 2753211.75 1666509.5 1457175.625 1708832.125 4008472.25 1462991.375 5250434.5 661026.125 3452622.25 2665144.5 614193.6875 1989288.375 1185800 350203.375 16422344 1363842.75 1233086.625 6400832 8478481 710139.8125 244712.6719 588010.9375 518260.5938 16827812 671391.125 920898.5625 1338798.25 435753.625 2398995.25 14532758 512485.0625 1310603.75 3173385.5 3917704.5 453905.2813 568695.4375 1856987.125 3795103.25 1894566.125 2996895.75 2410290.25 2218964 2386711 8073558 902045.1875 1107802.625 1399403.125 3349266.75 804092 428521.9688 677881.5625 2117109.5 1399929.375 1154335.125 2343990.25 781615.25 6806725.5 805445.6875 9427618 3179142.25 595933.75 1445982.125 681271.125 2359733.5 1950012.875 3292119.5 6287964 1185800 14743304 993993.5625 17928436 280403.2188 3468376.5 69795536 1888160.625 8716916 782727.375 3799163 1401223.5 989639.25 7891923.5 3142971 1185800 1336285.75 25879838 6290662.5 811582.4375 494925 6595571.5 3097683.25 1023929.438 389495.1563 51645956 1425307.25 2470499.75 1172015.75 2196096.75 5971414.5 2661631.5 958985.375 542493.4375 637440 7228851.5 539315.25 477584.0313 2082545.875 3810191 1573130.75 7497208 4325544 1094687.625 3219978.5 8470401 3369411 530958.375 631733.5625 2284279 2049890.375 958117.125 593406.25 527327.375 1976948 2371533.5 2180167.5 2350713.75 216810.9844 2649768.5 6951330 2126241.5 1552404.75 26470344 556853.875 5458433 506826.875 650315.125 3353156 3635696.5 949634.5625 30516778 502938.3438 647299.125 464810.9375 1480172 7547399.5 615009.1875 3368560.75 749307.8125 7365258 984602.8125 714611.6875 483822.8438 1456042 272994.4063 836244.5625 879475.625 993593.6875 641567.4375 759482.4375 2401846 12189679 2700746 2318369.5 914224.4375 5359771.5 1392338.625 629008.75 929090 847725.0625 4467417 901100.125 932909.25 972285.75 321372.2188 2802898.25 1173630.375 phenylacetylglycine 56719.2617 110590.5703 181204.0313 224212.6563 46153.6211 215345 102053.0547 56406.5781 26228.5996 38739.3164 44468.8125 88242.1406 19467.7773 121875.1484 105828.2734 108353.0625 54435.582 307027.5313 160937.5 23737.0977 63673.75 70164.3281 98460.9609 190194.1094 116837.6328 44975.0508 160937.5 65810.7422 208509.8594 58348.1523 266994.4063 565789 362625.875 60663.4219 69404.0234 1643160.875 56525.707 87122.3359 591517.4375 24145.5605 108540.4297 133324.75 316186.3438 590933.125 854697.4375 328916.0313 432446.2813 94117.9844 35073.5742 171800.8438 75711 574037.375 1724151 7478516 207589.1875 578571.0625 3620946.75 74189.8672 42017.543 9566.4961 420515.9688 104504.0078 349584.0625 117007.4141 90969.8594 229809.7813 290265.4063 145537.9844 409599.3438 39224.4648 645347.0625 100970.4063 573484.4375 195110.2188 341172.875 34771.8672 33747.7148 95995.3672 181570.5938 125693.5313 327721.9688 181503.7813 1638361.25 1705421.875 73557.0938 22560058 1994260 32677.5586 161347.125 259414.8906 57133.4258 74913.1406 191180.9844 77568.2656 13934718 122935.6484 623438.0625 41834.1094 62721.8984 262203.6563 1323267.625 58491.0977 160527.8906 911080.1875 57956.3789 284478.25 247685.125 6993027.5 3746358 80219.0078 69702.5625 456288.75 118895.8594 150074.1563 468103.0625 117327.2578 289238.6875 650349.75 193675.0469 214309.2031 73771.7891 68893.6406 494095.2813 169837.9219 359316.375 335124.7188 979758.25 256561.5 N-acetylisoleucine 781542.5625 340957.8125 222724.7188 241031.3906 320945.7813 428757.9375 395999.75 222155.5156 83296.3125 295349.4688 303059.3125 215268.7969 325757.0938 144792.0156 204839.0313 198134.3281 334186.7188 238037.0313 273300.7188 218532.1094 222831.0781 247847.8906 196322.8906 237826.9063 252337.1875 258466.6094 396749.4375 205650.8594 196970.5313 230387.4375 250483.8438 408319.7813 280613.7188 310904.6563 236724.0313 499791.9688 292207.0313 160301.6875 197389.6719 325694 226777.7344 288133.75 208995.5469 652736.9375 444809.7188 252294.6406 369777.0938 919170.9375 380843.6563 149871.5156 238337.2188 222397.0938 617896.3125 274731.6563 250202.4688 739984.625 121410.9141 520360.0625 249783.1563 458204.2813 607592 194562.0156 500654.9375 100930.1406 159730.6094 227561.5313 384960 547189.1875 169854.8906 168005.6406 196069.2188 356425.4063 655809.9375 514228.0625 683348.5625 377204.4375 168300.1094 406033.5313 95986.8828 487363.5 167888.5625 269612.5625 289517.25 263502.3125 626899.5 289234.6563 567302.4375 529126.4375 456540.6563 613156.1875 135616.1406 212504.0469 393693.2188 501139.6563 208321.7188 255627.8594 351203.1875 363233.4688 170049.7031 138052.5469 129184.8672 273337.5938 517740.9688 249374.0313 256922.9063 161725.2813 240268.5781 758399.125 477797.0938 469313.5313 582968.125 805424.5 104481.4141 774097.6875 586063.9375 296554.875 187956.9844 373501.3125 495728.1563 1002820.75 323931.625 1587116.875 304659.5625 690131.3125 317268.625 183904.9063 390209.6563 295978.875 612142.125 279398.5 931379.75 294588.8438 301644.0625 517858.9063 284498.5 809281.75 585263.0625 744783.3125 171977.6094 246504.9375 225272.0313 255745.5938 191932.25 268368.5313 258273.7969 176707.3906 868552.4375 312810.5 412420.5625 282982.0313 325694 232015.0781 273044.9688 289790.8438 907718.875 353817.4375 239246.9688 387734.5313 325974.1563 294362.9688 249222.5938 236152.75 818369.3125 350600.7188 1083795.625 1255014.375 231743.9688 575145.6875 328474.2188 465706.5313 469615.125 474453.7813 781685.8125 233296.75 563666.0625 285959.4063 1126236.5 204221.7188 452048.0625 1126213.75 140967.5625 507280.875 146647.8125 549455.25 979012.5 361491.3438 382752.5938 298337.4063 339977.125 536547 447930.7813 219780.0469 305371.5 329700.9375 535935.1875 261631.1406 1085609.25 626226.0625 351264.0938 472589.0938 1370958.375 564753.8125 166934.7813 151136.875 178008.2031 326333.2813 334424.4688 506553.9375 624466.5 344245.75 830494.625 623798.4375 419355.9063 347001.7813 1887745.25 915038.0625 156378.4531 194421.9063 433317.9375 570843.5 279584.4688 291379.2813 673251.5625 470805.1875 476516.7188 551057.8125 237462.6719 334119.375 496352.8438 666594.25 334542.1875 1501048.75 264800.1875 712919.3125 211143.9688 213297.875 732653 240222.0938 162287.8281 2345415.25 304832.6563 191679.2813 218774.3438 586768.125 816215.5 971458.5 377115.7813 1724952 101631.5391 227523.5156 144029.0781 351232.0938 278456.7813 178568.0313 236825.6094 173599.0313 140992.5625 549263.6875 330442.2188 372117.0313 584272.9375 464593.2813 104953.8438 555206.625 325630.875 357250.3125 160566.5156 599898.875 229932.4219 201064.2344 700042.9375 390852.5313 10-nonadecenoate (19:1n9) 9286253 26942966 17996684 4490426 3413291.25 8921824 2926281.75 7933957.5 5018736 15518428 12490713 16337953 2258086.5 6330085.5 2250351.5 8567881 2236850.25 8788651 13218608 2650635.5 20508416 12540831 5312348.5 6699995.5 9034329 17833628 46384672 14305362 14621728 8833526 2884751 1802011.625 27783852 4699498 3645705.25 6070178.5 4157590.25 40153240 4210718.5 1902525.375 2502601.5 20277444 4197884.5 2546669.5 8991875 2282320.25 13586223 3813779.25 11818019 3307798 59461596 90256888 9264443 43330296 36915656 6077292 3872208 30989786 21947184 10425485 54199368 24848222 10162077 2000884.5 13304972 11240024 20323540 2881489.75 27179486 12057348 12918482 19094440 11304834 8896882 22975282 26634240 12364578 23787022 16496036 13291816 19526034 13678255 24340688 25631212 3308981.75 25848004 5685786.5 18087492 27272468 26413284 33727580 13705742 8096401 32760978 31660158 86384928 16923450 26541470 21111072 7570005.5 6961120.5 26955422 12012480 20251624 61171080 3885985.75 31280774 17231258 15306888 20257852 59055612 26222594 26656140 57736480 12634361 12838647 21699862 8144955 34774772 26849682 10475005 17366550 9161159 38172888 22314768 16805130 22912638 21500594 38262048 34407180 13845048 22104190 22744868 29582434 12836640 13387041 16805130 15927933 8140551.5 25385942 13613771 23889652 39743048 27588104 33331350 1153093.875 16378453 19737274 8988123 8198266.5 19744566 23765564 42375876 14810930 20432558 24852636 28871128 39973280 22887976 3940424 17946540 16754798 24078654 33323540 6561996 32703474 25838744 18073172 30400264 12861944 18825064 20311828 15084166 69739024 2887584.25 21107848 67960392 17755054 22503050 7327388.5 35912336 8184905 7947391.5 6895881.5 24060316 30441588 6382253 29647578 9357372 29705806 18233442 10177787 8710487 21097748 19760342 7799485.5 6250381.5 40368720 9615216 13412114 22844376 15491261 18258152 29205902 9680183 18450954 16805130 17291544 12542743 25342062 2857951 35307824 22359592 15864758 6028609.5 38056036 26920196 14010485 23931206 14507355 1095418.5 28128912 16805130 3961330.5 27414056 72707832 35487404 3371500.25 8703889 3213839.75 5930571 5068771 21057900 36146928 28984988 35153256 26398092 50611776 11790890 7095633 7060696 29775544 25730104 13468862 16354665 35398356 29583876 16785586 15465789 23383418 10593554 24106806 19154420 21092294 32407210 7818326 5091704 6440725.5 3612492.25 13990703 8879452 17804188 6895545 14306349 19897524 18092064 15722692 20827794 44029048 10623619 29483162 22871498 18511082 28397856 15934837 22157174 10152095 17952358 10293942 11349712 18738874 17294776 6108968.5 4115144.5 43827660 17395410 38314644 16315485 21481890 17240912 19047146 1092167.25 7852594 11819964 11854174 20892768 21010620 17753664 13529714 10641576 10-heptadecenoate (17:1n7) 18283900 72354592 57969264 15954842 8948786 20167598 8251178 21171214 8503231 25468876 25532468 45484872 5124851 26137540 5349098.5 19861632 5907737 16993322 30838346 4639072 32097782 29151022 16989928 16265886 38047648 44971932 138479264 35387032 22690700 21888848 7861543.5 3286501.75 71952104 8245911.5 8618793 19130428 7204983 84072264 9215023 5636310.5 4048269.25 70635608 9464301 6008300.5 29369064 8311794.5 44687788 10495585 46424756 8939108 166746736 270644448 28823610 133176040 107144384 12170863 7416359.5 73924960 43218720 36288932 181508576 46017980 21791180 4296719 46910484 23058018 81741000 5048765.5 80986384 30945482 46096640 45823184 30225830 9090067 41966896 76070256 28657820 93409128 23354516 61032076 32695098 43130980 56907384 64886900 5406011.5 82879696 12308833 52185728 53065644 68782496 93058984 32548042 20432552 92779376 79727960 155004336 44541040 62451348 44850056 19262234 15688027 57745332 38988568 71302392 158795712 7028160 141041744 52760348 39263016 45962340 187289632 84005368 62469160 137346448 56497408 31453176 72243312 20683768 85167424 57156824 39811152 76903832 34292228 90986952 50767908 36655272 41320060 51292592 91785984 119524288 31469430 73512184 72332784 81833920 33694096 17307312 39206952 43044180 21552776 82251920 38948540 72879728 163398048 99756480 78246704 1980453.75 44850056 65354112 24440904 16433009 60017568 57915124 111187912 53601600 115748536 92583216 109724264 175339920 80183776 7817258.5 39613196 36596504 85944536 63929688 11793956 120396936 83087224 39238628 77930592 31339700 58158548 62430692 61558120 262717552 4851794 48716184 202831856 63368568 52447376 27545338 82162808 18296070 18265582 21959616 49097052 99109064 13251285 60391360 32296012 108285592 39483092 26165660 27304700 84637520 50577424 13416574 17906706 131064560 31037992 27130052 80312432 43443240 44435332 57168432 30210156 35204328 23084434 42707540 40872824 62353244 3944814.75 123464152 63792848 33634100 16942438 99236056 84165080 59383620 69791992 56312404 2165966 66947080 44386860 8676282 71568432 261806240 145737664 6636453 33927968 7359898 13249322 12408367 56891616 162344656 106361728 122419184 103842288 164115536 49576476 20163962 16589684 99216592 86436200 41195128 60230056 117615528 132947528 54634712 33508202 94175808 37164408 101825184 50296236 66186480 107086448 18391368 16106478 16178456 6931103.5 38185768 42508100 44850056 18117622 52906108 65214552 50789872 53146496 76970208 129033136 31385180 80290080 56633740 135696208 76306800 55618092 49872604 24435444 25148118 27780096 43682132 52994704 33910300 11072729 19122208 223658544 38083304 201996528 50748236 85084472 60200240 53573556 3159703.5 41451940 28398210 36111448 58990396 65040508 49428916 42605168 44850056 hyocholate 76666.6563 108106.1016 126783.1016 128861.3906 58053.1602 136608.5 52500.2773 416375.125 212126.5781 214413.4219 144788.8125 271808.9688 192776.75 42842.0273 145719.25 134490.5469 70968.0938 212555.7813 291561.125 145569.7344 85357.0469 240313.9688 365555.3438 251647.5156 215475.3438 424332.9063 217185.1406 222575.6563 83171.4688 497785.7813 108891.125 192356.5469 162682 284684.5 313348.2188 256930.2656 121195.3125 136608.5 99449.7344 60083.3555 126543.3125 103874.6016 135230 98431.0234 115104.5 1142861.125 386943.125 115537.5078 211798.8125 119147.3594 83587.2344 488684.5938 258009.9531 129467.9453 298590 25619.6738 409440.7813 155071.9688 235684.3906 139482.6406 73533.5156 120184.4141 40465.9141 284405.9063 122457.2656 132866.3281 81345.9531 540853.5 80951.1875 359222.6563 56858.8086 452426.5625 248268.3906 67560.4375 41584.5938 37285.2227 54059.9648 128207.6797 168102.4219 135319.875 163565.3438 89443.4453 88187.0781 76103.2422 101991.9688 311946.8125 59813.6172 76676.5625 116741.2578 197571.9688 100379.5625 532853.9375 200597.7813 195626.125 136608.5 117315.0703 52728.4492 62882.9922 109585.7188 185729.0781 101474.0547 57746.9023 64512.0508 239669.6094 176244.625 131784.3594 108468.1797 39586.6367 216849.7344 81865.7656 264230.0313 152946.8125 72411.6406 333236.9063 44313.7031 192656.9375 288361.0938 26608.8633 137304.1875 79319.7813 28341.1992 38272.6406 159651.3438 94647.2656 238431.1406 247770.0938 437705.0313 61825.957 115950.3984 174955.7813 201915.7188 139528.2344 393129.6563 74258.2344 191365.0625 32755.8887 602872.1875 115980.7969 352648.2813 52365.7891 434450.7813 90363.4219 128468.3672 462515.9688 97224.5781 192364.8281 98158.0156 288540.7813 63629.5313 135912.8125 95628.6172 35558.957 50763.8906 322587.9063 217287.2344 352229.875 119548.7031 277229.1563 805943.1875 158326.0781 18269.6914 149527.2969 538278.25 274805.5938 174635.125 176449.4688 159837.1406 135556.5156 785444 48501.9375 52299.0313 47496.4102 162403.3438 486769.7813 239210.5313 41896.5273 136608.5 79044.0703 291997.8438 135052.1563 59992.832 186986.3438 288122.2813 189501.8281 134000.9688 583023.125 93278.25 72591.0703 207533.625 46536.043 1011845.813 178977.2344 116572.3828 134754.6719 291338.2813 235909.4219 119942.9844 727220.25 epiandrosterone sulfate 2143697 10905961 12301438 433901.4688 2336857.5 5736401.5 4732887 7895990.5 7688947.5 4440374 16211589 7471013.5 12663591 33338.832 7123728.5 960752.3125 3315719.25 2324729.25 7545778.5 11619417 7245554 2071512.625 6814871 5697295 12958245 2082718 648889.5 5680029.5 4371846.5 6156564.5 8915869 3242423.75 7444449 6858425.5 5389329.5 2027452.5 4229907.5 2075427.375 2633152.5 1043535.5 5610355 2354256.5 2552473.5 3263190 2456798.5 7430877 4259391 1103713.25 3868598.25 1977726.75 16304286 174114.5469 2076415.375 2408840.5 1025290.063 3624433.75 2005991.75 6393560 222230.7969 1127681.375 5868370 12074074 2029300.125 6875077.5 833194.375 500816.7813 1426776.625 2363579.25 5465998.5 2168693.25 1609144.75 1655923.625 4992926.5 750628.0625 2181943.25 1842777.125 18428722 309563.1875 7326835 5096724 5799548 1763267 1549215.375 7326630 1261107.25 2864451.25 886738.5 468246.875 1593175.625 884599 2143697 1590885.25 1595440.875 7208839 13247344 1214232.75 1298456.625 351460.0625 3649233.5 214234.9531 936223.9375 420654.1875 1901671.375 2043835 5913687.5 625285.5625 4577800.5 1425184.625 3883492.75 113924.4922 2343533 210716.7344 3691617.75 2726036.5 1221173.5 1511143.25 2012122.75 2471157.75 13775646 1659273.625 9862417 156539.5469 7490580 6994577 2010063.875 3360026.5 363923.0625 11691325 2090952.5 1564567.75 7674191.5 2121388 390586.4375 3818351.25 3025489.75 5886172.5 77973.4609 5159661.5 1688303.5 4260463.5 1256002.75 2143697 11019905 1173095.5 7770702.5 966333.6875 3600769 11237654 1178577.25 1776041.375 4409145 1330299.625 1577106.75 2455393.75 5183893 789893.5625 2079063.375 316603.5938 4378929 2492154 821280.875 363165.625 624501.5 386623.25 7157565.5 1639316.625 3179089.75 1986275.625 453376.0938 1454363 1951495 3596821.75 1329311.375 6739234 3707691.25 1168662.75 4345892.5 14958515 1756385.875 677294 3009249.5 192504.1406 2150436.25 7768818 1297597.75 391540.2813 358396.25 309520.4063 290013.3438 1740632.25 10481928 3496681.75 28837682 1624058.875 3991855.25 3762694.5 1405562.625 1781911.375 4040978 4552672 735693.1875 529712.875 2616470.25 1668899.5 4267723 726085.8125 2537495.75 1423102.5 2794362.5 164433.1875 3932165.5 3275573.5 11895059 12052458 1054609.5 404741.8125 446266.0625 6194069.5 3310488.25 8137734.5 66063.25 648968.9375 897010.4375 7746522.5 94413.2656 3516719 2222451.75 2978054.5 7000577.5 686502.5625 8578860 2488198.75 5565294 83617.7344 4144010.75 692186.3125 935906.9375 3867602 203131.6094 2584712.25 41712296 3499145.5 2136957.75 4044779 165364.4063 4483050 986343.3125 383578.2813 534454.875 4484381.5 2572708.5 894837.8125 171921.9219 7946853.5 2790538 423729.5625 62616.0078 1055879.75 1539354.875 1128085.5 72428.0781 925577.9375 1933137.375 2347492.75 829787.25 1929334.25 349852.125 925606 625419.5625 487675.4375 2570651 1579436.25 5092271 5377173 2021382.75 1152706.75 24132616 1755931.25 863040.875 1358940.875 1277002.5 14123733 174186.7188 p-cresol sulfate 33900968 184651744 202199888 323055904 76082192 305757568 14408419 91291200 159452432 968043328 617517376 1018965312 302192064 135317296 16215278 62948480 62281984 120665280 65356364 146984304 259514544 532713952 255711520 57312888 1758706304 21655618 1036037760 19111316 803777088 300776576 16507757 159400896 1092400640 422233696 357711840 25779842 83840304 190767328 443880672 300776576 373799936 905055360 173831120 40548292 676564992 216133232 257929376 385005056 242187216 1326459136 548631296 57453256 62815912 1519938048 361085504 1564430720 40484364 124294408 1239224.5 606682240 83530960 22074736 115539168 409952576 5280023552 10108382 1893250304 13168083 631453568 363909056 227095568 253779040 38543556 73340056 552040640 458002528 76088648 904320320 1276310784 181633312 658385344 249107104 260954256 822316928 69788968 92906664 5258278.5 719372224 1536402 168877552 205956640 172509184 329213376 545841344 30938026 300776576 2445111296 584295168 395402496 505878720 13291234 85743792 5196997.5 12274274 48041104 366018592 23290436 234347040 455939136 1066667.75 484589664 414753856 15186956 494697760 67463536 420513760 784473472 1868676224 523325824 502304672 9220337 1731970944 168136944 827167552 1912712704 193791792 340570176 125439360 2498166016 1167606272 60749324 3357393408 744938560 1595436160 71279520 119281736 987830976 98547008 639425280 2130781440 35354376 3539210.75 77655696 1357120384 143802368 8529245 56263832 356913152 1134347008 300776576 58842376 195046000 126365520 273485792 2700783616 480922592 101722384 467597376 81407568 73744656 11965696 5035515.5 903194624 99076512 2138898688 407076608 177128192 129913304 2823381 53353344 5708331.5 153347280 426187776 180435856 844597056 345350304 116329504 46083184 8248204.5 408335072 244813568 569018112 546097792 3876690432 270571712 283409088 373240736 5133009.5 636813056 1570231168 499114784 490838816 34552760 64750592 39919656 654708864 262139360 1351502208 2194428160 256878528 1250928512 213003456 58191548 3127609.5 1956816.375 104052456 27904538 3447628.75 1751368448 27593756 991074880 461779584 407308256 69645688 153271664 59028384 334823104 688774912 19077074 448057824 2225507840 96197712 35082220 7394439.5 2425177.75 200190896 394549824 914443456 844237312 427509984 229012704 256343008 4739250.5 697440000 240758272 364099104 221569696 882983232 4016088576 108515704 275109344 301255136 720410432 1333899008 591135296 296897632 1046134784 136852544 630539072 3572136960 299363072 1372363136 2810945536 3059306752 394349280 511925152 404928736 4669506560 320637984 641478144 1363741056 491460640 336549504 688047680 1198387840 103286480 269859136 1525884544 367833344 427036640 51636828 328140960 1468124160 6206751 140221600 59749640 388967936 703498752 20055228 61995428 295795584 91644312 661846016 361960320 550191104 754954368 2079535104 373118400 830330304 820996736 317158496 1385362176 99851240 3960247040 27627508 1171625088 515245792 5151958.5 3892187904 1359662592 ADSGEGDFXAEGGGVR* 384181.0938 8750388 113410 94120.9531 68968.7734 31258.3359 28531.3438 105563.6172 2052896.5 1164604.5 37640.9492 31118.2578 1751629 78197.0938 1539672.5 67392.2969 101398.0938 1417009.75 125421.9063 43471.543 33662.0273 197190.4688 61965.625 194039.1563 90296.5625 132699.0313 741024.75 69198.1875 26914.7168 38161.8672 44785.5859 307836.25 131555.9219 266488.5625 360567.875 45770.5352 4347697 199905.2813 925351.375 121256.3828 85708.2656 DSGEGDFXAEGGGVR* 1743485.625 22693.8379 49606240 3171292.25 85662.0469 149265.625 61859.9375 110276.4609 210060.0469 119921.9063 107437 123881.4453 75981.5703 3411217.25 54516.8555 955194.375 282017.9375 82444.4453 105103.1953 32635.8652 49959.4297 89969.5469 7966933 51755.6523 507967.75 730460.9375 602604.875 38624.707 825905.875 4651753.5 32938.625 200508.4844 106898.3516 266754.8438 107975.6563 48902.4453 33784.8516 212217.6406 107437 102882.4297 114231.0156 67020.2891 36902.8594 79446.3984 51575.5625 50588.6758 116450.9844 104597.5391 1687092.125 32789.3945 23394.5117 128442.2188 165705.0469 120301.1328 23162.9395 1714049.625 68020.7578 113415.5859 72206.3594 20045.7402 54852.1563 17588.6289 46721.9336 283459.625 157501.9375 232122.9219 12986.6094 34456.6953 155848.4688 141414.5469 101458.4063 744281.5 63373.0742 372570.5 5850566.5 804890.4375 40951.2969 18650.1934 76606.875 69882.1016 1747333.375 265969.1563 143578.2031 25980.5273 ADpSGEGDFXAEGGGVR* 436185.4375 10414633 237049 112810.6172 246648.625 1251497.625 194962.0156 5341657.5 173827.7188 260694.2188 1083252.375 130363.6328 2966840.75 213403.7656 44940.6563 339770.5 270627.5625 1857266.75 33591.2305 196279.9375 157433.3438 43628.3047 237049 157900.2031 2236947.5 237049 4128732 227449.375 86706.6484 eicosenoate (20:1n9 or 1n11) 41813156 132319696 78101472 47851976 15316866 45138128 17532380 41494576 19588924 87523872 72766136 92477704 11862427 18817826 10615407 34090484 10307273 52878376 83192872 9077734 110676344 50794748 27017466 46409164 29611374 104652376 190401008 84590464 53415312 36624844 13524193 8114537 93732136 27662412 11739889 26795436 24131850 158239328 11850106 14581239 8853665 84590464 14025114 10545127 56653088 17242060 81627312 12678666 67018064 8257029.5 242196112 568336256 58056160 146090880 221327952 19336300 16148064 192715392 91416816 62535612 216299344 133202296 76337696 15094609 43979256 72647824 81138880 12699078 116603800 49029860 50360996 77612392 56724624 81710736 144813424 149360080 72912352 129551768 121897176 58227216 153734816 71764600 138361216 168585504 22000488 154390288 30552924 111319064 221234800 103780216 170596512 88282632 31659600 211079632 118454360 550842624 120724992 84590464 104950152 45491004 30985440 185478256 72682264 142183648 316866624 13937197 116101272 83071280 99274320 117080864 302916096 87921528 149088960 345187264 49156940 40479244 87436000 50943212 242825968 106200584 82397152 70560440 43919280 199080624 88575632 176454352 128349688 114914832 179467024 212682128 89961848 84618056 107609768 131029488 77958344 107157592 95115000 99463600 37898756 96427056 70537448 142092880 228351920 140595920 160708400 3449599.75 71985040 82206784 33785804 48231464 83791328 134917680 154624896 56598824 71613520 87316624 174084608 117411008 99230448 25530378 86910552 95692800 83273120 144224112 40523536 115329496 116237904 163618528 155159488 76719760 152508352 97016816 69496888 285605120 11938023 90395616 401848672 118800376 130163920 36669948 217897024 32113346 36194888 28589692 216556016 155791568 25929722 162691184 31151090 145313104 147776832 59114124 52028712 103233064 118724920 38615800 24794426 186378672 31833492 103461040 91413032 62810796 94773888 208041648 44253932 79434296 122595760 200207408 65636908 178354656 21315118 90073024 104894336 100183992 27700680 146792224 103063224 41875960 148574656 87709528 3331844 220661584 104746304 15872466 125699344 398632960 100804056 16491415 33141530 26319096 43758796 34713984 114067552 161259664 157317232 152173232 156242960 310673440 59106964 35943752 30910856 96807424 130826080 51797940 58904108 193042016 142119936 87260808 92150096 106141512 29817150 111154704 99226056 76323976 192773984 58458848 25628826 23068738 19048676 84144432 57564200 71403072 41153360 154701360 65936220 78853768 71981992 58715344 306480512 44410388 126687600 109898552 99034912 191274560 105579032 117412928 54973216 67814776 38931584 91579520 103413928 91079456 22988250 47330692 182750704 75165280 105983920 58651492 110151272 79018032 123548752 5947068 33316770 44844292 84590464 93732080 125463232 78510128 67800624 38179872 linolenate (18:3n3 or 3n6) 78031368 213327040 211353376 68304920 25597304 101839656 46216536 71945536 40575228 262165936 98140928 130242160 66315404 77489240 29093180 70455696 31529780 74304664 151498720 20434082 107235608 151019216 78823432 91881424 60580524 520822560 215172016 124242240 131044112 54678800 58229668 19190520 187448816 40325796 41061200 70685808 38189540 401092288 30925538 48670876 15891051 176177168 28579618 13061921 173599440 25006772 146472176 28456406 283566016 12371262 179559168 393295392 64672180 89843784 154041552 13846732 59315552 156844176 163096608 40199904 251006080 120572184 42641616 10481419 56047396 55198244 163604272 11133696 89379320 62152400 106709448 60140688 71443328 16276197 74017792 119227448 126250520 161796160 36492608 75179680 64956760 131208192 95222720 114071776 6037515 120297256 52921984 83983448 108797904 87979024 128647264 96163560 49947388 165906624 131623560 237936640 84985928 86950648 50391948 54865232 23540364 128667336 53782076 152246864 172737008 14455014 224090240 68709672 89585504 81587592 394917664 123183288 100078984 349814464 127353720 51347068 164699008 42238332 156287536 68237024 92482128 102013808 71533592 108627136 67895184 179342800 58117492 61654144 190262880 123887008 58197096 111996400 114577216 104391656 37887384 39137212 55257164 86950648 45869792 101858688 81248424 158783664 270192192 163516448 137460352 3620647.75 89431568 68735696 30348864 70543008 89370280 93619336 341433440 84923384 108165928 102376264 190068400 236484640 139236608 72217328 51092784 72453800 87922128 103959224 15923229 130478688 76739840 88747360 112218016 72819320 200113184 65492580 90827920 463676096 25080896 67735088 179435152 217815232 114936352 50016420 118353216 29422082 127067096 22348750 92280136 102986736 18184534 94495176 51465444 139089648 194016032 62472800 96869656 105454560 139608640 15667033 30090148 271084064 52858144 59659068 117452504 119920528 53628264 104136328 78308504 38527172 50294668 78276752 49572096 160200480 8699757 146874784 116795352 46183016 23673280 77601592 150015136 81756960 170822400 86950648 2981766.5 119931296 64770600 17487274 57608404 597482112 179838640 15749142 33036214 21622264 33426912 11689846 172233312 391304544 92015160 175773216 204898256 220118992 43463332 78148872 25005514 230259472 131271272 61896860 94148384 436745344 107928272 107933904 66278172 214246192 89291488 174080528 80336448 156177952 161513504 40118812 22207548 46196728 60672996 67810912 44171356 50014456 71488712 86217904 115335128 80546760 130353760 59736064 278853056 46755260 86950648 100385456 177002640 146488336 140431344 163096784 88212032 33908976 87683392 74605984 103813384 63802524 13104959 38082608 342016640 54095988 140397632 110471816 71531032 77957912 138964336 12145461 62745224 62086172 137511856 122895608 94539032 80441576 74182392 52277256 aconitate [cis or trans] 64780392 47589944 34659852 81186712 45392816 106332024 66842604 60084244 59718272 116723576 76353008 93203416 62073224 59636712 49620496 105295408 57918952 87265600 256268896 83487280 80800856 103829560 93772232 57687144 56805764 87125352 95587208 66539432 114428056 70141424 76771768 89504160 134313536 67069244 100174608 34266592 47211096 113646552 58929480 70630992 48882980 92089632 53403484 46072496 98334872 59545700 132017784 57478444 74853608 69529416 93244720 116629808 60545952 76167568 73539648 135643632 34107244 69059944 61477848 97151776 103454824 69079152 63613740 44460484 152868912 49136448 91217672 34412624 78581888 109864232 92833504 50589608 45956232 46845208 59043848 74237456 41250380 73665888 68596936 114484640 88789240 78376480 63057132 64432016 43114736 51858132 38891436 80151360 66039432 62864548 116767648 61497604 69395728 102717688 78285976 87340096 114062336 103872536 88011048 49555416 49223996 77636280 101663152 56861504 77484968 115519856 82376776 70550344 39548112 59711236 68491512 82698232 60847764 74853608 69390344 82061680 102237680 48993652 60392524 78622208 118454288 106535496 28246410 71955576 39105148 109919608 72018904 71231952 70615048 103808896 59878432 114154072 64953000 82622304 58768856 53394924 82271040 49420856 56632724 65407560 75957960 37649764 76086192 155485296 56523712 20948152 56786072 78711472 74853608 70255608 50357676 116885776 59136968 136711056 75331712 79616936 57421648 84077128 82725496 55289012 60947912 59555624 79369160 78883560 73186136 98113984 99798728 78061744 59891120 60234556 51874896 147416160 75132936 104579152 55798452 65875364 98109040 82331240 44861212 80803352 63762280 41764756 57985532 89794456 114085912 69085816 68493160 56315164 98029880 102728504 66654376 92047936 33152042 82485872 103384120 98372160 73517200 98074928 83851272 63792464 75359752 66613052 48052584 81144440 30178100 74690712 77089880 67839568 96253424 71721024 27522318 99902432 41439684 60388112 75473384 78120656 64765308 66187124 102257200 45784792 74449576 59584832 78976424 39454340 67306000 84290976 86566672 67829248 124749336 152998608 34923288 56615232 88467832 116524920 194437120 73314760 102661600 158322384 147187632 77056600 55712280 101722536 100419608 83319296 104265512 87742184 97527568 163557040 117375520 149895680 33386970 102682848 120186120 149523936 69648816 74853608 43968912 137173296 39304784 97814416 82274096 70178240 28096656 64365948 92356040 61956952 81427688 82652880 100079888 74420168 47768032 70741024 174802656 63730504 112638184 59539528 122042752 64380056 39827620 109803472 58617416 38582116 83830304 111566952 108273632 96512000 141235632 59734392 105670368 69937552 47068292 83143280 102911784 85288568 62469528 64141940 100847408 82899448 95212600 133769328 "1,3,7-trimethylurate" 1763293.875 2729157.25 94044.2734 1691316.625 102315.3672 186466.9844 559088.25 83117.4219 809096.375 289229.4688 119973.8516 415711.0938 211239.2031 142954.4219 207499 206256.1563 419777.6563 2477465.5 1354074.125 603769.6875 178591.1094 189713.3906 149738.0781 243243.9219 224149.9844 1693267.375 161248.9375 230547.2344 340149.0625 391006.2188 185354.125 257468.6719 1186593.375 233471.625 24904.2793 590838.75 29501.1465 52615.3398 125956.9141 207499 54353.0625 256756.5 4161247.25 1386557.25 36002.4336 52152.0859 70804.3984 54936.5859 244165.7813 316630.5 59341.1289 577780.8125 42495.3516 378384.2188 81231.4219 170218.75 108427.9453 251550.8281 116589.3906 63352.0039 567602.625 87206.5234 207499 1155306.125 48320.9219 80319.1016 192398.6563 125885.2813 90520.6953 145107.5625 165699.6719 756749.1875 261786.5625 27206.0527 184965.0625 34427.2734 222732.8125 1043807.75 1140694.125 162862.1875 2243374.25 29213.2617 284139.0313 870211.75 207499 8552522 32626.2461 291031.6875 255924.6563 17566.5527 207499 480155.25 179180.8906 1137894.75 39551.5508 6525441.5 68191.5469 75352.8672 1343013.25 "3,7-dimethylurate" 115117 103096.8672 88018 125589.9922 327885 206522.125 160047.0938 68268.2109 77772.1016 115117 98553.5078 118954.6719 563772 180679 79396 115117 110485 90818 88179.6953 121707.4609 92083.0234 108526.5391 124485.3203 66319.7266 149111.7344 44432.9766 195244.625 137014 371561.1875 118429.0469 92018 134818.0938 78001.5859 119174.8516 60311.4609 221528.1719 111336.1094 "1,7-dimethylurate" 2803173.75 2519474.25 483897.875 4594917.5 755064.75 1445422.125 2100932.5 1895756.875 43432.625 3767606.75 3864436.75 2929659.5 1732562.375 405290.6875 163075.875 19065.8887 2161081.75 1012513.25 1587796 1200138.75 2355345 2727965.25 522829.2813 1196785.125 1682401.75 5606780 3486014 2999303 1801558.625 324333.2188 4382727 3190108.5 9225905 814103.1875 193939.125 4476021 5255600 4648696 1912814.5 1923824.75 2977266 3356512.5 413470.9063 2521731 784297.1875 917992.75 727836 1148671.125 111332.625 708854.5625 305426.5625 77966.1875 573636.125 2216327.5 138445.1094 381300.7188 1105640.25 9499023 2454233.25 964052.5 576195.5 696639.25 43487.9688 529547.4375 39670.9414 266968.9688 46374.6016 1545456.625 593934 42823.0547 226939.5 971004.8125 341689.3438 235749.375 165154.0313 572599.875 271762.9063 56691.5625 2729526 436567.2188 285300.1563 144236.1719 44347.7813 685569.0625 273508.1875 517692.0938 419845.7813 1054338.5 71986.9375 228752.9688 627617.5 161142.9219 147199.3281 29661.377 157922.1094 923523.4375 973718.0625 190062.0938 2147465.25 224454.9688 695960 153806.4844 53342.2539 115535.7891 407755.9688 528097.9375 2014607.75 179272.7344 1978838.75 25210.5547 85214.0625 204224.5313 84069.1641 65760.1719 1307967.5 125795.8594 62240.1836 219512 1338663.75 1056229.25 202818.3906 251559.7344 339002.2813 455898.875 350178.0313 309453.5938 314880.8438 947782.625 98155.7734 1042086.563 440832.625 2408409.5 2711044 65252.1875 4550086.5 484400.5938 1232167.125 197047.2656 6836724 259029.8125 528767 1383486 528767 16807.0391 93626.6641 294929.8125 4483797.5 196743.3906 189364.875 84299.6563 795286.3125 444529.3125 5827805.5 86876.1094 1148502.25 9078555 1105119.875 2253900.25 15918169 1385323.25 528767 26540824 411561.0625 223581.1094 143134.1094 173864.4531 168029.0313 165616.625 205184.375 573133.4375 166436.9219 5403883 131925.375 61738.3438 368126.9688 8221394 214112.8594 15335414 69591.0547 38909.7773 286277.0625 2082432.75 469788.5625 1018486.25 645505 indolebutyrate 37586.7773 13113.1357 67922.6641 103162.9219 89295.9219 75794.6875 187935.2813 77669.0156 30780.4355 71502.2969 74664.8828 54269.7656 208116.5938 276001.5625 69489.0469 130483.3906 271023.25 271393.3438 451516.5313 87456.8828 56772.6914 171520.1719 180005.8125 266816.625 45425.4453 37951.0664 62369.3125 144674.7344 124992.0625 118417.6016 143354.3594 34053.9219 34650.5391 51420.7383 401307.2813 52713.4375 101948.7266 96248.6797 324533.5313 49702.3008 93201.6094 147425.1719 197074.3281 252454.3125 147106.2656 22342.6035 1000271.188 769655.375 1960490.75 175763 125942.8281 602245.5 181781.1406 15155.583 687206.875 1037076.313 175610.5156 77365.1328 114042.0469 78440.6719 2758147.75 253070.0625 114954.7891 175915.5 163447.4531 146119.4219 57466 200467.3281 85221.6797 1219851 33331.9922 43176.8281 105472.4531 151797.7656 360346.2813 985421.0625 1851586.25 457260.0313 92228.4297 91633.6797 393098.7188 329117.625 32107.7656 83351.6953 263461.9063 1104691 93733.7578 197258.0938 170219.7813 712945.625 363104.0625 136778.1719 411645.5938 818433.375 166001.1875 411120.3125 1346015.875 51027.9492 45676.293 422438.9688 502761.5625 274808.7813 4337325.5 818163.875 109779.1172 74212.2891 199087.8125 1885594.125 56131.2383 118325.7734 364356.6875 96986.3438 60565.3398 182362.2031 415257.375 139123.1719 63385.5625 28936.1113 5207992 1113980 652979.875 222316.0313 32991.1367 163741.6719 345081.1875 481897.6563 318789.9375 35545.4727 416932.4063 444328.8125 638078.5 103213.7422 99862.5234 249471.4375 85461.3594 1690339 202099.0781 53223.0625 182182.9063 535701.5 193747.2031 429201.375 54407.168 175763 26090.9434 1151180.75 129376.9766 336573.0938 1049643.875 52078.8477 469369.4063 53038.9414 167784.4688 235327.0156 158982.9219 438985.0938 52352.2305 238755.5156 61530.8828 50818.1406 539578.75 337753.875 635543.3125 94681.1797 277410.0625 166864.0156 750642.75 333101.8125 31507.5918 115088.8281 1177184.5 374980.4375 1378298.375 189046.5469 529447.8125 1092938.75 1476052.375 25427.0176 60512.9766 1912977 1009814 183741.5313 202654.2344 353737.1563 411592.4063 50361.5703 39374.9922 58072.6836 574202.4375 1406039.75 2699724.5 80788.1094 29791.9863 59362.1133 769641.75 205246.7031 264851.7813 156228.7031 77772.6016 52725.1953 201559.1563 130776.4219 566953.25 604398.5 18454.5293 24699.1055 69740.6563 230293.3594 364624.3438 58973.0391 45920.418 111482.2578 57122.5625 42985.457 47552.4609 174143.6094 912218.6875 356090.2813 445971.5938 494523.3125 858694.0625 350245.875 1275946.25 57166.4531 834251.6875 223228.4375 1418418.625 156422.125 50460.3984 56258.207 6966091.5 593537.1875 1-methylxanthine 3027768 6845045 2115799 385663.5625 511684.7813 910347.875 1855004.25 3863388.25 5839289 3997245.25 5301069 909904.625 132745.4688 1882139.625 630068.5625 2930952.25 3229717 3888482.25 4371927.5 550895.5 596208.8125 1658332.5 811099.125 2641593.5 2523123.75 1233823.625 6659154.5 7387266.5 16016582 3149209.75 1132095 3120129.75 8055565 10082327 705557.375 1282745.875 4092670.5 2003025.5 1053224.625 179490.9844 623755.125 395648 660721.1875 287959.6563 201874.0938 370267.3125 378852.9688 405632.4375 275129.3125 906492.5625 663666.3125 380443.1875 66536.5391 239275.375 128536.625 164864.3594 172798.9844 243562.8906 148696.1875 204786.4688 401255.1875 796734.75 718087.125 426496.25 152668.125 303857.4063 403503.9688 255363.0469 190769.9063 185726.3125 2417561.75 362251.0938 552324.125 273480.1875 1485373.75 255420.4219 257563.7188 366144.375 320725.2188 487049 364659.0625 190526.5313 93034.8359 166248.0313 888538.1875 177351.9844 752331.8125 86606.2813 314568.625 135335.875 167417.6563 525101.25 238168.9688 894887.8125 1336268.75 450072.5938 529170.9375 196817.1406 384055.0313 425244.8438 227513.8125 290194.1875 267041.3125 180202.9219 244125.75 164949.8438 249275.9063 236366.2969 1155134.875 185398.9531 105610.5938 91736.8516 194400.8906 811579.4375 342259.375 173920.9688 231774.0625 1569710 518925.125 185157.5625 211873.2031 582569.6875 631101.5625 75341.2578 273297.0313 395648 255091.2188 395648 451754.0313 809299.6875 303081.25 243043.0156 333708.0938 776503.875 2213009.75 251399.1719 2061761.75 192297.4219 310021.8125 222747.8125 2245321.25 291522.4375 2262550.25 193752.3906 309536.7813 170925.9375 136160.3594 476727.375 341732.25 N6-carbamoylthreonyladenosine 164037.125 194539.4531 196710.7031 190498.4219 158806.2344 350849.0938 82021.5391 71295.6406 71283.3438 269511.875 113565.8672 140105.4375 83431.2656 102172.7656 115991.7578 114211.5313 97340.9609 146957.2813 78288.9219 126852.1719 284503.5313 117434.6016 271038.5313 122060.5078 182361.4063 76571.0078 171722 142806.8281 148570.9375 90268.0156 150694.7969 168489.3125 158466.9844 64038.3008 132807.4531 217727.5625 103560.3359 146608.3438 120159.0391 267327.0625 132819.0156 209905.4219 278280.9688 195576.2813 166996.875 134092.2969 152547.6875 125264.8828 4108415.75 2511361.5 393287.2813 1211017.5 6025868 2408180.25 146977.9219 264893.0938 186558.3125 6024014.5 1144906.875 359929.8125 4465305.5 195283.125 7772245 255441.8594 1476320.125 123852.8516 947597.9375 202058.7656 1326934.625 169566.6875 235424.8125 193395.1875 2438192.25 699275.0625 137868.625 461510.375 593842.3125 1355705.625 2201874.75 1119053.25 1737677.375 804600.8125 230191.7813 526985 107676.3828 1082607.25 208778.4063 111376.7266 362035.625 88404.5078 924782.625 1337314.625 566592.5625 634456.875 5686549.5 1390598.25 1958927.875 111101.5391 435137.625 326431.2188 1351597.875 279704.3438 145051 854888.1875 331848.75 131769.2969 166557.375 186332.7188 238610.9063 1048540.938 421086.5 276001.6563 245897.8281 465360.625 387090.1563 2424899.75 321186.6875 436731.0938 1386459.75 5088576 137059.2344 1435027.625 1537019.75 483833.0625 266794.6563 907500.75 1018033.438 3361964.75 325948.5313 3111157.25 401453.1563 2365287.75 301556.4375 182062.4688 801996.125 366698.4063 257987.5938 3676403 581018.5625 359870.0313 1453742.875 1676554.625 152072.6094 144245.1094 247804.7656 281181.0313 1559523 421086.5 477578.375 1439453 110157.7031 1702331.875 3840682.25 493323.7188 256832.4844 649702.1875 570394.0625 196017.2656 189566.2813 255432.8281 649353 238555.7656 6318212.5 506736 1014016.063 379097.1563 470943.75 518168.125 429593.4688 373483.25 3586168 368115.25 220059.9844 246376.75 902312.75 460442.0938 115662.5313 421086.5 332470.7188 3388371.5 318972.6875 4411880 1572250 233777.0781 1040943.625 354225.25 1215396 1645657.25 737944.875 1617487.375 126945.7891 1068763.375 436626.125 5979230.5 183180.3281 1947765.375 4687516.5 170573.9688 6649257 171767.9063 984230.6875 868360.5625 159813.0625 371757.75 421086.5 252117.2031 1754102.375 1179409.875 1068588.25 230146.4219 228453.6094 1352395.125 1283121.75 342902.5 183110.5 4770484.5 983121.9375 712791.6875 727438.4375 268406.5625 6523090 1348857.875 310438 285448.8438 448885.7188 753330.3125 530108.8125 353269.0625 570093.8125 1725956.875 431355.5 2854035 2699991.5 805209.1875 464412.3438 5061768 4727645 164303.7813 519471.125 1173673.625 898782.5625 794229.3125 487092.5938 260646.7969 1202535.125 1241351.125 989762.875 2376421.75 104315.0234 1141760.375 6501696.5 3129772.25 337483.7813 2475006.75 793748.875 3768721 140499.2969 355030.5313 1397251.875 388466.3125 118645.5078 4215972.5 542165.25 268801.625 272107.625 683997.875 1771443 310782.4063 2278696.75 177031.6563 3814641 194938.4531 424653.5313 212154.1563 910308.5 261311.0469 199965.5781 586302.25 259569.2188 258042.0313 1009216.688 3187091 1940578 2681069 3966257 325583 3684596.75 469212.375 135356.6406 858077.375 366215.625 3501823.25 139790.125 785507.375 487074.7813 208932.7344 4510183 1389844.625 phenylacetylglutamine 5047208 22646778 16943356 29033426 7094575 68873256 7596810 22349960 19980572 136682704 40398412 102336160 15423522 19507150 4853224 9513005 8452050 10996927 28952356 13666682 20987160 81731928 20601354 7497020 58627004 7857083 85895320 4368485.5 41290548 25973476 8966384 7925604 71292448 43812064 53053416 15094589 10189753 20387006 31739572 16803662 23277768 56098860 10090593 7587513.5 55882524 14035591 22810214 24288014 34258988 79441200 229013216 133742544 14341338 173041072 306915296 384312000 7443758.5 18332240 13491654 142240992 23246182 43521500 136430272 49792552 2566824448 12256202 378102304 6275931 141571584 18312598 15803588 34720952 11616478 15775849 329316576 104501768 18740446 78631632 115949552 117530080 137161328 49013460 116020512 93921256 27656752 54568912 23388442 186222944 55739316 32604536 49166096 27647566 104368688 65505224 7962109 52667224 961429888 121081080 161156624 43516424 13298447 16531271 22398124 23856468 20162626 80139256 78940392 26460094 25895918 10810638 31206146 49590208 23249128 73606064 18474532 64644868 71561840 759026880 104885736 107181704 10355196 1070656320 11084436 109220488 463774464 41560256 56337112 11576558 242898944 622936000 20970610 1856774912 60296820 224432704 14338869 27367230 69319328 10574093 32139956 182575232 8463174 15998562 32417472 100109576 35332676 9212125 10119101 45208056 63782948 43812064 10999093 45059172 24824202 93757400 469781792 117994376 39740580 117240688 30371580 29125844 13318734 9550154 60950976 36549360 621144832 80734464 44950584 15305549 16466223 15620134 43350120 20691432 300419392 9567319 49121004 36952648 58233460 39377736 3146756.25 52533792 63254696 254455872 82856952 830515904 40898784 37765532 78643200 53741420 54514904 76126776 138421312 86512280 7197024.5 19301582 22395274 460662848 25684142 223623280 397338016 29354040 971285568 31336144 26865794 113471640 2184922.25 22709526 11763016 6391225.5 179868704 28385554 262210800 49255532 51179096 22177582 30285372 14948442 52519932 343742656 13955634 123603592 140717536 24305062 381797088 96482224 5492319.5 17543840 54946036 115487184 112440096 40601100 52140720 50830032 6498784 286759008 136660176 30151744 54416712 448151712 1082687104 13479489 18166986 93168376 109250896 177619216 98134176 25709540 133957536 80799032 131103584 1002298496 24762412 148921744 555040064 611608704 71869880 331044544 56783724 1899596032 33819024 76071392 454897504 43812064 33769196 243775264 29891954 26371606 31601456 228333072 158229008 104591640 57818332 21352312 614378688 3013725.25 26812154 15227176 36870696 86301000 20828384 23753238 14865667 23747066 103644976 377123712 24776182 103890720 404669536 44102636 220594592 43812064 17636942 354706016 25780042 298423104 5252839.5 92840856 73863168 7086224 605286720 164551904 4-hydroxyhippurate 883977.0625 1337544.25 2339287.25 1571850.75 12642632 999433.25 12864638 1396726.5 1332157.5 13049310 902823.25 2610327.5 14207302 1648732.875 961024.875 1381472.375 1015963.625 12188180 1353237.5 1504524.375 1578062.125 1981857.5 3135237.5 1580460.625 1995855.25 9359757 796950.9375 595371.3125 2467509.25 904538.625 6510631.5 6382806 869408.8125 1149481.125 8180989.5 1119166.125 1315153.375 1322962.75 1531482.375 670249.6875 24526922 5998183 740383.0625 399055.5 1662888.5 1805089.875 4316619.5 892194.375 3620757.25 1660321.625 8676679 1753926.25 240436.3438 2549043.75 51259128 5161720 541206.75 184265.0781 633275.3125 8473002 128843.9609 1186745.75 37331256 3822804.75 54431572 220040.5938 8040840 39836208 997791.625 450039.625 801589.1875 897728.1875 213905.0938 61101.1992 46597840 5689746 1099684.375 14437282 725624.0625 26508324 2033025.875 1673013.625 4549667 2306030.25 170229.4688 1477590.125 1379080.375 6235186.5 555393.1875 4193833.75 735640.3125 1081861.625 30924084 1120732 730972.1875 401307.0938 42620072 5965862 9299002 634550.5 2179589.5 377785.5313 644989.4375 906316.5625 9030101 2902444.25 8632446 244530.6094 2612856.75 581378.875 120918.7344 4338029.5 20331486 5753108 886187.9375 733126.75 3957867.5 27345306 354898.7188 386494.0625 411436.4375 56420064 1045810.188 1561432.5 4718481.5 423273.5313 1178161.75 1140145.25 6618921 17891552 1417665.125 130765944 7550840.5 13253932 1145447.75 679172.1875 644041.25 742552.75 1262588.75 5810776.5 1516009.75 157311.9531 1272730.5 637844.5625 778531.5625 1662888.5 524168.875 2165182.5 1463507.375 8287757.5 596697.6875 1205351.625 31786.4336 5408855.5 12763903 1903160.5 220977.2656 2152257.75 1307729.5 972013.4375 529717 143936.1094 1150427.375 217037.2813 6990479.5 628498.9375 5687705.5 202383.875 103359.8438 293613.625 12062895 737008.6875 101067688 286570.5 827131.8125 6380911 258318.7188 2810335.75 176328.5625 1805784.625 1703484.625 46465148 676215.3125 3510380.75 217113.4375 1478614.125 8914829 215697.4844 26812224 1180574.25 926964.1875 3111827 399507.0625 5387836 396073.1563 20584156 170712.4688 6731138.5 7257884 67289.1641 44623120 4219336.5 29058562 257108.25 3523958.5 3060093 70394.3359 501640.5625 4478906.5 103989.5078 48247072 1662888.5 570505.4375 278313.125 278454.5625 4071620.75 2435933 5166052.5 222019.5625 4052661.5 1326859.125 410108.625 2432219 13206469 50444.0703 347674.625 844867.6875 69084240 12324708 1133707.125 1662888.5 9860548 721384.6875 10022344 103786728 4965766 473307.8438 8895208 40522740 1597435.625 654277.625 1958774 2167673.5 2578755 2138157.75 4041974.5 3666353.75 18789788 2688137.5 97847464 803141.4375 5553835.5 197104208 109617648 15830457 3831867.5 15322352 152007120 297768.5938 450888.75 10472317 333864.5938 4605641.5 4521222.5 2777822.75 8162837 4972318.5 4233267 95668872 3940285.25 2312885 193968.4688 57559152 8578694 231307.8125 736783 1444245.25 709205.3125 3670848.5 1028710.438 1226629.5 55115.918 3312740.5 32176902 4348733.5 4724218 50122656 372114.5938 1434548.375 627488.9375 450161.1875 21068570 2041757 64237816 4819467 6285026 895652.875 594905.375 286051424 5279315 "5,6-dihydrouridine" 2522951.5 3066622.25 3885081 2850783.25 3613764 4684585.5 1615704.875 2228561.25 2618734.5 6354439 2658529.25 2984049.25 2653289.25 2118152.5 1509641.5 2864174.25 2929471.5 2591403.5 2800570.25 4021912.25 3344900 2788145.25 6344592.5 4369840 8089273.5 4704860.5 4188663.75 2811431.75 4196159.5 3305052.25 3280771.25 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1774375.625 2044699.75 1944587.375 842104.0625 713854.75 3766492.75 759412.8125 3110886.75 230810.7344 233596.4063 2258400 1078010.625 527268.25 4705952 2304467.75 321896.4063 1418946.5 873131.25 1192627.125 2038852.5 1053752.125 533718.4375 5353204 2123095.75 703629.5625 437563.6563 922613.3125 701411.125 3185718.5 889960.4375 488069.0938 1201393.25 1164158.375 457971.8438 2835708 603519.8125 941045.4375 327838.125 tetradecanedioate (C14) 832121.6875 1583897.25 925058.625 967205.875 531787.4375 591285.9375 955298.6875 778993.875 1181597.75 32148218 1260581.75 2941403.25 752813.625 792970.8125 1209126.375 1174460.75 728343.3125 1627609.25 843538.8125 877845 2204368 2348164.75 703168 1780314 619524.1875 4852536.5 2019112.5 1905321.75 3281314.25 838155.6875 1016086.063 629813.0625 4020154 1616842.875 1416307.75 579697.75 656249 1592421.875 1230478.25 922095.125 643764.4375 2779901.5 1410733.5 761409.25 1060627.5 948411.6875 529669.0625 599555.5625 1364842.375 897981.375 8188861 47580200 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142841.1875 937802.125 996716.3125 113197.3125 300876.3125 301193 213402.6094 234200.4531 162301.25 148204.6094 302432.3438 285184.0625 386399.1563 235186.0313 277796.7188 304170.0625 168927 263834.6875 217928.5313 140890.6875 238251.4531 249849.5313 447694.4063 134552.5313 155015.3281 163654.2656 197483.7188 119085.9844 422074.0313 258363.8438 142384.9063 260244.2188 144750.7813 213413.3125 181771.0156 131478.0938 156764.5469 969280.5625 294686.375 193979.9688 229019.8906 184837.5625 227160.125 311834.875 237523.6094 200141.6563 101833.5078 256164.0313 266561.25 212215.7188 150751.8906 449586.125 228090 239274.5469 191751.1406 277337.9375 252529.7188 212516.5 361907.0625 97215.4453 153156.9063 142636.1719 224112.125 344662.4063 291590.9063 163151.8438 120969.4922 259632.875 244422.7344 522982.0313 147696.0781 169870.2813 201797.8438 164135.3906 357828.25 138651.2031 538877 322634.375 310715.9375 149977.8438 186029.4531 239266.4219 382729.8438 221871.9688 419539.6875 158289.2188 125582.7734 131838.8125 186895 195083.2031 228090 124577.8984 129102.1875 265482.5938 173577.1563 310600.25 110474.1484 151329.8594 147972.6406 178979.3438 523057.4063 136556.1875 337304.5 509761.9688 578960.3125 59756.8477 114082.9609 130719.3125 74163.3828 274657.3125 385563.4063 259928.2656 403543.4688 290026.75 181387.8281 292546.625 1467802.25 indoleacetylglutamine 39136.4922 42292.6953 134189.6406 34134 91853.9141 244393.2188 2290750 39071.2656 66071.9531 86653.9453 46656.9961 270764.5625 55726.4766 62831.543 81767.875 193175 330542.0625 44772.7695 46819.3281 355937.125 193175 103959.8438 59963.6289 111789.9141 1593119.75 248661.7344 186580.5156 114513.0703 36095.3398 166896.1406 398160.6875 193175 104664.4219 30199.6582 610810.5625 1983535.25 249299.5938 185730.0625 282583.5938 161713.875 520925.9375 122504.7188 31050.4629 8001693.5 71356.3125 222495.3281 86729.0391 2077485 2771301 207013.4375 4888089.5 454908.8125 53298.7148 115447.9609 155366.5 121691.5 167862.75 59034.0938 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99501 17745.5449 57109.6953 1130451.125 102022.0313 115960 432300 142729.4219 81397.5156 179239.4063 1772895.625 194559.9375 33206.6445 78869.7656 852506.875 182221.2656 49861.2031 57780.3594 81167.7109 64315.5469 118254.6328 351969.5313 50764.0234 56944.957 243878.2344 176442.2969 64227 29774.998 99501 60035.043 4-allylphenol sulfate 2880229.25 41146164 6192557.5 4625670.5 1501006.125 5216419.5 35477720 8213371.5 34311816 22738312 23606610 8341908 16418805 106229280 5576584.5 1058867.375 30393488 9997971 10482374 17721780 6208074 1634988.125 135444480 23191562 6838975.5 15845327 7863093.5 50210272 17087440 2323429 27909116 5064819 10687043 13520170 6476218 38538120 11503070 99606360 5020818.5 118179128 3952510.75 10586532 38347464 1931806.375 2235449.25 65506248 19047610 190307056 5563245 3870078 2225295.25 1639577.125 541813.875 1837166.375 73100208 220646.1875 212370.0313 130922.5234 5829441 5490782.5 5637957 41949.7148 2176245.5 25423566 397728.9375 45931488 933074.5625 2643594 5362131.5 3165040 145336.5938 1400635.875 69576.0391 5184028.5 141816.4688 981652.8125 3371220.25 179472.2813 11449441 128504.8594 2752062.75 324769.75 567465.9375 581939.6875 51476.9336 233921.2813 1491217.625 272308.625 352815.0938 54706.5156 1112909 3530124 755967 169644.6875 1439578.625 1450943.125 873859.5 57805.1992 7662394.5 71636.1172 2069110.5 316520.8438 994489.125 26221876 59106.2031 3594847.25 48343.3867 3717650.25 41276804 1676078.5 3049008.25 228380.2344 9051900 2661441 638171.0625 73104.7188 1544555.75 36228180 12384884 1262702.75 421730.5313 2808004 1973802.375 418007.9375 9528542 11971010 350799.6875 33075.0547 4407652.5 2586059.5 962006.3125 2610260 327190.3438 1202964 13367456 2315565 230974.6094 1405724.5 3802461.5 10098864 10723149 136661.6406 4036492.25 386461.9063 2366359.75 248869.5938 899032.875 1477876.25 36662560 3912597.75 111793.9141 100665.8047 1213128.25 90233.9141 142095.3594 158300.4531 63973.7148 15658897 2253421 67887.8984 138499.6406 721064.8125 1016704.563 6510595 569576.1875 291948.0313 10217791 8488641 17332918 68225912 156813.4531 1139195.375 1003290.125 3520568.25 143135.4063 15447812 1116086.75 451950.3438 6025601 277306.6875 34812164 25645934 4556301.5 2163160.25 2601703 222428.875 509765.4688 128417.3047 10235182 8680603 3627385.5 26289934 3535962.5 93937.0781 56176.3047 642864.375 5604958 117187.7734 124085.1172 3033766.75 556437.625 73819.6797 21302260 398755.3438 3104092.75 1295621.25 444496.75 414735.3438 70057360 643284.125 491330.5625 21099214 884582.625 2077606.375 13042788 469983.375 186919.8125 434279.6875 2330400.5 3734302.5 3751914.75 4550592.5 900299.0625 2676928 847742.6875 68403728 20452436 1329880.25 8189536 424769 978721.6875 2345582 8687754 719699.625 2170769 107915560 10876096 2298221.5 1506298 25028414 4185846.25 20739540 1403736.75 14326614 3595396.5 323908.375 100367.8281 13196012 38417384 348482.4375 165534768 3953792.5 20362190 17780434 11742259 61990296 667845.3125 933586.5 1015492.438 14665296 2643594 17452238 894702.1875 76601024 41924.2344 19558322 1111047.125 8744791 245887.0156 4940854 2643594 7029517.5 66295.3906 1550695.875 4018270.75 510531.25 68156344 59190880 3778627 898772.125 4500148.5 15743808 30479620 3463109.5 53610900 4664999 372488.6563 765920.25 1369028.875 38602656 148531456 "5alpha-androstan-3beta,17beta-diol disulfate" 13141848 18521612 15127802 983404.875 2390464.5 15598392 2849496.5 4161613 9959027 7810302.5 25093112 4071895 26833932 129815.0391 11584390 1754293.625 2989699.5 3616702 11416305 15168508 3254543.75 6125259 8836583 14307875 10432036 739549.9375 218063.9219 5307232 2897898 4715168 11607363 1004401.25 4583854 4428538 6775587 1115610.25 7566529.5 1491384.375 6663266.5 2123483.75 2559549.5 3380975.75 4258816 6825051 3705048 14387770 73880.7031 4142725.25 979121.6875 7263409.5 7479525 41471812 1909409 1828731.75 860063 3587338 7308710.5 1902220.75 12097361 3429470.25 8220684 2592793.75 30745316 1179746.75 11920645 3938093.5 2586161.25 1935864.5 290817.8438 9002494 655649.5625 6403099 3705048 3561256.75 11210490 4492872.5 2679949.25 1530425 19631452 503958.875 18719688 13912019 7668456 3839012 13564690 4221955.5 6449493 2485028.25 1708977.875 197010.8281 1435618.25 1377687.875 15688570 1131066.5 1561809.75 9978964 12967330 30173250 1869146 13031162 2774543 1238283.5 6314647.5 74448.75 467415.3125 4481832 2960745.75 11502047 12221508 5048739 1292759.5 6106890.5 2274228 6647704 112787.3438 289453.375 22850166 2794794.25 3080395 117458.7188 10384387 3633328.25 11109603 34407408 104496.7734 13404095 6185282 12960107 36536808 1465880.875 17836984 1619308.125 18367052 8447864 6537349.5 5799828.5 2297211.25 1139366.375 10379327 1879936.875 3058932 1757694.5 3378488.25 1354414.375 5266561.5 2026348.125 4087135.5 27777122 3705048 10732514 1892999 1056649.375 7081950 5168306 574988.25 1065077.25 1671837.5 1302103.375 6317315.5 14018098 929212.0625 3702524 15538158 3817130.75 7885159.5 4947016.5 673268.375 7168922.5 2791014.75 10754283 1835374.625 5075964.5 3082908.75 1509292.625 3217208.75 1498344.125 6015513 3722292.25 36779904 874248.9375 1861974.375 6474283.5 10001978 16825688 2176677.25 6045568 3594506 7164604.5 11466785 8379909 301360.9063 4650038.5 2848857.5 1049984.875 1192397.125 24653022 23493908 34676628 479757.5 4809418.5 12795490 2234484.5 3888664.75 7114895.5 9194309 8571994 3569802.5 10735342 1135749.625 14510366 6275615 12822284 2161715.75 6120969 3446912 2530726 8593970 12743678 3707571.75 59081004 9359185 2436329.75 1654417 2005440.25 2344714.75 71071.8203 172683.4531 33989196 293009.6875 2633311.75 13446669 321963.125 5192843.5 899994.5 22088788 4605153 92732.0469 34669784 2106640.25 82909.0078 16234017 277361.8438 392347.5313 1455468.5 1919684.875 12972189 1953654.125 5074048.5 291568.0938 11680777 2784959 1509315.25 6416699 229404.875 4135662 907332.4375 1189843.75 1621531.625 2376866.5 5604027.5 2099193.5 235187.4375 2498714 1756904.375 446651.6563 974367.1875 1103789.375 2120952.25 492365.7188 4971156 120129.1484 204819.5469 3345209.25 2243432.5 4007388.25 1207096.75 19501570 537330.9375 1533992 4484975 169157.7031 4652164 1291946.375 3822758.25 115885.9922 7199275 7795146.5 886829.625 18202210 23799808 4937899.5 128601.6094 948499.1875 9080917 397369.0313 "5alpha-pregnan-3beta,20alpha-diol disulfate" 1137775.375 1914777.875 2720198.25 1772788.375 34925468 1516014.75 891168.6875 205257.4688 1331293.25 2953465 3539885 4666741 2848256.75 1433177.75 2821663 931690.875 613732.5 1151921.375 1086273.25 2030818.25 1548570.875 947100.25 938376.0625 799733.4375 1207392 1957403.25 515088.1875 1336759.25 2229389 1275835.875 336490.9688 6376363 939224.6875 2064859.125 1944017.875 799201.4375 3292061.25 398850.6875 678244.1875 4552321.5 1258884.625 956995.875 686272.6875 2218880.75 1057982.375 150873.8125 1064759.625 142160.1406 2042329.125 8501906 6153555 1360364.5 8651852 23171424 6608400.5 1620909.125 1966593.25 3579372.25 4879916.5 1433194 16739965 24369438 2923127.75 5846982.5 521079.6563 1970025.75 247688.0781 245636.6875 4340875 3175272 2684827 5114327 4502353 4207465.5 8742870 1112217.25 1706983.75 29300192 432622.6563 10155303 12999164 20181580 1536558.75 103479.3906 3102388.25 490401.5625 2768338.25 2747931.75 1066541.875 1110378.625 3437794.75 3893926.5 4984510.5 962700.9375 5518355.5 3743652 10414568 5731282.5 1688505.125 7001830 10401563 1156773.625 1601797.25 442474.5938 333768.9375 6868937.5 3017123.25 3830350.5 2144528.25 3885066.5 3007366.25 2970877 320793.5313 2884048.25 869691.375 2196178.25 5480599.5 11947527 2415809.25 301375.625 852380.9375 3479847.5 4178713.5 14952311 1730610.75 1546414.25 1782949.375 5256883 25619142 4127869.5 3965973.75 4884996 24013628 14837146 5225827 12676867 1700438.5 1531433.75 12968342 2148735.75 23484368 764018.375 35445288 2821663 437403.625 1539014.75 2608773.75 30347526 5944398.5 9699393 3407264.75 5020360 32992504 1609986.625 2621042.75 4383351 2568255.5 397051.7188 5063865 4668587.5 4654401 1820445.625 2530937.5 12288781 8063143 4006341.25 1599115.75 5416989 3923179.75 220336.6406 9552276 2001537.875 2858826.25 2308274.75 2471795.5 1489554.125 1933160.25 3391260.5 5439792.5 11499720 5379673 7315886 5092643 8014716 3230278 708716.8125 8027057.5 3905055.75 6321048 68764248 2556134 2693771 2885376 2440982.75 610455.9375 3203079.25 28629928 12594181 2784499.75 2309731.5 4618376 2303310.25 571275.25 6839640 5215250.5 4782982.5 412930.3125 2571652.5 4185992 14022832 4032874 2821663 9074610 8175686.5 1244618.875 1117937.75 3090452 2810003 2779599.75 22939876 24888336 684263.25 1597353.875 5669817.5 2399956 18835392 3625725.5 500449.1875 18828140 920752 3304275.25 4648055 674648.875 5520320 3000840.5 5123502.5 8511561 1061725.875 8355554 4375757 1075198 4467001 463420.0313 3898422 15767378 862466.25 3460376.25 505658.3125 1456949 491517.7188 5452613 3577992.5 7497863 31161064 582982.875 1639680.625 9224219 491761.4688 2896158.75 6811856.5 960412.8125 11301137 4895726.5 1297770.75 25028006 7929572.5 1110498.75 1754709 156825.3438 12604079 1522532.75 3337379.75 243360.2344 373980.75 3269181.25 6406271.5 1647761 2297231.25 2033800 1481611 3876993 660573.6875 3632859 362929.4375 12635577 16150384 110562.5859 2952342.5 1979350.375 265836.0313 5363620 4800165.5 950984.25 511196.5625 428380.375 5103069 2106425 glycocholenate sulfate* 13138003 19517068 15170439 24541616 13790056 12307547 6872717.5 5722564 8215712.5 5523733.5 13973861 7410541.5 8127284 6649399.5 8585243 20382332 5824674.5 8131414 11435178 11648359 7767528.5 8756718 3465784.25 2450785.75 3932676 6173082.5 12182505 7776494 3911796.25 6037344 7776917.5 3223148.25 7972194.5 5318321.5 9842195 6006948.5 3967159 8990895 9279668 4444496 9618039 14996520 9405864 19026024 22635344 13505447 3914618.25 4813977 5932803.5 6365016.5 44191360 154211600 18511710 31305142 116496344 25923456 11196331 20842452 22344926 45460052 128049072 78170784 176575456 9286707 22482116 29736574 44094064 4724884 45050764 11146677 21469014 26350466 78770408 12980081 16171670 82882624 14231526 36344484 49895908 46597360 48072596 5277077 66838316 42918728 28152398 75626376 7943184.5 92431352 32123346 13471525 52375136 10711748 32441004 58392864 15939680 46126920 95183552 19402464 120924992 18448574 30215978 77038528 22639106 32636710 12788027 1965841.375 57496900 12725552 25665290 108056776 8764535 12152641 20179760 6274158 42853844 46536916 12649523 81289720 83737496 63360152 19914668 32532748 15465870 175686208 64288216 11102976 29372358 105148408 11098150 193646304 62957436 12108869 14869193 129170872 89234592 22357048 69298944 50248156 29517204 20238866 43094532 34989208 72187704 67127864 11887299 7452861 13741589 36550548 68507440 20179760 7447662.5 50250240 13344048 6714827.5 45948340 26191658 20975032 29177692 55308472 20179760 8283887 17282160 38707876 34603288 40917248 69408760 20197678 68621632 63732172 60390012 25988538 28526652 11519567 7337019 11193859 19584688 60736404 52070884 18466622 13004280 54230792 31643680 32892450 9182453 135796240 24307754 47330168 20179760 33964960 65715952 32161690 58812524 6547739 87597424 22439482 3529071.75 10521149 35794576 58909616 54659024 6188714 22066814 28147388 62846948 7648883.5 169507920 75708560 104332264 25421616 107292832 39203560 35476308 18361834 13101164 90875056 27868118 11310383 28953802 46138860 83179328 9504119 79342960 80211920 85953536 28720820 13338888 39188016 6357876.5 23623514 6547013 93013600 74792496 53580764 20872002 12958135 16641058 10222273 47895668 13194753 5956664 11261406 28230810 22629766 11870921 17605178 21414944 45272456 20868358 16658841 1747238.625 18477942 14414473 973945.5 1035875 15290515 246204128 10188434 1232838.375 11266995 13449777 31735552 44292532 2551942.75 21881342 14642315 21335532 39275604 9381502 133057640 2109094.75 1182795.25 32036406 12846379 20248514 19755734 5952162.5 17620218 31354430 14830773 18479496 11265180 4213620 7599258.5 2922951 89774360 7382989.5 10582836 35803392 14362933 28432126 19507682 7366500.5 5401898 5201108.5 20053042 1739856.25 42519948 13742766 2444357 3522898.5 taurocholenate sulfate* 1938802.25 4821020 5206847 3715048.75 4749870.5 6185716 923885.3125 1781704.375 3948543.75 3468861.75 3013127.25 2593361 4146151.25 952552.9375 1378598.75 1934877.625 3618015.5 2880623.5 3713197 3477924 2084301.5 2029127.125 2106800.5 469876.4375 592521.125 3345881.5 1504180 1408361 1067365.875 1800539.125 964406.8125 873050.5625 760058.875 2439131.75 2620123 1071135.125 447786.875 2116107.25 1062291.875 350418.1875 1798231.75 3999345.25 1277305.375 2982063.5 2713757.25 2555788.5 2318041.25 800284.5 950047.375 1534471.125 107175296 133043352 3979846 2047685.75 139453632 5062643 3819387.25 26360078 10123924 191537440 75352624 60801396 707520832 22719568 29807114 16023035 59712488 2958350 32803710 30434522 73311904 26364830 117987608 3363288.25 9623306 65322896 14000462 15260616 38078996 27397526 80679536 29078698 287585376 19697068 39642336 30176834 7043539.5 160604608 18135388 5671163 33949440 11714474 45187000 109346800 12220151 43365220 276184704 27803622 184777936 3651740 23590612 71071984 8604107 20057626 6594686.5 7248575 29708910 2180478 9184947 118791328 8761571 9887521 9999523 3159526.25 42175768 29898850 9510896 179027760 28374310 95791688 9567487 31290260 23602494 236312432 88384816 9642577 6027823.5 55666712 19184204 353237632 8920514 10035453 12711242 70738712 40029396 4302734.5 46527440 54197828 9898728 478288800 29873034 41055056 76850360 249432848 5400011 1809981.875 3368615.25 26486920 358980864 14000462 5617416.5 54697416 6992041 9661416 204135872 9734287 3442903 10407291 21948226 9098873 3614646.75 8771386 35607892 19539150 97400632 63651120 6459467.5 143480128 75345128 53291052 11526013 18709110 22922032 15666757 2050663.875 13040361 38012072 27340880 8945688 17022272 14449361 157995440 11858895 130877384 93040072 9114778 45562956 7724628 50363400 58623424 18979234 158477920 2627517.5 61918628 73646600 4943471 3730839.75 20847330 107824248 17409038 74992920 6191275.5 17112744 38732040 6584966 87917688 51354788 57360360 79311064 67488824 24862916 15224197 1335531.125 63018196 47602348 16064422 2322647 181475296 74954944 60949836 9326750 62732384 911352704 51354888 9874924 6725888 10816327 2776516.25 10023134 6469113.5 77669176 98927336 54272992 49611204 21831708 37242704 41238300 113937512 6112432 8336897 14000462 22564150 30731314 14492142 4232493.5 27030246 42554224 15776778 28126828 3484461 3884714.25 27883546 7326659.5 6770682 44977012 325486976 3085539.25 10157981 7057962 9778437 39894968 29101360 768800.3125 71851632 11885083 12991882 84853032 16781084 181492096 637987.875 234432.0625 15499222 10213607 14000462 30218454 3020570.5 11861561 10515287 4812750.5 43708576 663558.375 1328066 5643630 11977888 221754464 17488510 31877106 17588876 16784948 71290536 5972485 1138753.5 6843585.5 15742974 12367631 506740.1875 25449440 11953648 6727302 2641415.75 "androstenediol (3beta,17beta) disulfate (1)" 297754176 197467648 161405056 26799302 28026626 771248576 51366000 31034154 80753728 137753664 170974704 68029616 100670584 2195023.25 111310984 47970024 37463460 89525840 157156576 103023200 34044704 14149437 131140456 146830368 51070756 17074130 3529550.25 38120712 28995710 71677552 113991880 6642352 53743676 28005272 58541564 16269113 176533776 34178696 30807908 16507809 22961490 50261576 40651612 83260576 70549232 43889012 3789104.5 32346812 34744596 49817912 68292520 1062052352 96673536 53143684 18820274 158629728 75133104 52194692 172665504 114184160 174482032 44722032 515863104 28606422 36090836 359684768 118081200 25143608 37804464 59069604 25479206 76667680 164059312 144333744 177257360 246973968 65253104 47693552 350922944 9491766 221795200 210994416 100467376 150383760 6179986.5 532487072 39880532 76595904 186556928 53743676 7206178.5 16393925 41677980 146967056 32215006 25383986 32087676 127825472 569546688 48104464 183284064 60695200 7762131 170650032 7174039.5 2881382.5 33309130 51284772 68964360 117988456 46057368 41008996 141837776 81611280 30298156 2501347.5 10796092 112921040 20740574 95340464 6234097 107551712 59805692 258396192 143558336 9390330 271532032 39219296 152311600 704581952 31186980 247820112 17246596 242856752 277383168 78019336 91378248 62984092 53743676 42259772 38697356 100332400 19056286 68614208 30614002 97420656 51972080 41472880 105457600 118465784 117098712 75138664 31226068 1245249 48809812 32405514 19488846 26267388 108759320 49559272 440652928 350813888 17281832 70039600 90379360 62074596 66062676 153975696 11520596 59566512 128950360 908469.5 148362064 30982362 46114412 86281288 71018672 58663264 27955882 22536530 80988992 297581184 24520276 80817240 189923008 58968248 105442072 110040008 17333824 73862288 72526008 116588712 141737664 16977144 51457704 54274884 14487298 23031656 230694928 362939360 206672800 33091064 109850712 255450112 18640606 68799544 79971488 125320056 60256608 53743676 481958848 25905088 298062976 62188280 172268368 66026920 50992108 45336476 36564680 71338080 67938920 56540560 450155200 99353976 60859828 34136112 47067264 44309580 7384977 9469979 756728000 4106659 34155552 67283120 9104510 79069288 19177648 206136080 62398588 7756598.5 337371488 16527095 3077194.5 97806352 4322279 5007196.5 45066132 26009900 159856864 24548752 37668432 1843722.25 10903496 50906624 46347148 225592144 9457496 61598140 12248636 1071155 16566713 20823982 67137216 187869280 3919651.75 10012758 36078344 44943736 14144803 9023879 99574168 47425532 4104239.25 180898288 4133267.75 41712476 21235170 42832828 45320656 26164740 998525824 22829466 43496360 202288608 5545605.5 19616794 54343668 44627856 11357232 71065720 71542696 19604152 2429779.75 99063152 296012576 89739248 7794430.5 11672533 122104672 44030132 pregnen-diol disulfate* 51014632 43621796 41447712 18908908 24527614 77082200 19806780 5323949 36235080 79188008 72663864 56806800 78131968 1177081.375 29220074 26309518 21040990 20268788 46595824 26849586 21643874 27736974 24639828 32390532 11071422 11086393 12934417 10277102 10632207 30745878 32212718 2998850.5 62592260 14995413 31019640 7337908.5 18839048 29016464 9496427 21392408 19050366 30774136 24828420 44370656 39722120 16805376 3990587.75 6380745.5 10077489 20805112 153085040 206651168 53783260 122288608 196162560 163906240 37401800 36070744 68182816 109442792 69260816 132680344 463555328 41968456 36213040 28974978 47591136 13818485 28887386 109115720 26112884 48156464 210175888 105142416 58226496 72912320 44072272 51532160 397702368 12626464 195520576 182981424 298418336 83666128 38079520 182211328 7849854 48729508 188742256 26168362 31788948 23856618 88320664 89480896 43367396 95063760 44595944 168611280 202864720 35604832 216772240 133367712 45768600 100579368 6466392.5 10556233 108127240 65415344 62719668 40559888 22496016 72941344 73243720 22460568 31078454 16096347 39068744 91869728 260293920 56760828 4505491.5 31935694 63406208 125349368 79974504 55556256 50700964 44746028 96716352 406260192 47060128 65105356 129194592 421326912 204771984 48156464 255633648 94921960 25051832 171801520 23724020 255125872 43225040 262199456 56636260 30478794 71991696 50068376 199703776 118165920 108681720 48156464 73738176 1637535.625 131500280 40345624 32247446 65433020 149948912 40856172 226210544 99709408 123848688 45486900 41857320 147282912 133741552 144220816 47106908 47263488 69249120 3356830.75 191905232 35500032 26655234 56000948 53091824 41329932 38873280 27487134 90105800 150353808 51801972 101702536 103240392 60030660 63948928 40459676 75461328 40253920 103418248 340496320 98136232 74042792 44969452 18708268 19335472 61442632 268540192 495305568 26225692 67253064 64974836 54666876 14202697 118627552 48156464 174681728 30963728 73055800 108095504 172972624 425883776 53410280 190870784 111096576 25801090 45280824 66725536 140793184 24764038 133441232 382434528 32179798 59172932 33849708 33567432 94213440 81583712 29805040 347453856 33822660 98635544 116191240 26978376 98171696 57171072 92682032 45222684 28628884 121409592 47898252 49225600 51038752 12810336 29036498 237233184 16273892 53967824 46411680 18823934 32649762 31410160 46599068 79732280 253313040 24654228 41068256 32422518 15304280 116989720 95425040 30660694 396971520 45124192 28967552 205338544 77045824 31768536 13249387 12145049 123868232 33909480 116923512 21592904 42801012 49490572 188399776 14878145 45298296 82971904 12107366 34256004 28606012 67412560 8610969 290464288 82931200 9126592 59720344 27765592 2827266 10833742 148586672 167076448 10240130 21839606 5700680 42233788 61217000 "androstenediol (3beta,17beta) disulfate (2)" 12740613 13754724 23855484 9236836 6031738.5 41251524 9402621 6007962 12668486 27261538 17092920 13988709 19334716 190899.5 14406550 11736174 8499538 13472704 19316366 11569069 10407931 7794424.5 17718768 17611940 9682632 8658068 6639906.5 12045589 6470166.5 14437659 21015336 4345372 18701424 14332582 13429195 4947528.5 13539361 8814000 6358107.5 7041819 6588596.5 10214096 9064890 13216436 14099075 9300567 1206275.625 6963328.5 4870222.5 10407931 14336861 30707742 8699934 9566046 13006066 28143052 7601089.5 5167995.5 15948769 22233248 11619517 14418746 53285528 6973886 5664923 6795019.5 12037369 2138755 10708398 7591494.5 13906102 5902439.5 16387978 12885757 15492953 11102459 3886401.25 14093420 51600768 1739333 35791088 21901460 22616478 15564283 10582563 27709116 3283031 7506342 21015996 3167873 11135110 2824057.5 7441668.5 18370594 7202054.5 23210392 6554510.5 17265484 34401428 6713380 20753230 14220749 1430268.375 11121685 1359479.5 1279835.625 5771092.5 7927199 6347158 9466114 3486554.5 9310552 9019870 2478051.75 2854996.5 904726.125 5904244.5 11993226 11587675 6848462.5 2260813.25 7281065.5 7637257 27372250 32437596 17891644 15425581 9394381 13912653 50368660 9242981 16084336 7739923 114910512 40261972 4966848.5 38166136 10407931 8339567.5 21683374 6061783.5 33613960 18552932 71552912 7838622.5 8323363 6965539.5 9305442 56907736 12433296 24350560 18221842 17053928 1087136.375 38976572 5067193.5 3588798.75 12885570 14449273 6535221 25383908 24696414 6717259.5 6339620.5 12815161 15185717 15395085 16536520 4547631 4961781 8519963 2344831.25 47646356 8581086 7287047.5 9184552 12907742 4928529.5 9032288 3623461.5 14999129 28892786 5640363 28202226 33778712 23214394 8134314.5 6671571.5 8865897 18809196 12687934 35756216 9204414 12672771 10760296 5818739.5 1873890.5 14639847 41590420 20181252 24728302 10390720 17080294 19142502 1856392.875 7364763 11814603 13014493 4333121.5 10489589 22719778 6970825 31900672 6026428.5 19011192 18652690 5149401.5 6671894 20930468 13495514 9170882 29942950 51623196 7267638.5 4846467 8489238 11919669 16220530 8511116 3227714 38783256 5512654 9725541 29261790 10407931 16898386 10695370 31640500 15086258 4940883 24466924 11513320 4838922.5 12750056 1115539.875 5392531.5 38415908 13988790 13552292 7875987.5 3159981.25 10757811 5230733.5 15652684 12865574 37630168 1993185 10373113 5936757.5 1235734.625 18738034 5493075.5 5144355.5 55524188 2482911 3983622.5 15059214 11294257 4780757 1904772.125 2707495.25 11244439 8151723 15098277 7010357 5365458 14001618 10004624 3285655.25 8394036 29374738 1200020.125 6847049.5 6544526 4352759 2166437.25 25867492 11249816 2044480.75 8090968 6744887 832178.75 2962680.75 34501132 7823639 2872465.75 12755533 4167795.5 30399644 10390130 21-hydroxypregnenolone disulfate 1357635.75 1653288.75 2724812.5 1061225.25 853547.3125 3269404 1101566 555130.25 1416238.75 2526118 1842154.5 1973782.625 2070886.5 29884.2051 1042641.188 1127586.625 1171265.625 1418954.625 1733774.5 1285905.625 1572761.25 980708.125 2016256.375 1903894.75 958929.875 1429610.875 554568.4375 756814.9375 535619.75 2192839.5 1441431.125 441351.7813 2591584.5 1659820.25 1399635.875 794135 1434835.875 1632393.375 269667.3125 791457.5625 1215090.5 1571844.75 1117236.625 1996865.75 1760130.875 1058016.875 186971.5 455374.4375 709143.6875 907918.5 4272739 6773945 1409629.75 2842034.25 7377209.5 8426538 793496.375 568584.6875 2697167.75 4740826 1094139.625 4399339.5 9648008 1304578.125 2615639 884199.625 3028678.75 225985.9844 1205497.5 3045799 4833944 910998.875 2879710.5 2351312.25 3176871.75 2096526 919258 2719761.75 17179136 745570.6875 6356792 4254098 7186208 2601873 1564685.125 3458721.25 326902.7188 1545895 5773092 480495 2007764.5 605909.6875 3047233 2973034 2476024 4256415.5 2875578.25 5492572.5 6248763 954537.0625 3814466.5 3369269 541217.375 1828173.375 296369.8438 67311.7422 2031822.875 3014801.75 868572.75 1116019.125 243327.2031 3770796.25 2536735.75 413795.0625 755864.5625 264434.6563 2719997.75 2602464.25 3443104.25 1149433.625 490808.3438 2156163.5 1288203.375 4488413.5 7023462 2821130 2988761.5 1307426.625 2809187 13934417 2464208.75 1509272.125 4698571.5 26691126 8874422 803523.1875 10009208 2059646 910254.1875 5078548.5 1965334.625 10760170 2781694 16767314 1360409.375 858039.5625 1256006.375 2007764.5 9589650 1820838 5217393 2979859.25 5726861.5 244063.6563 13368258 538944.3125 880303 5396175 3732616.25 990268.4375 5277415 3200153.5 2070175.375 1300255.625 2606851.25 3087145 7468081.5 3300971.5 1211104.75 438506.125 1774052.875 281385.375 12478316 2442854.25 1424799.125 1527756.5 4134911 833771.8125 1387057.375 1203724.125 2239327 5739736.5 2091699.625 11859150 3167965 5663531.5 1519752.5 1013249.125 2909920.75 3497977.25 4122490 6994082.5 2350786.5 5885187.5 1870634.25 706324.4375 505139.1875 4952094 10292547 14847275 3225892.5 3380678.25 5739074.5 1568686.625 350455.25 1555661.375 1233452.75 1687034.625 378149.5938 2434227.75 4076420.5 3404749.75 13957551 2040526.125 3512649.25 2916334.75 513664.0313 1221263.375 4258190.5 3361292.5 906854.9375 5046644 13611964 1389592.625 707205.8125 1905915 2109614 3772576.5 5284582.5 869981.5625 8698383 1805557.25 1412491 6188095.5 3212526 4325796.5 1863556.875 4970918 3770187.25 933490.75 2092645.5 3461122 744776.6875 2142258 393612.5625 2007764.5 13262292 2360903.25 1663441.625 1384653.375 570576.4375 5161538 1820006.25 2486870 2418477 7833631 705587.4375 1126283.375 1647753.875 317384.6875 6025084 1521170 978135.875 14668894 700866.25 627879.125 6250623.5 2683503.75 3291779.5 271387.2813 585054.625 3322047.5 2505404.25 3600710.5 2007764.5 932237.625 3013444 3629436 568736.75 1395439.5 2147126.75 305816.7813 1421855 707916.25 2333458 294596.5625 4369888.5 3032050.5 324300.25 2463711.75 977950 68671.8359 952293.375 5411223.5 1953410.5 363178.9688 2472846.25 315435.0938 4783754 2734711.75 "5alpha-androstan-3alpha,17alpha-diol disulfate" 256145.3594 499389.125 321910.4688 424114.7813 97544.9844 331626.9375 297257.5 130128.9219 37446.2773 46402.0039 45834.9883 196318.75 48997.0195 66572.8359 36149.8086 35454.4219 95217.5781 125621.0469 139072.375 76893.4922 46322.6914 19590.5156 26906.3047 47032.3047 87963.9766 62317.8438 58277.3984 47969.1563 3261668.75 693829.375 213160.0938 155639.2031 2365688.25 323179.5313 179750.2656 133709.5 121908.5859 1977030.375 1242236.5 438939.0938 5832277 569761.5 936768.4375 140560.2656 497059.3438 114661.2656 517304.875 274917.6875 170265.6094 313164.0313 333428.9375 377977.5 455885.6875 44596.1016 384406.9063 888184 86606.6484 2651771.75 439958.8125 1390838.75 280149.9688 1214203.875 899139.8125 284603.5625 255152.7656 38991.9727 212516.9531 1722247.125 84350.25 495914.625 750498.4375 321631.375 1799971 432341.9688 388661.4375 370748.0625 624033.75 323458.625 1449476.125 75827.5469 185079.8438 1693523.625 577202.625 297741.0313 82401.625 316146.6563 113608.7891 1452582.125 2398242.5 230423.5469 146008.25 1274849.25 107307.5469 2852555.25 260739.4063 275650.75 199509.7344 8102965 848898 231348.1719 2320410.75 236888.5625 314176.6563 4326800.5 214628.7969 1228935.375 428841.625 4121049.25 336954.4375 6084091 411003.4063 107002.1484 395497.25 125147.3203 1699908 244730.8594 154781.5313 489409.5313 121918.8516 344751.6563 557712.125 169271.5781 1297338.125 767244.875 260966.5313 325446.7813 130594.4922 825426.1875 377517.25 58218.8203 1741702.75 175537.2813 72807.3906 167636.7031 245828.9688 144828.8438 60893.875 336037.625 408853 1478597.125 34547.5273 1059578.5 1323270.875 395759.5 987191.9375 1001759.438 700310.6875 426257.8438 1798756 49963.3125 237243.1563 292788.375 662953.4375 1801917.875 485044.5625 1759631.375 562580.5625 1278885 45812.7422 401888 704984 869225 201936.8906 432072.4375 684665.25 496190.25 367415.1875 441896.625 1659916.25 322545 87666.1406 491510.1875 1157051.75 726691.5625 394601.25 809361.3125 8158338.5 765930.25 280349.7188 182853.8594 138262.2813 576399.6875 328057.4688 939978.375 1415646 355426.0938 1181285.125 193265.9531 2780096.75 643622.4375 25167.8164 1376762.5 635162.9375 306250.5625 484839.7813 227425.2031 1780644.125 703000.25 403673.75 317032.5313 174914.0313 94635.2578 360394.875 787252.5 81149.0938 124604.0547 113631.4766 43030.4844 509856.75 289663.9063 1332684.125 328168.5625 78889.8125 696642.6875 143463.4688 144869.3594 28444.0859 269492.3125 264799.4063 199058.3438 101493.3672 128397.8359 251485.875 122590.2578 100169.3438 232561.6094 86056.7813 310083.4688 130782.3281 1429394.875 326303.2188 583988.3125 78842.2422 1267720 273296.8125 239717.4844 201283.3438 179002.4063 51315.6875 "5alpha-androstan-3alpha,17alpha-diol monosulfate" 110960.125 238774.2344 340067.1563 46110.0547 144298.875 150759 187405.2813 399361.4375 97808.5391 229198.1719 110863.8203 156025.0313 170431.4844 163137.6094 150759 351805.25 50882.457 169315.2969 122498.6328 129229.9609 266677.1875 37160.4063 148775.2656 165283.2344 184110.7969 45600.6875 127946.7734 81934.6563 77988.8984 177262.375 54828.668 123688.8281 44813.0313 71063.1172 301219.8125 1031460.313 143642.5 295316.9375 81060.1641 243307.75 253106.0156 150759 110029.5 101820.9141 1870353.25 63260.3594 303149.4375 68432.0313 191247.5625 32816.8672 96167.1016 292487.7813 53382.1797 184697.4063 108956.9297 49497.6484 54580.8789 248428.8281 2812313 553246.25 138478.9688 487810.0313 490523.375 260673.0469 145392.8594 130494.9766 162906.7656 78472.2422 23467.9121 63282.2578 295099.1875 212634.0313 256505.6094 259017.8281 221375.8438 28013.7949 185935.6094 106863.5625 36624.2383 244074.0156 76906.1172 334363.375 59127.6797 175432.0469 50302.293 516982.0625 169759.1094 68487.6563 119396.1953 399253.9688 959922.125 377285.125 298082.625 137072.6719 100841.5703 553227.875 96331.5156 114284.4844 2412000 170896.5625 69861.2578 480654.4688 81853.9297 45427.5742 899214.3125 116445.6719 290916.4063 576385.625 62666.8047 163644.4844 56480.3828 141685.7813 541338.8125 97177.8984 294176 338038.5313 238847.3594 1199715 110495.3281 45032.5156 251179 141348.3125 59102.2969 355146.5313 281682.4375 130207.8906 85804.6172 281592.1563 114745.625 48055.6836 37022.3477 92908.5391 295778.75 104450.7578 88414.4922 106047.2969 31065.3887 34200.0703 77018.3047 81724.7578 267225.875 134429.3594 244379.5156 778153.375 307381.1563 152742.7344 81861.7266 296831.9063 198212.4375 110233.3672 263275.25 36037.3359 67696.5625 198449.6094 488986.5 189942.0938 991694.9375 362100.0313 409738.875 64917.6563 182234.2344 357683.6563 45282.8438 171452.5938 119429.4297 606622.25 83603.0313 194548.75 84908.9922 122890.6875 94284.7266 731255.3125 202999.375 379754.9688 522757.3438 422262.5625 111113.9453 155501.4375 255863.7344 149530.9063 99428.2109 573272.625 296692.9688 147112.3438 486757.1875 647097.625 504699.7188 209026.7813 325430.5625 187172.0313 331970.9688 201478.3281 129703.1875 67653.6172 29680.2344 808770 116028.0547 175759.9063 203805.6563 65013.2344 100211.5859 38097.625 127606.4453 137213.5781 101974.7578 255848.8438 95113.5234 99687.875 148247.7969 173571.2188 36937.125 74114.7813 185592.75 90189.8906 118654.0078 48368.3047 85177.7578 144073.625 331005.8125 200175.7031 259653.4531 60206.0508 1309649.5 49484.6602 158198.2656 100893.2031 291845.7188 "5alpha-pregnan-3beta,20beta-diol monosulfate (1)" 90986.7266 128619.9219 397757.6875 8277168.5 148625.0781 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408079.125 279788.3125 53046.0273 478414.125 247477.9844 1092575.75 96422.1641 96988.3516 42613.4688 2589699.25 48216.9219 4546107.5 42199.0469 1165297.125 1117426.5 111796.6406 226948.5469 1040976.063 769303.125 194121.1094 66345.4609 345730.0313 77625.3125 309675.125 154182.9063 329306.9063 65301.6094 197801.8281 219900.4375 720263.5625 892189.125 982714.0625 532467 87746.5469 103875.7344 133830.0469 308791.8438 40162.9648 650139.1875 169121.1094 46890.9648 682032.5 879018.0625 436683.9688 122034.0703 1083124.375 91761.3828 259644.4844 184791.4844 2300778.25 107715.4375 134817.4844 1298097.875 287541.6875 287620.5 131221.4844 218849.3281 204203.0313 44319.7969 111908.1406 232433.2969 77233.8281 41043.9414 213260.1563 253214.2031 60222.6133 228704.0781 302494.9688 724344.75 63829.0586 84181.125 106315.75 1453214.5 "androstenediol (3alpha, 17alpha) monosulfate (2)" 245133.7344 357586.3438 586406.8125 267264.1563 198847.0313 415631.2813 213304.125 275755 366005.9375 553967.125 502243.3438 289477.9063 519744.2813 389446.7813 352194.25 369396 225074.8125 349103.3438 237725.0313 285297.8438 190127.0938 228351.875 216721.9063 498647.2188 291282.5938 376686.3125 390616.0938 277174.2813 378466.125 483705.75 147196.3281 252499.7969 723661.1875 361662.0938 561055.5625 172341.6719 43959.3672 258507.2813 322829.8438 279085.4688 277043.7188 307070.75 310260.4375 306760.4375 216087.5781 182031.9844 259470.4219 361625.5313 2456920.5 257089.8125 128107.3047 325947.6563 259343.5469 153382.9375 238198.5 305649.0313 351129.375 133327.2031 570166.125 243353.2813 171779.6875 424394.5625 411345.4375 264422.5 206728.1094 412000.3125 206433.625 874197 60219.0977 364972.4688 249998.3125 81364.5703 79199.5313 348615.6875 447413.6563 185413 287600.2813 294984.375 168520.6563 232912 232102.3594 173950.1406 298566.875 340054.4688 474557.9688 153752.5156 556242.9375 97163.0156 279482 229009.1094 332638.9688 479469.9688 209709.8438 119426.75 372090.3125 174847.7344 116364.125 134835.6875 366758.2188 132845.7656 308152.0938 167392.1875 26985.6699 339769.4063 252773.5156 135280.9531 76334.0156 372143.7188 405587.5938 337645.1875 584096.3125 271415.5 141279.7656 145291.0156 550985.4375 534145.6875 320974.2188 180261.0469 374171.5938 135936.8281 368332.1875 372782.8125 845787.8125 946192.125 749527.625 242783.1406 211536.9063 124326.0859 149336.0938 326640.4375 343809.6563 459083.5938 407064.375 177283.4688 1192634.625 769897.3125 1317203.125 279663.5 104611.8438 182350.8438 413356.9688 323978.625 450665 123820.8203 222333.1094 575511.625 51800.543 232929.2813 110317.4688 201217.1719 197731.8594 242864.1563 248951.6875 272555.7813 292426.5938 202449.375 212750.8438 464076.6563 173873.5 1175814.875 685324.75 919301.375 263282.1875 187554.2344 220452.8594 664612.6875 867011.1875 232143.625 165585.7031 533931.125 135954.5625 289078.0625 339643.2188 236195.9063 188654.25 161635.3438 224070.0156 150137.5625 234683.9844 233829.2188 1330878.625 175842.6875 354391.0625 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267618.125 2012248.75 1352284.25 2468650.75 3063672.5 339433.2188 3183683 2116719.25 2431244.75 794687.25 1110086.375 769370.5625 1667222.25 881623.125 2671190.5 1792907.125 3664993.25 4134831.75 2361294.5 4159766.75 725554.9375 974703.3125 1164348.375 3812285 14085894 250238.9844 3994024.75 3030714.5 1875871.5 2831953 4551933 7903345 965323.875 2387553 8564425 16179753 1769691.625 1547299.125 3525793.25 1428567 2677312.75 4007035 2373772 3456976.25 3647970.25 4627981.5 1812696 2157728.25 3750609.5 1876391.75 18140372 351911.8438 10054512 3312098.5 9422329 3039900.75 8589838 2339905.5 2579847.5 14220272 1477968 587185.375 1561716.375 2994697 5237374 2077621.625 2879657.75 2052514.5 4980708.5 5738784.5 1758200 1607232.375 9105335 508424.3125 2804557 757542.5625 70380.2422 5064845 4437599.5 5523481.5 4298451 2665068.25 1889566.75 6112290.5 255957.4219 1482086.5 93644.1563 497668.2188 6636357.5 9799168 4861337 547732.375 871161.625 3666346 5187907 8659534 2001851.25 5302497 1357941.5 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9278248 484258.5313 3856772.75 2611130 5892441.5 1676946.75 657031.3125 4927725.5 3825423.5 96845.6016 4297935 312535.9063 1793443.875 3561945.75 1788069.5 2999989.25 183087.7813 2041138.875 1312479.75 979672 4773494.5 15973147 288342.4688 1650403.5 1988243.5 1644368.125 1404640.375 4238823 1012613.625 584906 987353.3125 7466463.5 1675026.375 265575.9688 132607.0156 3344139.5 2411769.5 3350603 43333.5234 835335.8125 1662891.5 9146300 2123890.5 1372435 2217075.5 198542.5469 743139.75 638742.75 1283880.25 2918669.5 1903062 4098075.5 5203788 1989467 167099.0938 4175088.5 1934978 412993.8125 1722607.875 549308.4375 1446893 487097 "androstenediol (3beta,17beta) monosulfate (1)" 2388407.75 4327149.5 10033538 863532.1875 1214295.5 80240184 4638018.5 3270900 4944484 2475762 6810174.5 5998148.5 5921156.5 88305.4766 6889612.5 2892095 1988859 2973906 8134881.5 3398372.75 2586125.75 902943 4103125.5 4586629.5 4202086.5 1699255.25 283933.2813 2436898.5 2999350.25 5536441 9031610 856561.5 3174831.75 4220122.5 3966961.75 3214681.75 7171914.5 1640205.625 579348.1875 1111674.375 2982313.25 3612459.75 2880572.75 5295433.5 5421430.5 2936420 296694.1875 2536603.75 4516130.5 1997756.25 3928476.5 21136826 869314.1875 4831044.5 2182965.75 5355302.5 4198471.5 6028245 7034493.5 4104191.75 2986092.5 8741946 43162308 2003629.125 3206397.5 18010936 7932353.5 1647212.625 327604.9688 2288625.75 5588228 3735945 8101715.5 10068963 9065882 12500438 5103773 3852879 25474884 995528.5625 3368339.5 17363684 11147041 7094982.5 70094.1328 17712422 5612149.5 3547915.25 26170008 2766654.25 858926.125 1341583.75 13209514 7175545 4754234.5 5002966 2198530.25 5101805.5 15596590 2519399 929508.625 12536882 203050.8594 4564603 1539897.125 3612817.5 6901232.5 2919590 7865509.5 2762642 5145176.5 9961899 884237.5 3028416.25 850684.9375 6633309.5 2065331.875 12135292 408521.25 7124879.5 3457785.75 12826999 21116968 3852895 21459266 545806.5 5556080 39411800 9161946 3863066.5 568365 22492962 35761912 5171611.5 17513268 11918753 3667810.25 960533.4375 2913117.5 27272416 1850181.75 12019010 3735945 7748811 6360694.5 1676012.75 7643154 5880531 9111147 6315741 6159126.5 8373970.5 1023444.5 3070493 7985956 10149224 3251612.75 17169448 11321215 3136603 6467265.5 1393299.875 19386520 2670262.75 8589564 3002553.75 2552191.75 6557073 96121.2188 13715395 3351486.75 2225314.25 3920974 3786226 7838780.5 2804054.75 1387739.25 6482768.5 9557013 6244171.5 8413102 12027159 5151850 2434704.75 10436951 2351897 1492513.25 4810825 11826025 3708096 6514941 1205616.875 2715681.5 1261010 2464432 27098004 2860107.25 18730190 3751261 28617754 18354398 1345275 7795662 13085345 25763078 2968438 3435908.75 10979554 2007015.75 18935912 3855648.75 6223441.5 3852012.25 2655649 846734.5 4770030 17379448 3124089.5 35335924 11228679 4183211.5 2980907.25 5296051.5 3543413.25 6411330 161955.4219 203112.75 1422026.125 1182972.25 2300827.25 8342450 565897 5594450 4229467.5 6382634.5 9921220 1536946.625 4312724 1119602.25 83356.9922 8501122 522959.5 1359947.75 7268237.5 1578373.75 3094019.5 723010.25 1848419.375 52237.3984 1831541.5 2705607.5 4778116 79551024 412326.2813 3720628.75 661959.5 61557.2617 3735945 415535.4375 7932106.5 18376950 146832.8125 1278608 3655342 4207751.5 116671.7344 215406.3125 2847547.75 1885048.875 1630815 13507280 182600.875 2282898.25 3501607.75 3779967 3087771.75 1891890.25 4768054.5 1910356 2487413.25 2673419.5 835291.5 897411.0625 4664201 3252370 609728.375 5248742.5 1008148.5 316463.6563 196986.5469 5810360.5 2541684.25 1440297.875 2700566.25 2357777.5 18055516 1356994.75 "androstenediol (3beta,17beta) monosulfate (2)" 1063375 777250.1875 1404174.75 300993.9375 329438 2668654.75 810457.5 454108.9688 699205.1875 371098.625 826504.75 703951.625 711256.25 834555 501540.1875 688116.8125 781159.75 1001566.375 973623.5625 918000.125 136053.9844 918465.6875 2325848.5 518204.5 668976.4375 58628.0664 815495.5 553666.375 916088.875 1230593.5 451625.4688 517767 433908.2188 980389.75 538977.4375 3398338.5 587767.75 389514.6875 167464.3125 597588.375 1010744.938 621313.1875 970352.6875 813584.5 1093481.875 65126.582 997045.25 499950.4063 925748.8125 97885.6328 3298562 354985.625 126355.5547 103202.2578 313045.25 186222.0313 504828.5313 355830.4063 191953.5156 200515.7344 734102.9375 65914.75 160453.5156 2809491.5 653087.3125 90402.5547 129617.1953 160093.6563 358699.625 397261.625 327001.9375 502162.0938 681253.375 397241.75 172636.4063 113701.9219 451866.3125 329438 1024796.938 268812.2813 624837.1875 1225069.75 478544.5313 119596.3672 448369.9688 530283.875 62383.8359 107275.9766 133646.8438 341627.3125 138199.875 128617.4531 306122.375 629084.6875 284881.2188 271394.75 198561.6406 263418.5938 44589.3281 92309.8125 190596.3281 75227.5938 677013.125 527120.125 221608.8281 792875.375 191344.7813 216408.5781 61004.457 286106.9375 336927.8438 49726.2852 375658 172365.2344 832810.4375 513753.0313 49281.5586 465356.4063 118401.3828 303944.8438 1252178.25 198731.5938 633897.1875 640588.1875 790520.5625 992871.375 182803.0469 70948.3594 329438 314588.3125 141342.125 56929.1758 154147.0625 123417.9609 240209.1406 597789.5625 497775.4375 281278.9063 399117.375 66788.3828 329438 174459.5 2287911 1126826.25 39163.7188 145946.7188 178684.7188 329438 366039.5 462118.3438 76486.7656 567081.5 349027.1563 137089.6563 423460.0625 356065.375 312562.0313 292178.375 96632.2656 103514.5078 150240.5938 675242.375 143658.875 350787.75 607146.8125 303383.625 347201.0313 472297.6563 65377.2031 418280.125 90551.8047 217908.75 188611.8906 261193.7031 392872.5938 145018.0625 128389.6094 625554.5625 648958.1875 1268063.125 132174.9531 618233.5 95946.9453 211837.4375 598838.8125 86670.2656 251922.8438 1036137.188 164903.5781 804786.4375 168645.5469 643072.125 301302.7188 238959 126565.5781 195460.8594 145932.1875 437648.8125 246699.1875 739433.0625 358800.4063 176408.3125 310023.7813 571469.5 369165.1563 39258.0234 67838.0703 1251468.625 418424.5313 92183.9844 320480.0625 812439.125 156212.9063 723817.5 164956.5938 761276.8125 40752.0664 52132.6719 215951.6094 162186.2188 386562.8438 92692.1797 296106.9688 223038.7656 157040.6875 632739.4375 187942.1719 182121.6875 139785.7656 88214 453285.1875 596991.25 64422.168 308684.9688 191004.9219 53434.1523 29931.2305 407951.5938 176483.2031 65328.2188 1240145.875 39547.7656 213831.9219 177123.1563 337391.375 85941.0078 6313348.5 193364.0313 340265.2188 445925.375 116754.5938 222204.625 63085.1133 372462.625 1299568.75 278382.9688 787336.4375 594189.875 150162.5781 1657363.625 287266.8125 "5alpha-pregnan-3beta-ol,20-one sulfate" 351741.9063 28476.0762 100550.2969 88514.8438 54248.9023 31645.3672 48797.9727 60147.9609 30352.7344 117356.4453 83323.2344 31588.793 93148.8438 181291.3438 25229.9766 42034.0508 223410.7656 404523.6563 370975.5938 71945.6172 137464.7188 406788.25 51485.7227 63312.4297 173383 243953.7031 131800.9219 473354.6875 727156.25 163116.6563 794619.625 202700.2344 238619.5313 255376.3594 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82595.4141 134800.3281 220857.2969 372850.0625 51043.4609 33924.5234 1849378.25 135609.6406 32811.8281 421976.4375 120882.5234 52849.7422 367761.875 317596.7188 256936.4063 256794.6875 217574.2656 59842.3555 173383 404792.625 848533.9375 103320.875 308678.3125 1034907.313 48213.8008 225189.9063 218075.4375 76472.2031 35225.582 173383 25151.7832 2918387 53842.793 485813.1875 137909 105912.625 19088.9199 142526.4219 331769.3438 72546.6172 147319.7969 144001.625 158373.2188 173383 121000.8984 pregnenediol sulfate (C21H34O5S)* 4454044 5695072 12341099 1928724.25 4076276.25 11312826 5558236 2156451.5 8643227 8530834 15817151 18931984 16493899 78038.9297 8428858 5450393 4170056 2336041 10257861 4488860.5 6878457 7939337 2196558.25 3449113 2662151.75 4783668 1575113.375 2495255.75 3682626.25 7676107.5 9762985 1284112.875 12987916 6592769 9314625 3808505 3475652 6961629 929762 3996706.75 3997753.75 4592331 4901498.5 6384872 6585882.5 1944364.25 516407.25 1420675.875 3096460 3151813.5 5707428 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51894.9805 356631.6563 pregnenolone sulfate 569790.3125 1037572.563 1310489 396580.7188 824339.6875 1496395.75 1077402.75 172198.2656 1310489 1746852.75 3565591.25 2660348 3541694.75 1548109.25 1686338.5 1179916.5 433919.4375 2439566.25 676771.5625 2579675 1358865.75 753685.1875 880973.3125 990846.5 1999372 494575.9375 424343 719302.1875 1272379.75 1812424.375 310135.9063 2131489.75 1105160.25 2207960.5 1063829.25 1030199.688 1948972.75 102384.1797 680600.5 1355490.5 476348.0938 1310489 1030635.813 964197 454055.2813 543605.875 282393.9375 850175.5 1251938.25 5691831.5 462000.6875 956629.4375 6385830.5 2196053.5 505141 1672467.125 569989.8125 8133943.5 1294526.375 76759.8594 2566321 907878.3125 382169.9688 590083.8125 2870480 3259562.25 375150.75 2546526.5 578116.875 2560691.25 617613.0625 807786.125 1148985 14245251 466455.5 1035086.125 1343265.875 4726322.5 811456.5625 740627.75 676014.75 371553.0625 1783531.875 3437117.5 779291 3582385.5 548151.25 1272382.625 1769382 2268658.75 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853554.75 1210012.125 2747861.5 498076.0313 1289541.625 andro steroid monosulfate C19H28O6S (1)* 338687.1563 390890.1875 340555.1563 666915.3125 83239.3672 310530.4688 150411.2813 259452.4688 196718.8438 941899 249707.1406 248413.0469 312978.4063 194080.2188 473942.6875 176169.1563 240769.4531 430162.8438 165849.7188 192479.6406 121465.4844 271747.1875 161917.25 100221.4844 235286.0938 88996.375 313926.0625 131112.3594 201907.5781 1461327.75 135358.4063 352030.6563 448098.4375 241719.7656 176937.9063 629174.6875 333175.6563 469836.5313 291201.4688 138273.4844 138906.3281 210824.1563 1070177.375 192783 391946.2813 102264.3516 202244.6094 739465.4375 192783 104301.4297 104178.5 1240807.75 118856.6641 134002.5156 795568.25 39921.2656 130939.1563 780241.125 373054.8125 178981.5781 37734.5195 578167.4375 37227.8984 57622.3984 45707.8242 292843.0625 346507.125 157969.5156 130424.875 87524.8125 191762 801926.625 102254.9141 92136.4063 221064.6875 812783 132666.2813 853094.0625 649807 23888.1074 264366.625 225701.1094 107055.0313 67000.75 85197.2969 317908.125 136769.6875 192783 234960.7656 33343.2695 47020.5469 30900.9238 189877.4844 83893.8828 315298.9688 131303.125 357829.75 163396.5156 108894.5391 365479.5 201173.7188 97734.0938 184392.2969 19289.2305 118544.3438 238739.8594 536354.625 233227.4219 82140.2266 43423.9531 231523.25 348650.6563 114209.2266 153955.2813 342310.9063 80502.1484 109796.7969 55086.6445 149971.6094 142482.0938 118165.8828 189423.6094 91723.6172 224999 111608.9141 760736.0625 75329.2422 173413.9375 139456.2188 195836.625 192783 173055.5625 57498.1836 145393.8594 1074470.125 366074.2813 413809 100548.0547 693993.8125 122945.5703 170330.4531 680748 352746.3125 396958.125 61075.4883 52204.75 204741.4844 154424.5781 780644.8125 278229.8125 72556.1406 210940.4063 196524.1094 66667.0625 437652.375 152795.9063 156745.4375 282994.2188 29599.6855 134909.6563 125460.9922 352399.625 475204.9688 375267.5 790585.375 215304.4063 192329.5313 1193688.75 109620.8047 203936.2031 109566.4063 322683.7188 356146.5625 206494.9219 64833.0977 56407.0703 42753.7695 43757.4492 3258864.25 217406.5938 52692.7109 825041.25 313910.4375 109942.2344 596412.8125 152201.8281 704938 1018909.5 121483.6719 82705.6953 6744940.5 50968.793 40349.0977 210239.3906 516564.2188 262608.6875 33423.3711 95201.1406 2243075.25 204857.3125 790250.875 126457.1484 1301375.75 261639.5313 322752.8438 104999.4453 143695.6406 179321.4063 104952.5078 283645.6875 110669.5781 255944.9219 85647.5938 32798.9258 2407086.75 872509.1875 indole-3-carboxylate 138105.0469 44441.5898 76810.0469 43532.3672 91726.5938 78552.9063 129623.875 40475.0156 41421.9453 61178.5352 42476.7188 51360.3047 50441.4297 76876.4922 39947.7148 399610.875 91035.7344 35977.7383 66235.9297 26534.4609 86814.7344 70313.3359 59896.7227 56212.5039 43421.3438 88410.6172 68505.4375 45799.457 56783.3164 70731.5156 173924.7656 50773.3945 61621.7422 44410.7891 36359.3633 121803.9531 325534.9375 38886.3906 145909.875 241137.0781 115797.9922 88546.5 67924.2344 42818.0195 71400.9297 172102.6406 44036.7383 326261.1563 69833.0078 99038.1094 44091.7539 68531.25 94338.5391 199764.8906 46209.1953 72756.4844 129753.6328 47977.668 69501.8594 28278.0645 91005.0078 123745.0234 231319.5156 96043.0078 251661.7969 105596.4609 88546.5 44268.8672 112845.7188 46745.7852 82117.0391 94036.0469 55682.8516 130804.0156 66534.8125 60743.6523 101155.5469 205221.125 93435.4453 344463.3438 39055.5039 215667.1563 500378.4688 278512.4688 52401.0469 28934.7754 74751.1641 70829.3125 83749.6094 31504.6309 153390 88192.2734 92275.4609 86288.7813 169858.6406 62728.6953 136171.7031 165903.4688 128631.3438 94477.9453 34671.582 83359.4453 83333.1406 193612.5 110083.8438 48836.0352 106412.7422 121392.6094 101022.2734 190963.7344 81407.7188 114614.1875 64139.6992 88546.5 29475.666 78232.3672 77104.2109 43004.9688 89637.6641 145878.875 93110.3281 116172.7344 161728.5 87939.0313 88912.1094 64893.6953 71405.2031 392333 31602.5508 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300083.0313 82269.8125 100205.0234 130342.0859 608671.625 72460.4531 354153.25 98043.7422 96178.0234 243169.8906 100869.5625 155499.4219 76772.1563 100609.3047 136215.5313 106546.8984 158663.8594 46322.0703 78292.7578 75715.8281 114338.7813 88546.5 122836.0781 107491.9688 63362.3789 57871.1719 31914.916 123928.375 136090.5469 116810.8203 209926.125 163776.1094 151165.9531 70264.2891 88728.8672 28669.1113 66207.7813 49890.8125 106891.4375 42844.207 81545.6875 61421.0352 91868.3672 151397.9219 13-HODE + 9-HODE 3053961 3959123.75 7474953 4456556.5 550358.5625 4403912 3623714 1930239.125 1994323.25 12698204 2401843 1637040.25 5656226.5 4478574.5 1908433.875 2254495.25 4889302 3030931 3665520 410079.6563 1945341.875 2923330.5 2257397.25 3261224.25 3304127.5 4135755.75 1911488.875 2050725.5 2828799.25 793001.4375 946408.8125 1163896.5 2546760.5 3381039.5 2363943.5 2760119.5 1642416.5 3946975.5 1114753.125 1693930.375 287772.7813 2624730.25 1269697.375 1809653.5 1721657.125 412993.125 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2145440.25 1157815.25 1863276 2426200.75 2144437.5 2469265.5 1820099.25 2906665 1204951 1722867.75 1821929.625 2204555 4232670.5 2386675.5 2987551 2185385.5 2192785.25 1170892.375 3591820.25 1717734.25 1658451.625 1436460.875 4109241.5 680906.4375 2709304.5 2275615.5 1238678.5 1060187 1402288.5 7425582.5 796365 1636750.875 2170262.25 1225437 972315.4375 847207.5 2985991 2664288 987905.6875 3304915 3613391.5 207850.1875 2364066.5 2456041.5 1942847.125 294012.5625 4587331 1948678 3081268.25 1031256.813 2321093.25 881579.875 517647.3438 1303957 2653339.5 1948678 2214344 717001 2319975.75 1079055 821943.125 1986792 3899444.5 1578785.875 856953 1153125.375 2723110 1335805.25 1373331.375 4950177.5 2028149.375 2084961 259679.0313 906704.8125 6281644.5 4239887.5 1822557.375 2255504.5 1611289.75 2145330.5 1538699.75 4544943 1948678 3968907.25 3566320 1041223.563 1385224.875 1141044.25 2023908.75 3007458 3063937.75 1896929.875 1481050.25 1750853.375 1490795.5 1517570 3122597.25 2182280.5 510356.875 2619115.75 3287981.5 2830535.5 895935.75 2043450.625 1994924.375 4996385.5 1299287.375 208776.1563 1285015.375 5275831.5 1826797.875 3428495 3455265.5 1106189.625 4629595 1500172.125 1387928.375 2734817.75 1157229.5 1917605.875 1477109.75 3963132 916207.4375 tridecenedioate (C13:1-DC)* 307526.5938 426183.75 1564757.875 281083.3125 148878.875 679163.6875 111994 444211 323279 5188604 662463 2488868 424260 110455.9922 235223 240526 334950 433557 966230.0625 110277.9922 925765 1338329 525006.5 735649 164107.2813 1052839.25 1269536 710196.125 665808.5 683256.5625 282602.375 379431.9375 2240839.5 513513.9688 787237.625 109829.6094 447432.7813 1198092.75 252385.2969 491922.0313 398000.2188 971174.25 307198.0625 502860.7813 948464.5625 175034.0469 461288.8438 228514.5625 226858.7656 216662.6563 3047262 4895070.5 437453.0938 1298004.125 2275574.75 1445720.375 91654.3047 416360.75 452410.25 1232091.625 681866.25 1415157.75 542405.375 356438.5625 459626.25 512417.1875 570803 306393 593122 905003 1561049 952348 788154 1046437.938 1511828 569460 577002 653790 1083000 382209 890459.9375 1800299 644625 1029642.063 389572 477038 240825.0156 332488 976132 650971 363470 452259 503346 1015479 468120.9688 2314872 2156378 4761749 804230 324602 299045 685016 491067 512561 231992 677638 1114283 418306 438569 159368 390965 2361651 1356941 453386 439360 1472804.125 462076 420188 1460542 1150905 1188937 236915 359305 1149972 530511 1115276 716258 988386 962840.9375 1040629 1069671 1143754 290440.8125 1512700.875 774806.625 510430.4688 919494.875 677638 408925.4063 838401.3125 579472.9375 1421187.875 1510267.875 1197855.125 469152.1563 219206.5625 683857.6875 357718.25 1015696.688 462362.6875 808902.5625 713642.625 1274240.5 493457.125 871041.625 892901.0625 980121.125 3739111 511020.1875 180111.4688 314816.4688 378710.2813 603450.625 872354.625 1344893.625 541595.25 1149971.625 952157.5625 542475 873495.6875 480509 1337442.25 1833107 592892.4375 555964.625 1098195.375 274683.4375 591647.5625 278346.6875 630231.4375 1069210.875 571735.3125 162673.5938 722436.8125 748212 718262.625 557475.25 1286997.25 1469644.25 1021184.438 1407963.25 649141.125 667447.25 1250167.125 941031.375 252293.6875 2358337.5 1795629.625 452843.6875 1593702.5 658263.125 1094293.875 890106.0625 65984.4922 478578.6875 609006.6875 318227.4688 355574.625 1682995.75 315948.3125 663736.125 2109159.25 2335423.75 1375091.375 454207.625 650536.5625 251829.5469 694398 764581.5625 351055.1563 967358.25 382540.4375 357642.6875 419173.0625 748711.8125 1477498.875 791096 257294 159707 688121 160650.6406 573584.0625 1834767.375 1779769 885351.6875 852106.5 603457.75 723599.25 732809.8125 401265.9375 2505961 531839.4375 1316009 545615 944155.1875 1382398.75 789997 958396 1112100 359293 1096585 1232861.75 979828.6875 672019.4375 798588.6875 148212.9219 1474528.875 309940.9375 767599.0625 303845.5625 677638 666080.25 1985992.625 994296 1108342 945871 1762340 3552077 413611.5 1622697.125 943933.3125 2915689.25 354073.9688 780464.125 337064.6875 2284976.5 1299366.125 478828.875 778888.1875 676112.3125 511812.25 447568.7188 339765.0938 1093711.625 1404669.75 826598.1875 606912 1063334.25 699630 1137710 108857 231312 1914133.875 192089.6094 429376.8125 314928.9688 312926.5625 1909396.25 1777749.875 N-acetyl-3-methylhistidine* 47141.4531 181729.0625 17935.5234 13944.5908 20083.5625 46231.9414 17981.2559 87237.3594 101443.8672 14765.9209 61412.7578 559723.625 108554.6484 64346.2188 231002.6406 169397.0625 125816.9219 54735.3555 54789.4609 154891.8906 188403.3906 211177.4844 28240.1074 446787.5 26406.5801 57773.4531 133296.0625 43984.207 29484.6172 20396.959 226486.3438 141051 13775.9668 254123.6875 22438.7402 102173.7813 1279889.875 76168.6406 223449.2344 154027.3438 715608.5 304931.4688 215891.7656 155674.0313 192883.6719 28576.8594 938559.375 84662.6094 325590.7188 396885.4375 69029.2266 240313.4219 152339.3125 141051 251197.2656 87366.2813 183913.4844 104010.7031 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448726.6875 180790.0156 4673611 192174.1719 352973 37633.1094 85673.2813 20182228 288203.4688 216803.2813 358934.9063 72348.3828 167131.7031 43820.4922 5699233.5 95651.5391 3533177 566910.5 420883.9375 532491 790014.875 408207.5313 4751338.5 51531.3594 353165.7188 14930510 1173080.625 6365008.5 219840.6094 27151518 129204.6953 2188927.75 185923.1875 72582.5469 92440.7578 194638.5938 177668.4219 373879.5938 226825.0938 635047.875 171428.4688 244592.0625 230762.625 1179559 223582.3281 1078943.875 120067.6719 261596.4844 1532928 67428.1484 6734768 414900.8438 357486.5 677817.75 3896949.75 103857.2734 138171.3125 393642.3125 53655.5859 7118270 1352222.375 1110416.625 227458.9531 9338478 6696942.5 75523.5078 1448365.25 1468344.625 113559.5234 593280.8125 1860860.5 477030.875 1341200.125 1701152.125 93926.3828 300238.8438 13572320 7498897 137165.1406 1841236.5 82315.0781 6809887 84058.2578 1451407.625 72238.125 247183.2344 3864469 247538.4531 600310.6875 804831 694407.9375 55366.5586 349635.0313 303462.3438 5317220 279477.25 695069.4375 202261.2344 164145.7188 489432.625 61517.1328 5407628.5 149861.7344 788797.25 4191038.25 85522.5938 185831.3438 436968.5 240110.5469 166875.125 16605016 25533.0488 229251.125 34625.3906 56481168 648771.6875 cis-4-decenoate (10:1n6)* 3287776 4200656.5 1957003.5 1242887.125 378831.1563 442621.5313 1067150 3026272 743236 5971805 2668362 6964422.5 1660302 411562 1832652 1443628 1247237 2351953 4367954 1182205 3243671 4448720 1246544.875 2560526 942466.5 8843007 7951650.5 5690710.5 2034164.25 1927889.125 809015.8125 105142.4219 6750500.5 1203445.25 1301792.875 1841775.25 1532460.375 4520908.5 877885.625 2687969.5 916926.75 3831219.75 718634.4375 717256.125 6961901 1046557.75 1447238.125 263510.7188 2225561.75 421789.9063 8540459 25331844 1985068.375 1637869 6962977 1155163.375 805656.125 3941449.75 1913221.375 4695833 7947536.5 11651117 6433097.5 288995.9688 3591496 3487725.5 6423424 957969 3133049 5017525 7676520.5 2101477 6802245 2380561 1808476.875 4677923 6189809 4299751 4087373.25 4706483 4008528 16095600 10425147 9261874 920968 3029830 3430956 8072872 11028607 1160943 10160093 3312941 4692346 8310516 3896863 9040348 8249069.5 4598225 3250490 3050515 2365159 8275547 2423324 6341831 3822498.25 631994 4918680 3749906 2718226 3201961 2576692 2132787 3935164.75 5635423 2021534 3081132 3827603.75 6530323 19205058 2208533 16439272 1880668.125 1113637 2923877 3510490 12439314 3961375 3304096 2381441 9286209 8307642 3473289 4802891.5 4384257 3387807.25 3304814.75 4687916.5 2140275.25 2407831 2927859.75 3737565.25 8149034 22614218 6716266.5 1814884.25 2145725 2951643.25 2788058 9224972 4086792.75 3732164.75 5069524.5 4576124.5 3634968.75 3195231.25 14799662 6595219 7784908 3735878.5 924663.0625 2691216.75 2935506.5 4761926 1518794.5 6748290.5 2983514.75 5557340.5 5268751 6132466 6625569 5203963 2841655.5 10525144 993478.9375 2153226.25 3387541.25 10061300 5300628.5 1247204.625 34286700 522254.7813 10563745 946787 8198507 6625489.5 2581837.75 3295476.25 2108790.75 5705123.5 6325053.5 4766109.5 4067124.25 5051369.5 16353756 271003 2439319.5 9265598 4641628 5011050 5452220.5 3105950 9110062 7434338.5 1008238.688 4979273 5595524 12560664 1055852.625 14546855 1347284.125 3159386.5 7479877 3448661.5 2033097.25 2105352 3653653 3609007 11641276 3253089.75 449290.6563 8163844.5 5025273 1765171 1901122.75 5152414.5 3664931.75 741184 463741 883250.0625 1478492 1300460.5 7746975 30352786 8917089 6146508.5 5008830.5 12603476 324120.25 3473289 1074530.625 7941247 1583053.625 4083260.75 1555412 10453193 3105313 7164731 2496805 427680 1584924 6364709.5 1517876.625 3686320.25 6760868.5 19290064 258105.1094 458671.75 2240958.5 1209206.625 5853298.5 2190585.25 2713032.25 14582790 8492710 2821864 5652173 747822 26038880 1674988.875 314856.125 2803471.75 8057328 6167679.5 2400171.5 3349269.5 3991125.5 3473289 3000815.25 12464144 1991926.375 1898479.625 1761095.125 374419.9063 3458852.25 5867242 3087747.25 13896859 11547552 11347118 7096513 83127 8306967 1776650 7473921.5 4108789.75 3558770.5 3710075.75 1978778.25 2164334.5 ethyl glucuronide 60407.3125 4854049.5 18994572 185114.1406 502689 4195543 298418.3438 1220874.125 366975.625 2868926 567789.25 690164.6875 225414.6719 53468.8203 107854.5625 142610.8906 416725.0313 123389.1328 467139.5 951821.3125 1366721.5 160994.9375 247643 484087.0625 211338.3438 288679.3125 228403.6563 149378.875 196867.625 151694.9688 128310.3672 5582.7314 66760.2578 597520.1875 89192.3359 447825.7188 187980.3594 230660.9063 3612005 247643 140831888 244216.5469 3820587.25 256348.5781 96369.2578 247643 341475.25 171180.9531 60314.6914 glycoursodeoxycholate 3817389 905924.9375 1765481.25 1427859.875 4167937.25 5510148 3243221.5 2440982.75 9519524 5439679.5 3526074.5 311113.2813 6250001 5397775.5 18151088 6827612 1193076.875 1504575.5 1346391.125 5870739.5 1079869.375 701350.5625 293170.8438 2248199 1578857.375 15878987 2771267.25 1046465.938 6637916.5 1919435.125 5054505 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529649.8125 35698424 5307260.5 1567864.125 1043043.188 5785248.5 4251979 113317.1328 3211269.25 4540100.5 58432388 953462.6875 5367671.5 11052425 7164004.5 7239806.5 550065.3125 2060510.75 5418651.5 2355458.25 3360277.75 20327052 64674160 10664066 40369636 26615206 15243280 7404900.5 277290.3438 465693.1563 843913.625 30888966 7874148 1099971.875 5049695.5 4226186 18674526 3885083.25 24752450 31886738 2070097.5 78116.7266 6545494.5 13583632 1188042 3549716.5 2335086 4053658.25 8337848 35171512 95477384 1074462.75 3486523 811464.0625 8537028 7024828 3369931 45477840 14815996 1173315.125 1164039.125 8073868.5 4829860 2850464.5 763567.3125 24259658 8730202 14241335 529861.5 18123072 5875744.5 42827276 921842.25 4092735.5 24779052 688837.6875 827399.25 21645132 9874249 4977701 128425.7031 15997941 4323603.5 10503979 11882225 4277772.5 1555964.125 38545200 1167757.75 30395784 315386.9375 11732133 4387628.5 3740923.25 22584172 166664.0156 1186690.375 12384783 4594720 8396634 22682470 18234036 24354470 1202900.5 4630257.5 2362690.5 2889885.5 2084879.25 986417.5625 22310012 1183125.75 1541900.5 845818.8125 7490050 11827119 2450411.75 10951941 2403445 2846324.25 1991452 270982.2188 437935.5313 548039.6875 4338028.5 4355515 87683.4766 602042.125 1691131.75 3296386 6778479 12096205 10557172 4251979 4350310.5 19318782 3015312.5 160099744 133651.8438 24391082 1774876.125 1976092.375 3750372.5 7993583 3037259.5 876463.75 27698066 517743.9688 8044791 2611665 3029040.25 580408.625 7566623 1167177.5 1165561.5 996153.4375 10451425 58221096 28753558 2445397.5 944431.25 2617909.5 14032387 135439.1875 9287557 24900428 8546286 7487662.5 tauroursodeoxycholate 81831.5781 113711.0391 71797.6875 84696.7109 951591.0625 1226933.25 167992.5 580007.875 45481.6523 674404.1875 133713.7344 75613.7813 34214.4727 371172.0625 63077.8984 1667363.375 90958.8125 272561.0313 60247.3438 39369.3555 597227.125 30708.8066 111475.3438 90457.3906 43181.3828 136482.6563 459244.6563 111320.4609 406928.0313 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543689.0625 698445.5 556107.25 246916.9219 6333471 39969624 723466.875 4600985.5 2107131.5 750920 621874.625 70950.7734 2679148.5 4486016 801953.5625 988522.5625 5365650 1692252.5 5078015.5 4367962 947764.125 123792.8828 1408431.625 208820.5938 724927.75 114911.75 639808.75 485671.1563 47194976 12982929 2445140 531513.75 1279970.125 602411.9375 599953 6409121 1586089 602208.5625 137661.6406 817832.8125 5523667.5 375215.4688 66295.375 8040276 2197452.5 678476.4375 1345043.875 962001.4375 351367.0938 3633789 115485.8125 1122443.375 4087085.25 332407.9375 3322500.75 1275202.25 534383.25 4681689 635259.4375 2174510.25 923550.6875 4018316.25 664334 7032164.5 218474.2344 7515627 1356231.875 669916.0625 563861.5 555938.0625 657580.3125 86981.4844 2338436.25 875732.8125 2475908.75 8396911 4736121 14935845 392566.7188 2115854 956177.5 515797.9375 375497.1875 323373.5625 4669461.5 114987.0469 144361.3281 1437320.75 4066246 1385806.625 5316087 456427.5313 121086.375 642816.3125 117329.0391 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105336.5469 50896.1641 719928.6875 852157.625 198050.4688 85830.2266 468250.1563 658879.8125 126892.9453 46024.0469 381928.7813 85002.875 168167.8906 197247.5313 115208.3047 513998.125 116251.8594 333095.8438 178388.3594 187256.9063 5721444.5 315202 97156.8672 133570.0313 38287.6367 649555.3125 123034.125 197649 221615.625 497113.7813 169110.7656 311485.0313 971070 247479.75 392523.6563 246932.4844 83076.6172 136704.4375 128830.7969 159569.3906 (14 or 15)-methylpalmitate (a17:0 or i17:0) 14876243 26554402 30480968 10619136 8722781 17920538 5068954 9864576 9691631 19298812 22345750 13293163 7002818.5 10946335 8143529.5 13280805 5448825 9130015 12996351 6951641.5 24057130 24432056 11488897 6711576 20994908 11804830 40168176 17660360 35315808 16719385 9226606 7305322 17215538 12329333 12302990 16064418 12146337 40595228 13861286 5697960.5 4837038.5 23058616 8266047.5 7077959 17124294 6776148.5 17046350 10249634 15137275 9324390 61952108 84012648 14662346 43328472 36015332 7858949 6566991 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35453316 19311026 13411368 30908076 28679214 47682804 10276134 31003022 42788584 21773122 28687484 13202833 28835932 15932730 14318791 14191955 19851700 17193204 12804257 28939248 20655538 21940308 15146100 17117380 15504433 26834068 29852730 16884346 14263178 40745212 18634298 15700163 35987000 21945480 28606244 20994908 19726484 22688588 14541665 19129956 16316589 23139044 7923316.5 58453680 22444618 18941344 10895357 54433628 32474644 17410338 27525730 28406628 3408313.75 14500130 25383112 13290439 33649448 54175840 34823988 5734912.5 13596200 8228091 7463265 11658828 22135880 47855700 29299942 45064040 31598426 34179100 16171806 13872009 13809632 42310008 25007436 16842278 20994908 35473452 33790104 31214660 23715806 33990492 16803892 22263880 24963518 28704834 42889664 13872093 14029007 17050668 12267084 21883182 18884156 22426734 12490689 26465274 25376076 22039674 15868315 25890954 42626372 16477851 47767612 32979718 27209686 22196740 19424730 26933370 16780998 22647414 14976256 27025446 24083310 18406458 8105069.5 7953002.5 36620652 20951564 47005848 17132238 21038254 17745804 16266567 2962603.75 13083922 14770863 11011743 27218360 27937026 11704783 15165817 23998214 eicosanedioate (C20-DC) 753519.75 2062786.125 1348489.25 972252.875 652825 1125195.375 1761269 1109202.25 2059932.625 12321131 1618422.25 1897604.125 861299.125 378156.1563 2635889.5 729052.875 1572473.75 1647447.75 1767429.5 874309.8125 1003435 1822518.125 1129982.875 1578951.25 624106.9375 2145961 1114191.125 1686226.875 1277744.5 470870.875 2221722 1232513.75 791644.0625 2127880.5 1772770.375 1560316.375 1201356.625 1249087.625 736644.3125 1069945 1020257.938 1325620.875 712098.375 682346.5 590069.875 838897.8125 468830.375 417410.7813 640296.375 914038.8125 416858.0938 3018727.5 1877695.125 446417.3125 938477.75 452071.5625 182038.0938 1459589.375 539556.9375 167588.0313 425807.0938 1295763.75 241930.625 232527.0625 189455.0938 352658.8438 467559.5625 977915.4375 307398.375 941655.5625 534501.625 365236.2188 547995.3125 180429.0938 230380.4375 331155.9375 628659 469042.9063 477905.1875 346566.0625 778271.9375 725778.125 205922.5 379853.5938 737821.125 374789.0625 553897.5 309325.4688 844650.0625 801578.375 565366 603339.6875 247027.875 780390.25 231904.6094 954199.625 984876.8125 633135.0625 336125.625 763504.125 354783.5313 788837.375 277380.6563 560307.1875 1418426.375 294274.0938 523519.3438 430046 789979.875 835619.4375 1034153.125 708305.25 532371.0625 694772.3125 491295.875 209334.5156 812588.375 260985.75 1017721.375 639770.375 1186834 117796.4375 1151980.625 372869.3438 295057.8438 1718513.625 688259.625 831760.375 374266.875 440685.8438 732102.0625 232592.7188 732235.5 737924.5625 889006.875 556416.4375 744027 473373.125 467451.2813 592895.125 413203.2188 443499.2813 1141119.375 974675.375 700659.875 539791.75 547042.6875 900773 197091.1719 663678.8125 438496.2813 467973.1875 835596.75 691817.8125 467517.2188 729711.5625 1531112.875 722792.375 643280.25 604664.125 178474.2813 363068.125 341639.9688 871348.4375 236005.5938 418353.1875 410775.1563 848529.0625 760035.8125 480761.9063 399358.7188 985693.5 218119.5156 662390.6875 1209636.75 967541.8125 415892.625 473537.2188 635202.25 673022.8125 607835.1875 225231.9688 1192721.125 106467.1484 841332.625 646767.6875 396145.6563 367320.375 531588.875 636235.1875 653869.4375 419449.3125 532354.3125 202929.0313 955840.6875 508157.3438 437797.2188 566384.75 288807.6563 475662.625 165700.1875 1109699.125 364721.0313 482220.5625 1633342.75 493606.9063 388883.1563 352588.25 628659 870287.8125 208323.1719 715755.0625 198935.2656 1019276.063 295151.0313 541527.75 640987.9375 213657.75 1605618.375 471277.0625 193184.4219 564703.5625 197279.0938 126965.8594 472576.5 2787165 595332.3125 195236.8906 249934.0313 875512 293380.0313 213112.9688 931600.75 629316.3125 1108195.625 596199.4375 1239949.375 825908.8125 246541.0156 4398762 257437.6719 589941.625 549170.375 293010.4688 527664.1875 956311.3125 925101.4375 1015408.563 366674.5625 185909.5938 211361.2969 1117905.125 120875.2734 1178141.125 628659 441643.9063 180696.3906 770255.875 1044118.125 863641.4375 657197.9375 443335.3125 685717.8125 617576.3125 303272.875 473065.4063 1536543.125 279145.125 2994696.5 270522.25 142985.2344 685963.875 313548.5938 598768.4375 1196188.75 748187.6875 1480172.5 737063.1875 412375.0313 561523.8125 743980.1875 639741.75 199116.7031 219080.875 1190857 1070370.5 1442345.375 647387.5 243703.4844 882142.375 956312.9375 561386.8125 525610.75 375048.2188 480940.8125 241234.1563 922260.0625 628659 367340.6563 252828.4844 docosadioate (C22-DC) 324589.6563 943048.6875 567967.5 718755.3125 563496.6875 413185.7188 996880.1875 353494.8438 817771.5625 2688929.5 577810 730097.3125 387991.0938 274405.375 1116466.375 229397.75 1404231.5 820142.1875 575305.75 248100.25 360988.6875 659045.6875 330708.6563 356004.3125 268614.9688 911627.625 337692.5938 413395 509391.25 239936.5313 664502.6875 275746.375 361551.5625 855531.3125 615350.6875 533709.9375 380363.9375 394432.5938 315601.9375 372547.4375 176057.7031 440837.0625 351490.6875 288626.4063 253135.0156 407971.3125 144038.0938 205951.0469 469123.875 194032.4688 63994.0195 239367 1081085.75 161683 211804.5781 182893.5313 58338.918 276139.1875 178008.3594 70000.3281 104130.8906 234698.0469 60740.5703 48547.9609 67211.8438 157098.9219 541178.4375 163634.4219 237878.6406 89908.4297 146413.4844 233995.7344 125819.9844 132678.875 165203.0156 276793.875 102364.2344 159772.2656 122052.7813 264740.5938 134496.7031 138335.125 175808.3438 187277.0938 112158.5625 218518.4531 132844.0469 320116.1875 221447.9688 181719.75 152120.1719 114632.1094 185508.7031 141350.6719 178361.0313 435210.1875 206558.1719 228138.7188 150848.2813 180955.2344 197917.0313 89467.3281 144812.2656 660677.5 145809.1875 301491.8438 125531.1797 246884.7188 195129.9688 339962 239803.3125 129976.8672 189994.9375 158594.3438 134403.75 235426.8438 106221.4297 234677.1719 161700.875 266903.625 457837.1563 131924.25 159614.0156 277140.0313 228187.1875 282386.8125 216643.25 149540.7969 193251.7969 141712.6406 196523.5 212568.0313 209606.875 181618.75 230421.2031 116750.5703 191958.75 149386.875 110368.6797 410112.5313 380503.8125 264935.4375 190270.2969 736389.3125 214325.7656 184164.2656 98449.3125 220297.9531 161969.1406 200465.6563 207287.25 264669.25 170253.2656 318299.9688 215147.8125 142241.2813 158838.0156 146469.2969 223235.3594 127400.5234 170411.7656 135236.9375 257929.3125 322042.6875 177896.3438 393840.9688 139850.9219 143069.4063 380716.25 382854 152925.2656 196445.625 144742.7656 221335.0156 183129.1094 140147.2188 448392.8438 114694.6641 201583.4219 162783.0156 115010.7109 127058.6406 177033.0781 149883.4219 181961 106115.1875 236586.0469 273747.3125 156615.75 143165.3281 143261.25 163516.1719 90237.3672 374417.9375 119311.0938 179166.0781 1667382.875 175494.1719 98399.9922 114971.6641 144897.3281 206580.6875 125977.8984 293312.7813 134154.1875 210284.8438 109792.1563 174195.4063 251848.4688 104311.7344 331465.4688 188957.9219 155797.125 321114.8438 153490.3281 101866.2813 196601.375 587741.3125 196523.5 61527.332 138897.875 242637.8438 103776.5625 154169.4063 192381.5625 191557.1719 221793.0938 222410.0781 295868.375 180847.0156 124688.2188 1673910.875 144897.5625 265246.9063 194032.4688 114341.6328 173021.5625 311106.0938 227755.875 246880.7813 99927.2734 155120.875 86267.8281 201731.6719 86641.2813 274135.6563 183172.7969 169080.3906 144879.5156 268096.6875 373454 253041.2813 201489.8281 309824.9688 172540.7344 99357.5938 201650.6094 448124.875 135758.7031 833145 154361.1875 103120.8203 254311.9531 137592.4063 168701.0938 306314.625 210590.8906 1036297.313 304751.6875 237441.5469 49880.9609 310626.5625 144836.4531 72683.2031 42604.1406 513051.4063 204535.875 161296.1719 226812.5313 52735.6953 255006.6094 201369.7188 212623.8594 114642.0078 118433.3594 183184.1719 168774.375 161268.25 133386.1875 111875.0391 16-hydroxypalmitate 1368195.875 2864197 2183769.5 1023486.5 893891.1875 2937644.25 2303044.75 2004448.25 1564319.25 3166746 1564007.75 4197388 1334053.375 3180530 1598804 1850829.25 2128568.5 2011031.25 2288841.5 1403790.875 1920984.875 1945760.375 1508459 1852997.5 2144318.5 2450712.5 4734157.5 2632320.5 2346902.5 1810023.875 1571540 989400.25 2751441 1647434.875 1222417.25 2293996.25 1442267.625 3593949 1451198.125 1071894.5 963087.8125 4119116.75 1753406.75 1184091.875 2169524.25 1907593.375 4042385.75 1458735.5 5621051.5 1326422.375 9530322 22427964 2154872.75 2908533.75 20648564 1176291.875 585172 4023894.75 2042724 5802833 11949664 3906516.25 2388472 335575.4063 4368535 2088591.75 5220863.5 1293552.625 4771647.5 2459395 3045962 1699921.25 2227389.5 1337349.625 3187155.25 5590763 2583398 13013545 1596240.75 3824971.5 2806627 6388688 2401638.75 4670998 952474.0625 14328947 1374490.75 1666283.5 5718720.5 2728582.75 10541890 1566601.75 2033577.125 8724431 1801109.125 4565292 6220988.5 2838054 2159288.25 2333993.5 1943118.875 2336026.5 3243231.25 9204613 5318875.5 1051394.375 5783126 4415609 2923089 5132884 3420307.75 7107718 5022505.5 4000628.5 3197311.5 2514226.75 5075481.5 2940434.25 4696500 8080329.5 24628080 5343841 2538072 2738019.5 2395192 7451828 3017239.5 6416349.5 2754820 10674579 3245664.75 6986519 4045418.5 3161498.5 2777933.5 2629571 3002373 2948270.5 1713984.625 4138358 1394237.625 4502130.5 15882116 2957119.25 4201791.5 479832.1563 2923089 2864676.25 938423.25 2458067.25 5473420 1388923.125 5518321 4334745.5 7979994.5 3933669 29285482 4432170.5 2014777 1755998.125 1571370.75 2019894.375 2222874 3357191.75 2408437 3463100.75 6709211.5 3467215 12753876 2819865.25 5099870 2873352.25 3945107.5 7254436 1004152.938 3443617 15985630 3068268.25 2346650.5 1927360.625 6947267 2348328.75 1799872.875 1543423.75 4921105 5577218 2416634.25 4446081 1803375.5 10750663 7018447 3418400 2483554.25 3539511.5 4863596 1112427 931310.0625 17186620 3788719.5 2909433.5 4120507.25 3065314.5 3365386.75 3867071.75 1637867.25 3277630 3425448.25 1649447.875 2513509.75 10787229 801573.375 3778787.5 4663272.5 2763688.75 2183280.25 2657265.75 3934630 1409393.5 13260826 2218724 630505.0625 4912224.5 2530758 1204415.5 2923089 6687363 4859033 739524.9375 2172503.75 2910992.75 1807430.375 1674437.125 8088203 15424179 9094350 6321726 8966836 28794766 5893463 2656461 1237277.5 4763149.5 4632183.5 2887941.75 2686091.5 5856466 17860104 25101332 3024834.5 1808689.25 1849314.625 7597850 1948669.75 6599627.5 4442491 2564426.5 786085.5625 1137343.625 922336.1875 4250027 3008131.5 3646076.75 1885752.125 8237357.5 3887047.75 2683447.5 10659244 1902048.875 20519880 3127765 5176336.5 2885197.5 9396732 2711656.75 5938110 2923089 2324939 1584884 3014438.75 3277181.25 2260399 2241156.25 697599.375 4553996 8515425 2652497.25 6452712.5 2867966.5 4643589 5833535.5 4510276.5 1208532.5 6373638 1447529 4178227.75 6255146 4598735.5 1206520.375 4143892.75 5734425.5 alpha-CEHC glucuronide* 118249.5547 165619.625 30187.9492 63747.3047 42772.0625 118046 116746.9141 146049.3281 781760.9375 59789.625 39822.8477 1942775.875 38639.5781 95179.375 182354.4219 127238.3594 82562.2031 71033.0625 86988.1563 928198.625 89729.6719 163294.75 160531.7969 433461.0938 49050.4023 26182.0625 140969.3906 22562.9355 95122.6094 75052.5391 17588.4121 165757.4844 128388.1641 1106107 293075.4063 25224.1875 13675.7568 467329.6563 125523.0313 62102.0352 227833.2031 133294.0625 157511.0156 106430.9063 229213.1719 117842.4375 115830.6484 221359.125 102023.3125 30244.1504 941711.5 52342.5234 545684.8125 687953.1875 1090287.125 17648.7988 135479.25 430998.2813 187527.25 43288.1367 37503.25 315994.5 102797.9453 27110.0488 236896.2031 62896.7461 33125.4297 153112.6406 229112.625 557731.625 75020.0391 222089.6875 110568.9688 N-oleoyltaurine 190843.5313 351610.2188 216459.5938 190288.3281 75070.6016 296687.5625 132940.2656 162402.6406 407856 380539.25 200844.0781 83672.8984 72261.4141 419377.3125 88884.1563 380295.8438 336860.1875 138482.5938 486697.25 376706.7813 296453.125 179059.0625 184183.3125 226770.3125 1004338.688 190257.6094 147200.4844 273625.25 102376.1563 143433.6094 162144.2969 123584.4375 259891.625 129696.0547 154847.2344 133652.6563 403220.4063 278614.125 164726.1875 116034.1328 304934.6563 1016914.75 205433.5313 1004689.875 328999.9688 151425.3906 203628 209624.8125 618216.5625 142087.0313 112980.7109 110468.2891 361187.9063 231525.2031 108585.3203 79981.6953 149681.3125 109857.7031 125147.6328 257205.3281 235622.3906 118309.9375 86478.1094 104328.1328 109855.1484 285650.625 147792.7344 197147.75 94109.0313 126372.3594 124231.8594 479892.7813 299144.75 281994.3125 160217.875 191587.5469 1493860.625 275367.6875 269651.7188 508967.8438 420440.3125 56600.4023 203628 192997.8125 476440.7188 152525.6719 263487.25 469890.6563 149827.7031 311406.4688 1778644.125 216618.2656 180803.3281 2193677.5 63838.9727 245991.2813 297114.0313 61478.0313 204289.3125 156999.8906 58645.582 538291.5 380165.625 140581.3906 79134.0078 203999.0781 42399.0234 989568.6875 285338.2813 55712.707 602838.625 352497.2813 158386.8594 206253.1563 85862.1406 203349.4688 283282.0625 203906.5313 79454.9297 253719.9219 207064.7656 131142.3594 249987.125 133184.8125 605935.3125 117968.3984 186613.6406 380359.9688 106932.4922 251930.0469 79217.8672 773454.5625 268023.375 724926.375 215907.9844 101792.3359 104317.7656 264743.25 91072.375 150091.2344 783216.4375 259345.625 1262036.875 85029.3047 261265.6875 273228.1563 165194.2031 215950.5156 275805.3125 341570.0625 57057.8164 221607.5313 203628 122316.7344 133773.3594 162680.8438 211439.875 452520.7813 116371.3516 217984.0469 166784.9375 191988.5781 207147.4844 135536.6406 123615.8828 380854.625 1052074.125 913865.625 138803.875 118910.6563 127207.1328 148984.25 84729.1172 196927.8281 403473.375 456472.7813 526522.1875 359654.0938 124494.8438 267205.6875 60936.7344 184073.6719 262300.5 191254.2656 221995.9688 792338.5625 191942.8906 372107.6875 208399.6563 227560.0156 193333.6875 267649.1563 155019.4531 221065.2344 291839.7813 69244.2813 502895.3438 202886.9688 353334.125 326764.125 94724.2188 203628 139665.1563 267079.5 114761.1953 69918.4609 79301.6563 83999.7266 91893.6328 207409.4063 380885.6563 926976.625 275252.25 112296.4141 536255.5625 415298.6875 128584.1172 253467.4844 208977.1406 463237.6563 135230.1719 131345.2031 144730.5313 111444.6875 128778.2969 168912.1719 250888.2344 211107.8281 160289.3594 210326.125 88913.9453 296479.5938 167764.5156 286313 170601.3906 161621.9688 169110.4844 212769.8125 isoleucylglycine 103782.5156 92911.6953 110433.4453 96845.1406 112915.0156 87856.7969 52868.5352 77072.1016 62507.4648 82151.3281 74984.6172 88376.3359 42361.8516 71120.4375 81869.5625 89390.9453 113237.5 203034 61277.7422 51826.2578 88139.6641 65746.1641 107241.1797 96001.6406 50321.1836 77200.2266 198343.0625 57946.9531 41636.9688 82232.3516 53095.3242 114180.1094 113349.2969 159760.7344 85991.1719 67660.6406 119441.4453 138878.4219 44082.3906 69287.5625 138163.25 121022.5 76939.1797 193562.9844 133574.5313 53849.5586 122521.1797 118749.6641 138371.0625 184891.9688 154376.3594 63621.4102 195071.9531 114583.1328 89836.6328 57220.4258 143970.7656 74720.6406 35307.4727 126430.2891 65729.4922 139781.7656 161904.3906 141586.5469 124804.3047 249705.0469 160635.0625 72805.3984 56757.0586 161247.2656 79711.4141 37924.8828 75595.8906 70930.0547 85139.7969 119074.0703 201913.4688 69640.8438 129097.2266 117097.7422 201493.5469 106919.3984 166851.8125 595319 163351 165418.625 189941.375 69296.0391 72106.4922 290000.6563 171507.375 82285.9766 134541.2813 130200.6484 144650.0156 70097.0625 81551.1328 82589.5078 96881.3984 525249.125 72091.6563 34818.6641 118439.4844 98911.3672 113161.0469 113237.5 77114.6484 141136.2813 126592.2422 117549.6094 214841.2188 96907.9531 196802.5469 282470.7188 208716.5156 161171.5781 253687.2344 94219.2813 69911.0781 201348.9844 143958.5313 88889.9922 60290.7031 129326.5859 73528.2656 678554.4375 337090.9688 136417.4375 78016.6172 49542.7148 201027.9844 154336.4063 141241.6406 277600.6563 119780.3906 139753.6875 227247.8125 68165.2344 113559.9766 73887.5234 105313.0234 95924.0391 124448.5078 323268.5625 74649.9375 361265.5938 108035.5156 247887.1406 91787.1563 84577.25 66736.3594 113125.7031 227166.3125 224433.1875 41279.3477 288132.125 244716.6094 188337.7188 323511.0938 124002.2891 123937.5078 33724.4023 202254.75 234249.1094 N-palmitoyltaurine 175713.7031 252999.2813 351171.0313 86441.4531 119123.8359 429691.5938 115925.5625 61632.418 93680.6875 447866.25 254203.7188 488507.4063 117840.2266 209882.5156 338273.625 162398 228922.75 627367.8125 86271.4141 86346.9844 193074.2656 69579.4922 275859.5 163189.1719 173826 550786.875 120009.0469 103177.1406 190854.7813 153776.9688 206447.9375 493209.1875 202807.2656 588765.8125 159911.3281 119658.8281 166852.8594 301310.2813 430421.125 94446.4063 111482.1172 41490.7578 115816.2734 120477.4922 79507.7266 245737.7969 126236.875 271362.5625 199595.8281 1593664.5 144207.6094 456496.875 257948.3906 88937.1328 171377.6563 187122.0469 428339.4688 116968.3047 1506311.25 53124.1758 1199076.375 176274.3438 188729.6563 653373.0625 98548.9219 80763.6484 663631.25 621260.125 454590.25 155194.9219 161816.9844 173826 163041.875 141676.875 31424.6855 440596.7188 285354.9063 73066.9609 324311.9063 525010.375 387839.625 100684.4297 198489.2188 103178.7891 249586.8906 66460.8594 504104.2813 1056489.375 133415.8594 229362.9219 206132.7344 146547.6563 96539.6094 160622.2969 127782.5625 72037.9688 106562.3359 236404.5781 350661 276482.9688 42973.5742 112282.4141 173415.5 107714 335561.4688 277255.0938 174236.5 424936 122608.6719 249424.4219 381998.0625 95080.5234 127597.4688 114926.2813 173826 40670.4102 207375.0313 150939.25 114150.3438 N-stearoyltaurine 103027.8047 101703.5313 169762.0156 70266.5625 106585.5547 175975.0313 428148.1563 133570.1719 82081.8516 158885.25 61805.3047 121223.2578 247850.4219 73865.5078 232459.0625 97419.4375 179715.2188 124080.8438 96697.1563 192512.5781 278462.1875 88876.6563 193151.75 82490.3906 74660.5703 43340.4297 138029.5938 126792.8984 124583.1641 68053.1563 209388.625 114398.2266 69858.2578 129439.9922 91672.8438 115834.5703 92273.0859 89479.8203 99209.6172 74004.1016 154263.0938 78596.8281 94004.4766 98288.5625 96972.4297 89704.8516 50831.2578 73917.2734 74839.1641 107305.3359 125688.3438 152013.9063 101040.2891 377351.7188 64912.4414 112320.9688 68622.8906 46031.6641 116420.6875 60889.3906 116550.0938 92492.4141 505750 74681.8594 86208.4453 725702.875 150878.9688 86775.9141 90691.4531 171550.75 55548.2148 282053.8438 111846.0859 131451.625 161355.7969 99737.6094 31162.6719 93415.4297 80286.5625 93306.5625 98903.9375 84841.3594 47998.4414 110437.6016 112622.9609 137094.5 106957.5859 97854 64583.5898 51905.9531 81836.5234 235237.5625 63423.875 76849.3984 114165.7578 60817.9961 146743.125 48612.2578 262995.8438 284239.5625 43241.1719 43665.1875 50792.3828 102508.5313 136188.1563 65757.6719 82856.0625 141613.2188 71993.75 73632.7969 105047.3672 153964.2031 30156.4805 108676.5391 66942.9063 112570.2813 56431.6289 79789.6094 115971.4922 115254.0781 77525.1797 86724.1484 70982.0469 87507.9531 104035.1641 230550.0156 45627.5508 50723.7344 137889.3906 96804.0625 112823.3203 74787.2656 83826.2344 beta-citrylglutamate 222156.4375 239542.375 183912.0469 332786.4688 170223.0469 490965.875 181669.5469 217411.5625 134991.6875 320706.0938 325429.6875 445329.6875 114159.9375 147980.7656 241233.625 215031.9531 140068.4219 214788.9688 156537.8125 185994.6563 114521.9766 308291.2813 229438.3125 189465.3906 202220.625 158581.7656 280248.7188 205302.375 240032.3906 220923.8438 246241.5781 109387.9531 157430.25 128341.5313 289377.9688 132722.5313 217541.5781 347282.2188 192579.4688 398877 125129.3906 234085.3906 162624.2031 171102.0938 193627.0625 193770.875 555167 106743.7656 191048.7656 320100.5 1537512.25 1870301.375 309868.2188 471754.2188 2319368.5 636184.6875 200211.6094 370988.1875 237762.0625 771155.3125 1194231.125 481790.3438 5013530 185613.875 2806263 291760.7813 636428.625 169497.7188 639624.6875 317128.5625 1644026.125 258493.5313 256923.0313 273444.2813 1201486.625 1204717.5 230327.7344 300788.7813 663228 844011.5625 468788.0938 514771.0313 585439.4375 432384.375 938749 1195339.875 132599.9219 554111.625 259649.2969 275537.1563 589334.4375 224719.6875 2618206 1363403.25 404279.3125 2063891.875 1863753.25 500018.7188 1697068.375 386005.375 438667.9063 947362 616593.875 370356.4688 451918.625 711119.1875 414300.75 264953.625 116069.7891 354566.5938 442362.8438 590157.3125 215483.0781 398877 362014.8438 339501.6563 418684.1875 8587952 632162.625 532256.875 1477163.875 2047867.875 186262.75 885812.6875 2441421.25 1223174.5 773782.875 393073.75 334760.25 1283698.25 1824862.25 315012.1875 383692.9063 1393575.375 523159.4688 298948.4375 944112.3125 239352.3438 206598.0781 2249865.5 809384 581391.5 2721880.75 2090494.25 147364.0625 144228.6719 273035.6875 459861 929248.8125 896921.9375 291378.1563 1328565.25 190574.8438 1255276.875 2240205.5 413295.5 417214.3125 668532.875 530915.1875 114745.2891 269715.875 322590.6563 571823.9375 544107.4375 746491.5625 772376.8125 1077048.625 360192.3438 1108304.25 507281.4063 254818.1563 194191.7813 1672215.375 324627.5 161264.875 212220.9688 398877 372607.125 201577.0469 815935.4375 458393.5625 458650.625 349941.6563 1108681.375 1343193.375 214366.2344 496627.6875 647083.125 2128785.25 399250.5 505572.375 431113.3125 334172.375 2367042.25 645422.25 905597.6875 266650.7188 1453529 3823634 163547.1719 896129.875 617551.6875 5122360 512859.125 214067.9531 497524.9375 823574.625 609730.375 650014 1254642.625 2980798.75 339567.3438 210870.4844 252367.9844 280491.2188 598923.25 271109.6563 4527674 664307.75 1040553.5 508113.5938 453658.75 6230140 2145365 713129.3125 178879.5313 449465.1875 329710.25 374677.5 306498.0625 621010.5 4295968 323108.6875 1108054.875 907922.125 1217427.125 193949.0313 1023674.25 610301.6875 162861.0469 565227.8125 424086.4063 306693.2813 255286.9531 175222.9219 153856.2969 393589.5313 991357.25 466158.2188 367307.0313 92297.1328 273239.3438 497230.3438 583738.625 458473.25 2811895.25 1069590.125 313901.1875 248519.4063 226734.4375 2638758 412429.3125 178923.2344 3502499.5 310680.625 520230.8438 179330.4375 146402.1719 694171.125 382084.8125 247087.125 156902.6719 1169630.875 252195.0781 436091.0313 353226.1563 233972.375 313344.7813 110121.9688 410006.375 357205.5625 185123.7031 387747.625 327405.5938 516120.2188 522787.0938 1551994.25 150254.0781 1114067.5 538470.8125 104487.5938 248173.2188 217641.5781 550883.75 184763.5781 398877 346119.9375 210225.0156 617693.5 373969.5313 equol sulfate 153337.2969 78277.2422 487146.625 208866.0625 2522243.75 38577.8828 2505817 2117651.25 259375.5 6036660 29042.627 44159.4805 259375.5 58507.6094 60769.3594 604331.625 1248582.375 89493.25 151591.8438 3287696.25 2386021 105057.125 444412.0938 147576.5 259375.5 153660.8438 50930.0625 128666.5938 80185.2813 2474609.75 121830.1719 6492528.5 2468544.75 1087984 2029222.75 873562.3125 106084.6172 1014909.875 259375.5 336025.5313 81339.6563 437411.3438 126786.3984 153249.1094 652711.375 1386654.375 dihydroferulate 900712.5625 311901.875 207404.7344 163819.3594 64654.6992 1799971.75 1101416.25 764775 421919.75 249074.1875 1252616.125 344529.6875 127429 195734.25 923094 318763.125 126891.2734 298570.3125 1231231.875 2297913 49925.8438 107565.2422 1208197.125 939952.875 91183.5 260388.1875 1799589 88252.8359 70706.0391 133670.6406 171593.1563 58428.7305 1488855.875 130019.6875 176904.25 57854.0781 105699.9609 124838.3125 163969.2656 49496.1055 58366.2227 131082.3906 67351.4688 110962.7813 98212.5547 36470.1797 157957.3125 243924.6094 876591.1875 128419.2188 856941.1875 51895.6758 95206.0313 65264.9805 126438.7813 41595.5156 106493.8906 129638.2031 61927.1992 105809.1719 216414.4375 110357.3516 94028.1953 194343.7813 76682.9219 127966.7188 153781.5938 353701.6563 91607.625 271470.5 125751.6172 120110.3047 105416.75 211063.8438 107800.3984 236691.4219 31444.9258 44811.0273 43072.6445 160151.6406 307006.9688 35060.5313 27301.2266 75141.9766 98358.7578 101240.9531 235549.625 90806.6563 60654.6992 41284.4609 95866.5156 124319.1328 195840.9688 275411.625 233446.0781 84781.7188 45707.5039 127433.4219 133861.4063 182639.7344 79617.9375 128692.9141 138910.5625 309869.7813 127424.5703 49258.1797 74346.7891 122172.0781 55104.5625 77997.7734 196595.8281 108171.0781 131157.125 pregnanediol-3-glucuronide 84658.0391 234473.3281 73601.6953 2920226.25 76809.5391 44179.2266 225970.5313 69149.625 1462355.5 445947.625 659103.125 270662.4688 140166 102636.3047 72013.0859 119333.0313 110650.6328 420447.8125 417743.3125 472594.8125 474499.2188 334498.1875 312352.75 130075.1484 138761.7813 209429.2344 256761.5625 195129.5156 118611.9531 1051907.25 166373 274334.6563 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211152.1875 2564276.75 471788.875 540348.6875 2459635.25 2977854.75 7104532 3731141.25 847834.375 120297.6953 184952.4219 1176473.75 3489165 539278.5 98494.4688 99053.5234 1381127.875 1558840.625 125440.6016 487278.5938 95178.8984 92060.4375 320921.75 633855.375 687150.0625 211961.375 19048826 907778.0625 259821.125 969936.4375 432456.1875 148066.7969 10779804 121495.0781 2449254.5 651660.875 19337222 3065046 N-palmitoylglycine 526761.3125 1214448.25 571159 646036.125 250774.1094 770898.1875 264889.7188 416813.7813 255483.875 526431.5 847771.875 611571.3125 356560.6875 524002.3125 317919.75 543021.3125 246799.375 545191.75 757103.6875 255660.9531 1326134.5 502843 384085.9375 455151.5313 683752.375 876975.5 1376814.875 619744.3125 685151.625 367876.75 283094.0313 148964.4375 743440.125 379189.5938 291301.25 531760.5 328618.5625 1478070 308749.6875 316520.8125 330261.6563 517564.0938 507182.5 374809.9688 864717.9375 281247.4375 484963.3125 804802.5625 408700.375 229090.5781 972626.875 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801851.0625 5340918.5 1185155.875 275871.0938 535887.6875 2117372.25 792708.25 305189.1875 515796.7188 825383.9375 1038298.875 642878.0625 854915.3125 213823.25 1459865.625 867934.75 867633.25 424840.125 310521.6875 531929.4375 355056.5313 480574 332766.5625 405827.0938 233881.8906 1137523 658036.0625 1497982.125 334618.25 1001492.063 2177200.5 1242967.125 390618.4063 1187055.5 1304880.375 1585857 379477.1563 177300.375 988255.5 879708.625 1346861.25 646924 1070688.625 965039.3125 568277.625 312695.6563 1410191 1279162.5 2055616.75 498039.7813 110159.9219 371726.4375 867784 561842.9375 414627.7188 355308.9063 787232.8125 1175218.5 732042.0625 949763.5625 288048.25 1855181.25 314248.5625 639510.75 270125.4688 768416.0625 1733556.625 1030083.563 1305896.375 307058.5625 2288768.5 1183658.25 291338.0625 695714.0625 526712.0625 451609.125 475485.7813 536368.25 669078.5625 363796.7813 990931.375 2495237.25 50898.2539 1036778.688 1241522.875 1495363.125 376826.4688 807190.8125 997682.6875 278367.1563 5-hydroxymethyl-2-furoic acid 396404.9063 1530456.375 193845.2031 251086.6875 456018.0313 171202.1719 208670.1563 318934.375 469352.0625 418000.4375 833801.5625 172694.2969 445123.5 394889 250319.5 301075.4688 358573.9063 1459797 377997.5938 446750.4375 393373.0938 488752.5938 795609.75 224415.8281 400588.4375 656685.9375 500009.2188 426269.8125 275383.75 253235.9531 2735022.25 524364.125 222577.125 94037.1094 662032.75 1120679 196642.25 404840.4375 188025.9688 320425.9375 498310.875 199083.2813 358331.25 403889.5313 550328.125 149732.7969 385888.4375 128594.5703 331471.9063 155937.5625 528000.75 669709.375 952614.4375 879872.0625 348933.1875 384482.2188 407337.0938 885762.6875 207835.0313 909075.375 514599.5625 631555.75 426435.9375 254130.0781 679283.8125 394889 464520.3438 514047.1563 504180.3438 661231.8125 133606.3594 198200.7031 263691.7813 331373.7813 370819.6875 487777.5625 308017.2188 338569.9063 270090.4375 159995.3438 glycohyocholate 156582.0625 73133.0391 608537 158322.0625 436066.625 102372.9141 113048.3828 113144.4766 116255.5391 118392 1136183.375 107929.2969 45243.2773 73355.1484 146195.0313 410632.0938 2740957.75 1194705.375 91619.0703 128253.3828 134297.8125 1128612.375 92465.7891 119675.7813 189546.9844 232374.5938 833319.9375 126945.1953 137043.5 235560.8281 45657.1328 177551.7656 668922.5625 406134.9688 138071.75 115619.5 579256.1875 1171824.75 31431340 1469899.5 229757.4063 1125766.25 608537 4097667.75 735876.3125 4720521 110264.2031 561673.625 613569.0625 112694.3672 1197219.625 1638301.125 3384522.5 103546.5469 25024260 93742.7344 697913.625 1188885.25 2028792.875 45753.125 1582188.125 2028554.75 98512.7734 1629456.25 6123512.5 185536.2656 1274991 967675.125 46116792 1243406.75 890583.875 4462569.5 217766.6094 428534.5625 2403929.75 1526990.125 407730.7188 340140.3438 114811.2969 431175 9184608 10168879 174154.8438 310954.375 507723.0313 264323.7188 223459.2813 1443878.625 96542 400342.8125 5905870.5 1289096.125 179251.3906 1152136.875 50843.7813 343700.4688 665820.5625 48962.2422 2263933.75 4081722.5 753407.875 235234.8438 3216472.25 980646.875 2086706 80949.4219 5626563 40221.2578 2369782.5 61349.625 341484.5625 114714.8828 3180491.75 623971.8125 340090.5313 166481.1563 447683 2698688 593102.1875 491391.5938 26323372 497201.5313 362906.3438 320778.5625 2623542.25 518623.1875 1021076.625 164540.9688 1134895.875 3289376 1499046.5 44923.8398 1597376.375 1163402.75 756347.4375 711638.125 42903.7773 298093.5938 1179693.625 3001630.5 1763793.75 2010617.125 4937340 1791996.75 7937477.5 608537 350827.125 591746.0625 3902765 268480.9063 265722.6875 298192.5625 2389130.5 2786913.75 2834879.5 532849 2219516.25 8522892 798214.5 380783.9375 4989959 2080716.75 890368.5 300410.5 542305.75 122523.3047 563135.9375 543895 381276.9063 272171.6563 692449.6875 287169.3125 4301392 696317.3125 749179.875 3714497.5 622077.9375 1792848.75 4018300.75 558080.125 1174979.5 497023.0313 483241.4688 104162.3672 1060263 1188055.875 1032255.375 8475141 3703389 560657.0625 350799.625 550671.125 584991.75 2159885.25 1120884 3083685 12045863 2233755.75 1872454.25 148123.0313 1815661.25 3011984.75 65486.9727 939850.875 594996.0625 1185322.125 129740.0547 206502.5625 7612543 3448070.5 643927.4375 109749.0703 65168504 1119092.625 53908.6094 60757.7305 111545.625 2037747.375 490707.9063 328912.4688 833179.6875 534820.5625 19835762 20943598 1005718.75 245335.5313 95172.3984 815861.75 644129.625 270246.25 43151.3555 101703.0781 46260.6133 5763828.5 320994.5 1091406.75 1181440.375 60832.9141 170459.4219 447879.375 5658107 1575860.125 14526941 2102342.75 93233.7188 taurohyocholate* 71516.6875 259356.6406 575301.375 160141.3594 60892.7031 2800562 60061692 815459.9375 1136902.75 724683.6875 4697284 496236.4688 60570424 219528.0938 1348274.625 217867.0313 3294957 874277 14234593 275365.3438 241067.6406 1119154 462755.0938 3539726.5 301767.1875 911719.375 28597814 331321.8125 372019.5625 1318636.25 1393911.375 319404.1875 10460463 90558.1953 320967.4688 5502508 206205.8125 651133.9375 836834.5625 2074395.375 595946.8125 2433267.75 5266337.5 1766810.125 392293.2188 152859.4219 7843891.5 16662.1973 567679.6875 1034585.438 1225469.25 246178.1406 3969929.25 1020059 3724263.5 580801.3125 874277 302893.0313 4202665.5 1790321 2383527.25 336108.375 235223.7344 1043364.063 596549.1875 89695.7891 712090.4375 1482864.5 2174747.5 874277 833738.4375 225824.3281 1204380.25 549772.6875 17213720 395879.7813 302720.2188 1296315.375 575502.25 9810942 2369750.25 3370219 930766.125 1611407.25 136334.5 5175964 558440.625 11862073 1087635 319639.5625 19227938 3700098.5 723015.6875 1204777.75 13888091 223235.1563 128254.3984 682281.125 3275296.25 1066272.875 87926.9922 2-hydroxydecanoate 1180778.5 2093788 2737373 1469172.375 703402.875 1145567.5 3882758 1423595.5 2650244 10529735 3864918.75 1169939.75 2842279 649477.8125 2514616.25 1211392.75 7525878.5 1796727.125 2805776 1230766.375 2328189 1814830.75 2236745 8060591 1163875.125 4689331 1656267.125 1161817.75 2003313.125 507643.2813 3017959 1464634.875 1822415.375 2179226.75 1917854.25 1615682.75 2389320.75 5367930 1142474.875 2143805.25 1345143.75 1163173 1959939.875 1900815.875 2498019.25 992608.5 1298741.375 1835420.75 817229.625 793691.6875 852175.8125 11889720 6012067 1097750.375 1722872.5 1995732.5 760577.5625 1507982.375 1401264.25 1012344.875 928322.75 1895886.875 803914.9375 528490.9375 556907.375 499124.2813 878047.125 1775715.75 1529593.875 1408429.875 1163173 708461.3125 1391282.375 380830.5 313702.1563 836489.125 1114790.25 464855.4063 606668.875 1326313 2529415 441990 557077.125 3081411.25 2214865.75 342115.4688 786955.375 603949.9375 920331 1146558.375 1163115 1559711.125 584388.4375 572823.6875 431698.2188 5803849 3965570 943590.5 2352039.25 1324340 828286.375 680730.0625 840782 847546.875 824362.5 1589218.375 1891951.75 654897.6875 866732.375 2133044.75 935749.625 1249637.875 1092419.75 1102519.5 1075413.25 911943.25 916873.1875 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2312110.75 1860040.5 464890.5313 1309013.25 595823.6875 805711.375 915991.125 1163173 759614.9375 1394122.125 1247325.25 2416576 1136022.75 630082.6875 689650.25 942032.5625 1350299.375 351642.25 699824.5625 5170657 993143.25 965413.875 3419942.75 1990338 2035964 2898133.5 1506663.875 1571476.25 409417.2188 2594492.25 559987.75 3167612.75 751276.8125 1289113 957518.375 1205596.625 3239862 1649794.875 1368371.875 353387.1875 488218.8125 2677907 405358.9063 2211996.75 1204167.625 861567.25 379073.5 679361.0625 1278530.25 1262649.25 1773612.125 688575.6875 907962.1875 2232301.75 635193.125 943809.4375 5119286.5 593233.1875 6193894 729504.5625 318040.9375 1600665.875 673713.1875 536859 1177080.75 832629.75 5334517.5 582960.75 1256480.75 4789478 1704202.125 588567.8125 624270.9375 962550.125 1277270.625 1096772.5 858289.4375 1183512.125 676149.9375 1858562.625 1873292.25 1066720.375 1429918.375 653184.375 1970140.25 657988.25 4625388.5 1070948.875 931420.1875 874232.375 3-methyl catechol sulfate (2) 191588.9844 341593.0313 111194 40494.8477 170891.1563 43856.1484 617420.4375 150949.9844 200222.0469 111194 126168.4688 44736.5 93481.8359 134379.4063 177812.9063 298319.5938 111194 69085.0547 174871.5 111194 127906.7266 951740.125 85402.2188 195065.1563 291353.75 155514.0938 55916.918 593938.3125 111194 60725.3438 78831.2656 66330.0625 100303.7656 61353.1328 11370.0391 87182.3125 21075.291 247491.125 27687.9941 34831.6055 15538.0117 23052.377 208052.7344 89989.0469 153988.3906 174319.7813 33587.1563 45994.8438 153160.9531 29868.6465 110349.75 137367.6563 47349.9375 164963.9531 102978.1563 411966.3125 171652.2969 122584.4063 50263.793 4-methylcatechol sulfate 2593352.5 19824972 23178746 10815484 10961664 4833002 1775409.875 2304205.25 10577537 34014736 106005144 35170172 40360640 28242322 460370.7813 1237485.375 18038208 11930431 1352418.875 18935010 10809060 14212336 5662743.5 1724182.25 39987456 9391109 17188814 1109093.375 38964292 15014505 576337.25 7328967.5 17821642 15764893 27229160 258864.1719 5178589 16484626 73649256 46223244 9273195 32756646 8531872 859063.3125 26402592 39025628 4988951.5 31697726 8104530.5 48308424 8459097 2754754.75 1211561 32550782 7770578.5 61776524 2369454 2691995.25 41764.4141 8604645 706020.5625 157431.375 818286.625 10327071 324745600 633876.0625 76179480 163372.9063 10414952 5140652 5685569.5 19475710 118380.6563 1981001.5 26482664 14026590 1156330.75 40718628 12663446 4320561 25961996 4431053 886384.75 27326490 1421452 3049081.5 320472.1875 30254004 10399064 10912033 5694978 8668456 12239597 228098.0625 2391967.75 155239632 13392195 8073521 109100600 51338.5313 759502.0625 78610.2031 173264.9844 757615.5625 6049335.5 1120226.375 7060682 6091655 8317432.5 8827325 74194.2656 15955390 371311.375 13301986 15946091 37873576 4616034 26213530 31865.5508 84529008 1647647.625 8531872 56219420 2384527.75 3816441 2225515 80156936 27491560 951074.5 69525912 6518905.5 11802676 755545.8125 34013004 41230628 1204345.25 38391008 40143440 629623.5 1796864 9789193 15296694 126676.8281 1004926.813 7672634.5 23359704 3391768.75 652277.8125 11737910 3311409.25 14805556 30956956 16092361 34869984 37691680 969276.1875 2110626 388345.7188 32648718 1459525.5 144514848 16800238 1905399.375 500770.4375 1370629 115612.4609 1965637.75 6972799.5 1262998.25 29042586 17268900 8472482 754492.8125 24703.4551 6520004.5 1275695.25 9486419 60198832 97183360 1297958.375 4447622.5 5924391 94918.8906 10794897 34004008 5866732.5 7230992.5 83879.7266 705236.8125 785098.0625 11323181 4976430 23585722 41698732 1676228.75 85051120 18748070 2679162.5 119364.4609 165302.5469 1659535.5 845389.9375 45018.5391 30129846 58084.418 37112308 4361825 4314751 204090.9063 3597215 152021.6563 8591261 12007061 138095.3125 4009011 76647824 3670022.25 970407.8125 505302.1875 5787047.5 18213790 43486316 47941064 4377919.5 7921028 1513774.5 73648.4453 36801740 12297873 7931306 14567406 65358532 297607232 8286287.5 5386863.5 13039709 13023378 88479440 18582802 18404316 51400308 2600150.5 57101272 101752944 6261004.5 39199504 170644576 97650480 27196732 22234264 5889724.5 179676240 13548624 26445228 27678258 5617918.5 10206706 29651614 33068494 4431909 1220466.25 59902332 14481027 10760680 1335465.875 5725774.5 63025256 195639.1094 5265446.5 3345376.75 15911844 27341350 398819.9688 1259913 2482392.75 6383901.5 26568802 10310897 19399712 126983232 80420320 16933310 88040672 48512616 7717045.5 37751900 4468494.5 95280336 518680.375 21723114 5286992 59239.0391 109666640 72739616 3-methyl catechol sulfate (1) 8411252 13675816 283722.625 4594215 169357 2086906.75 2903496.25 1189733.375 239134.2969 11633354 2414949.75 503558.8125 4998287.5 379188.5938 690174.75 516215.3125 2771454.5 1804175.125 1466369.5 2211071 2696155.25 2932953 218186.5625 1933505.25 2385492.75 2783703.75 562780.1875 1720266.875 2656275.75 96581.2578 378571.5 2410200.75 2125137.25 13623380 2164910.25 78094.0313 388427.4375 4629695 3629903.25 1335433.5 769543.1875 339739.5 5478710.5 169770.2969 93756.5547 1807083.25 147246.8438 291489.1875 177363.2813 377828.1563 772176.5 1951738.125 258558.1094 119717.4141 151052.2656 737406.4375 63139.5313 138707.5938 2635649.25 584269.9375 429408.4375 52965.6523 4051335.5 1895375.875 271784.3438 25973.1094 2429237 51502.332 105711.4453 378047.2813 552289.1875 179996.9063 739345.875 59701.3203 31855.3945 50916.6914 744270 75164.9531 27244.7598 76381.7656 35678.6211 3273574.25 425692.25 61704.5 58137.8828 250035.9375 55137.2422 19183.3906 147484.4688 991300.1875 203866.4688 295646.6563 55791.1758 343549.25 25747.5449 106301.2344 807575.25 127140.1484 42408.332 136693.5469 193571.1563 1513198.125 221388.125 182647.8125 281831.3125 255365.3125 165817.4844 619909.6875 293334 357345.875 117139.7813 83358.8047 94918.3359 158115.9063 148586.2969 107170.2031 364210.4375 339739.5 1319457 904115.1875 54614.168 1951803.25 102365.9688 120796.0781 70986.4063 231790.8281 1987040.75 686329.5625 29221.7422 131052.6641 200157.5938 339914.625 76950.8672 199982.8906 4682371.5 339564.375 121119.4609 1185221.75 145418.2813 37126.4805 999980.8125 62099.7734 1014842.813 476316.0625 164388.4688 154243.5938 394587.5625 383105.5 2254641 927267.4375 1277991.875 70634.4688 217882.1406 249517.8906 94111.3047 19922.6934 191710.2344 251684.9688 21348.248 2729683.75 3174831 214765.9375 27083.2383 100627.4219 343982.8125 937880.5 92292.3906 1422966.75 633569.8125 1285206.625 2219773.75 355040.4063 33277.0039 398636.125 1671969.25 237109.3594 111389.7578 112352.9375 516068.2813 210273.2969 195227.1094 335929.7188 2881944.25 585320 100904.2188 200782.0781 797529.8125 2840101.5 195193.5156 582861.625 2193388.5 56046.2773 80509.7188 5646985.5 5465432.5 1007569.75 123923.25 438962.3125 39500.168 4879595 121307.7969 681352.9375 138584.6719 94134.9922 395756.375 177970.9844 234190.8438 223121.2344 9112504 542303.375 30839.7344 224733.0156 1064792 3408883.5 110223.7891 580177.8125 45986.5664 526217.9375 1426042 539423.75 3b-hydroxy-5-cholenoic acid 95553.4297 64297.418 181280.4844 69237.4609 142948.7813 65337.75 79114.4688 54755.5898 34765.832 49834.4844 43160.4609 91582.2344 60423.4492 69904.3359 123186.625 137184.9688 46796.2266 43209.9844 48969.1094 38143.3477 87502.8672 115066.5234 53822.8008 187999.75 32656.7578 58643.8398 77996.125 44413.5508 297204.25 72505.6016 106227.9688 84022.1953 488617.4688 92572.0781 78659.4453 175216.3594 237778.0313 138285.1094 99796.5469 209505.0469 37491.7461 134053.7656 131327.0156 117219.4375 104480.3594 54712.2148 197943.9375 44063.7109 227950.25 437218.8438 91795.7109 124121.4063 204338.1406 63564.418 117212.6406 107474.1953 241817.1406 57689.8867 135372.9219 89390.4453 216705.5625 107067.6484 344972.2188 191794.4688 79846.3672 529103.9375 317222.25 87006.8906 183094.5156 90337.8203 101162.9141 107610.8281 186207.8594 54486.2852 48201.6992 80189.9922 24085.4688 351940.625 68811.3438 67410.6016 52633.4297 117831.0234 50708.2031 165102.75 129704.8828 116968.875 239549.3906 129026.5938 89993.5938 285130.2188 81777.6484 71806.2344 256623.2656 105774 197128.1094 58780.5977 105774 785256.4375 145085.4844 152585.2031 29334.3809 53907.9766 393039.25 273095.9375 600184.5 52558.6992 139891.7344 124081.4219 174113.7031 90741.0547 102772.9766 206039.3438 345828.1563 144482.0625 271205 134525.4531 46978.4414 92329.8438 193548.4531 268993.3125 109883.9844 104923.4063 41127.5547 105774 192620.125 142529.2031 75710.3516 100751.3047 103937.1797 guaiacol sulfate 6595661 8155633 1530168.125 6894310.5 2148861.5 2498161.25 4082980.75 2035052.125 1465707.75 25939338 7374158.5 3637064.75 7751025.5 1203245.875 949468.0625 2714429.5 2308657.25 1936420 4965104 6502706.5 3901755.5 11717364 2954837 3588987.5 6194547 7280204 1213119.375 7580073.5 6626352.5 1264430.875 4987359 2858269.5 10417333 40255308 3644803 417900.6563 2420143 21755860 7645915.5 4971121.5 4509710 6595136 14199101 938427.0625 21823724 6087361.5 3512326.25 2392377 1775963 2805821 33343242 8900181 670836.375 1009680.125 6892960.5 14618826 227136.0625 246231.4063 759213.125 12685446 574021.5 14385.8623 579664.1875 452430.3125 35133208 5018461.5 37714976 498019.4063 465607.3438 639579.5 3677599 223734.3438 92651.9609 125713.6094 56203512 1967393 279841.1563 9023905 612211.9375 28441258 19111744 3121312.75 1179941.875 2766764.75 267435.8438 828275.3125 1233982.125 13474719 32184.4707 969058.9375 209490.125 377428.8438 4834936 631498.625 81363.5313 9375457 109972912 8539893 1619196.75 17416816 256950.0781 930974 1862116.125 143064.7031 5931274.5 682835.9375 123044.8281 421498.9688 3633704.25 2804814.75 3322910.5 2011757.125 651527.5625 4773514.5 585187.75 135829.7969 656490.5625 107734752 294085.4063 1272760.125 1799752.25 86566.1406 2836882.25 8419140 6228417.5 15292628 282475.6875 50871672 995187.5625 2072789.625 414030.6563 304719.0313 2209000.25 97666.7656 4088950.5 53026540 1632949 1499424.25 735366.625 2292412 263498.5313 637583.8125 5510126.5 4567421 442231.0313 3051538.5 155590.4219 3868702.5 7890256.5 6933221 99743.8594 769045.625 3528874.25 510538.1875 1228540.5 18753996 396974.7813 802747.9375 301114.9375 39416.7578 340129.5 153990.9063 249797.8906 48809600 53889.2344 1716224.75 2633481.75 4662110 503238.625 498888.4688 9078980 760685.5 36707624 553930.625 265373.375 3913500 173673.5781 2084137.125 9705632 724694.375 509594.1875 94778.8516 2292412 31750196 670488.9375 20449244 10633587 45310.9648 70662368 755023.4375 138489.3594 2990086.25 85464.9219 192624.625 109520.8359 17415054 96426.4844 5199856 362723.4688 1795199.5 1448437.75 2789624.75 114081.3438 1063113.375 8243703.5 280076.0625 1729270.875 4686278.5 198702.75 10875981 10949491 588740.9375 498947.9375 12275442 11119513 2655535 3675109.5 7396721.5 275421.2813 10133825 26624728 6315126 80600.3906 21079134 41394504 205386.5313 427955.5 4054098.75 1191838.25 27041258 9009937 305516.875 501493.9063 10946468 40323396 130087184 351753.1875 7031748.5 180163824 145612112 305184.9375 6662100.5 11168332 113787208 1711043.5 3247923.5 24992592 361137.4375 208777.8906 15076699 5852407.5 346779.1875 473795.9375 5504600 4186620 536888.75 19893590 129757.6172 24275544 1528191.625 217753 27558350 594834.25 349545.9375 2266654.5 816920 252784.0313 2500451.5 9792460 2318169.5 29558838 29467362 270831.7188 3939592.5 2292412 385865.2188 28035588 266703.7188 133498192 64399.457 4484127 1273558.375 127639.875 159437856 9241459 2-aminooctanoate 63327.3086 69210.6016 195233.1094 19967.9082 41112.6445 154740.6875 59252.3242 89965.5859 239611.1406 912803.4375 126893.0781 706836.8125 107608.3359 230941.8281 34453.4219 123730.5313 141674.2188 199473.5781 53750.8398 121466.5781 213131.1719 55861.8789 285304.5625 49924.5859 105340.0781 108771.8906 83492.5938 294525.25 48145.4141 140745.6563 54704.0859 111373.25 250333.2656 175914.3594 131460.5156 135504.1563 138636.0469 83600.2578 95067.5078 216403.125 60817.8125 41313.8438 63824.0977 116528.2266 77587.8672 72745.7578 88822.3672 117298.2266 37105.6641 22518.4121 215486.9531 160433.0781 116575.6328 23827.6016 126717.3984 30331.9785 215160.2969 44895.9766 28294.8008 13780.8613 41366.7031 53825.8125 122532.0313 29046.9746 37110.1797 35207.3672 50414.0508 69430.5938 74797.9688 46693.9531 34666.7227 31549.5684 360730.3125 23378.6543 121600.6875 113836.3125 23369.1504 233376.8438 150220 237137.0625 56457.2344 28754.4785 96889.4219 28020.5938 53374.9258 99061.5 30280.3203 31357.3848 167613.5469 122918.5 155063.6094 36607.5508 47311.6836 137184.3438 61560.625 166112 38595.8984 116157.2813 427467.1875 37308.6992 58028.4805 72086.2969 47413.0508 40934.6016 38513.8438 70835 160817.7813 49003.4297 44738.1797 72140.3281 70835 176982.2656 86619.6484 31760.377 58237.543 30585.791 46466.4648 32434.4785 27267.4648 38251.2461 50255.9805 332037.3125 174891.0938 125053.1484 157786.3594 120167.6094 25487.8359 116180.2266 24553.791 54933.957 229796.9219 54043.5625 107749.5859 25834.0996 54162.8633 40460.6523 55720.5703 32913.4609 47189.0625 218393.6719 150333.4219 83861.1719 31449.0293 54369.457 95530.1641 327621.6563 34454.4766 140722.8125 38494.5273 148818.7656 83939.6172 56790.668 224152.2969 18238.5742 123605.0391 103148.2422 185245.0938 86110.1094 50225.9141 36419.4258 43539.2148 135352.2813 37047.8828 53841.6563 65602.7578 125269.3125 52684.6914 112494.4844 63149.2695 68901.9297 32713.8184 32571.0918 48579.8711 39674.0234 69583.7031 103075.1563 298701.9063 63569.25 93285.8672 33344.5391 95082.875 49846.3203 70835 55364.4063 97140.5625 187758.9219 54201.1563 55321.1367 94945.5703 72459.3984 87386.5391 67994.7422 231408.5 119580.6563 64037.875 344582.7813 41610.1875 151885.6406 36611.5078 74146.3516 49138.625 gamma-CEHC glucuronide* 32437.8652 19285.8496 35241.8672 95566.2031 61348.6172 40441.7656 16309.0342 59788.1484 25527.4707 99957.5 195411.0469 26577.2324 66686.75 114319.2266 50524.7461 31920.3789 100427.7344 99487.2734 15220.1445 32229.5547 257539.2344 209071.8594 346455.3438 145547.1094 624457 198563.8438 46749.8594 3151488.75 62562.6094 25800.3633 655390.25 700571 126380.2422 97332.7188 64907.2813 63961.2109 446032.4688 102582.2813 62963.8594 77187.0078 84901.7266 48633.0313 43889.8438 48007.4414 221658.0156 1529517 38348.0117 134293.6719 296046.5625 191229.8438 2823950.25 99957.5 697648.875 25799.6504 44349.0156 66813.6094 190065.9531 369684.3438 43653.7578 58467.457 415844.5 33070.2578 589656.1875 27904.5332 1595901.625 56582.2305 1145835.125 68633.6953 30646.9375 179060.4688 54076.7773 25017.6953 554375.9375 139185.6563 138783.5 1172945.875 38395.5234 257831.0938 37338.5625 85595.7734 813536.25 81010.8516 597111.1875 435296.1875 58420.6563 198921.4844 374051.5 146985.1719 154452.4844 1189895.875 72440.4453 58159.0547 49585.5156 131647.75 1289060.625 26016.5039 2340203.75 1255841.25 129931.3438 90387.8828 2463696.75 27435.3535 122800.6484 252127 68949.25 169252.2344 95658.3906 602013.8125 241881.1875 13780.8438 18163.7383 387166.2813 99200.0703 381976.7813 45338.2422 849522.4375 1348623.125 56359.0273 601068.1875 215247.9063 2-aminophenol sulfate 161794.7031 338304.375 301031.5625 431863.1875 78496.5703 212849.7031 245713.2344 76032.6953 184883.1563 1594160.625 370820.1563 173625.4375 318511.8438 77947.9844 81601.2969 88316.7578 76086.7578 273972.7813 577978.5625 149485.375 129112.0859 303108 138005.0156 998747.25 195520.9063 638179.875 211952.7969 80921.0469 742739.6875 133070.7656 53071.8125 170177.3906 218100.0781 440140.6563 165978.4844 164854.2656 5654991 212783.2031 225707.0781 265344.8125 213023.2188 396124.1875 526630.875 171893.6719 868260.0625 174688.7344 91942.3828 193027.5313 1436831.875 152610.7656 871977.4375 458605.625 165238.625 185500.4844 324463.0625 598030.9375 66646.4453 109101.3125 68792.7891 814343 179661.7813 390562.7813 53993.7539 1343585.75 41906.2734 4311267.5 133543.5625 661182.25 65072.7539 311405.5 75068.4063 39126.4336 42454.4766 1581948.375 265283.5313 31622.1621 627686.5625 219844 733499.6875 1327170.125 352004.0625 683166 382600.7813 95703.1563 236038.4063 58314.75 1252310.875 48791.4961 88081.0078 56344.5078 33370.8242 312598.4688 481899.625 224910.0781 341247.0938 1909554.5 482325.0625 924861.625 129012.8281 176762.9219 125225.6797 416997.0625 61446.918 46760.9922 886969.8125 469565.0625 79857.0625 40896.3672 335170.6563 513084.875 284574.6563 354740.9688 180978.1406 527329.4375 1847101.625 149268.25 84450.7344 429763.2813 4792739.5 311447.1563 486032.4688 509129.3125 116216.4766 690023.25 867270.9375 544990.625 4350993 80058.25 2424194 200710.4375 502807.25 72049.5781 193431.0469 88175.7266 1245532.125 513461.9375 278036 735660.9375 132962.0781 48239.3633 69136.5703 1002647.563 120463.0938 363408.0625 1581193.5 551569.875 1244499 813802.1875 157228.5156 217873.9844 62884.5313 467051.1563 1324319.75 3441418 145286.5313 227925.0469 45821.1563 63584.6953 172589.4063 63532.6016 57828.1367 1600950.25 32860.8281 1131825.75 381924.9375 278036 115995.9375 271450.0625 187772.125 2476308.5 263537.8125 2223747.25 358881 79292.5469 892273.6875 218240.6406 300492.3125 1940959.125 320406.3438 269734.0625 258722.1094 152733.7188 271838.7188 4639125 76679.4375 927095.4375 933910.5625 6643752 400147.9688 292157 328131.0938 87744.1328 59443.0195 3454959 278036 1362447.5 104053.6641 307502.5625 897652.125 378244.9063 108422.2891 1958205.875 222767.8438 177128.0313 352331.5313 2978167.75 840605.375 240631.4063 278036 65461.5234 173530.5938 518273.25 247131.2969 199994.5156 1005365.188 1179286.125 1091674.125 665586.1875 45547.1328 924361.4375 17995144 380489.1875 803315.0625 285029.3125 990264.75 1015452.375 116914.9063 253928.2656 341915.3438 418449.6875 2602319 144066.5781 3163353.25 8593577 99425.3828 230546.75 456965.4375 2474836.25 433890.2188 93326.0391 985679.125 105134.4141 120337.5859 1805051.625 282099.2188 79994.4375 147982.2188 313138.2188 230756.0938 152348.2031 1189877.875 104765.1797 1354237.375 91721.5703 186277.1719 3068439.5 103618.3125 385179.3438 42841.8359 439511.125 33847.3398 259449.4688 291895.7813 297998.625 246659.1719 1929945.75 47657.2461 376902.5 148038.9531 169847.1563 1699013 68004.625 1815539 354185.0938 106392.9688 30590.9395 1868223.5 1760432.375 3-acetylphenol sulfate 169453.0938 393261.2188 27830.377 173717.0156 57103.9609 215331.8281 238663.9219 161128.9375 199709.5625 755076.75 296224.4688 87129.7188 346584.125 331674.0938 53435.043 62059.8125 113895.0859 229272.25 137826.9219 242980.8281 120887.9219 202975.5625 130834.0703 143521.5156 28835.4805 69299.7734 438132.2188 289759 148535.0156 364962.9375 958415.9375 269861.5625 239017.0469 218253.9219 294256.3438 154496.0781 71244.0703 229649.2188 536999.5 28886.2461 141647.4844 39898.3672 64531.5469 37223.5039 87334.5625 30530.7871 20935.3965 26565.8066 343197.75 77262.1953 120489.6484 27358.3105 408483.9688 363489.6563 89312.7422 1345725.5 30881.8281 1534433.25 56313.8438 61700.2813 32118.1855 29380.3477 31735.3828 700558 470491.6563 53626.4453 106087.6563 30946.4902 73166.3516 97932.3438 590697.875 32623.8516 31183.1582 73732.8047 42179.7695 156288.2344 165229.8594 3332266.75 75638.0625 83844.5938 43308.4219 50427.8516 36494.8164 134480.7031 48162.5938 32338.8906 55951.0938 854955.6875 109273.3047 49160.0313 270346.125 135944.1406 126330.5469 31687.1973 166507.4531 98197.1484 28067.0664 164237.5781 109286.5625 101137.2969 3051496.25 215407.9688 20218.7969 28067.0664 67603.7813 87322.6172 125861 138516.4219 190943.8125 748703.5625 81197.5156 110074.5 176444.2656 57456.0898 119943.5859 384433.3125 34776.7773 87300.6641 34635.1055 82517.0391 71058.5547 86924.0859 144650.1719 8822963 1964778.25 2000390.25 187359.8906 2432263.75 18796.5605 257283.1875 131232.3594 102548 36539.9766 236990.3594 304073.6875 81626.1953 198819.3594 763038.25 208845.0625 47677.4336 2678250.75 1398484 60933.6563 5041849 459760.125 1-stearoyl-GPS (18:0)* 134707 241232 313055 207169 40828 33411 229661 233411.9375 59505.5586 29793.3301 196393.4531 80961.625 262207.9688 289863.4375 558251.375 365096.75 80307.8359 58319.7305 64563.0352 50578.4063 113586.4688 124583.6406 59039.7148 1368308 77975.7656 232863.0625 74854.1094 279368.625 158245.0781 91869.6719 157984.125 215209.8594 168924.5625 61787.0195 110066.9531 217494.3281 71258.0859 115637.5469 285478.625 206900.5313 127949.5 442202.125 299752.7188 408990.25 102292.5 57164.2148 119996.7344 127949.5 167254.0938 76633.3359 119475.5469 154283.2969 140261.4375 121192 39961 100958 2-hydroxyphytanate* 1364889.875 3295302.75 3621789 607904.1875 1099414.125 1368612.875 1169471.125 500914.75 1432111.625 6530550 3329591.25 740660.8125 997156.8125 1427687.75 2251525.5 346032.125 1261983.375 844257.125 2631167.25 1070445 4017259.75 2227487.75 1813503.625 2077019.5 1658049.75 1640233.75 3584011.25 2199356.25 4413987.5 538073.75 2873482.5 909160.375 5553548.5 1314727.125 2225989 794897.75 510709.9375 1643858.75 823103.5625 374018.2188 1532222.375 916641.3125 1204852.125 1270683 810726.75 1568333.5 1691175.375 1639566.625 1060278.625 1037434.313 1394667.875 9849730 468621.6875 1094858.625 1592306.875 680509.4375 344351.0313 1728991.875 1270683 791669.625 1579168.375 1086212 91000.1875 162937.4531 648666.5 200290.7344 1412054.125 992562.25 1215136.25 1095010 4273760 1445805.5 2069459 364278.2813 1547311.125 768782.1875 1456329.125 652507.75 474020.1563 1186815.5 501727.5 523195.9375 953093.75 1171863.5 866616.4375 862235.6875 458730.4688 690893.1875 851283.625 745947.75 2106857.5 734017.75 1606832.75 202759.8125 1856404.625 19604394 2417081.75 4078255 1771265.5 580643 2181006.75 4807310 405515.125 592183.25 3074192.75 2072507 2563704.75 743840.875 1156754.375 1757927.375 3785862.25 2725661.25 1345368.5 2128639.25 1197814.25 615752.25 1174191.375 1270683 2650819.5 1873948.5 4395761.5 807977.6875 766888.125 3228493.5 1430586.75 5135845 1569182.75 2869478 3709152.25 2594048 1069131.125 2081774.25 2043299.25 1520801.25 908498.5 419700.2813 1638861.125 700627.4375 583935.5625 2696875 1275237.5 945245.5625 5831565.5 3935854 1544710.625 1087089.75 1005765.938 670629.8125 1146955.375 2115944.25 1929727.5 503267.5 2017423.625 1240518.75 2902066 1818905.125 3707907 6174424.5 3480673 508497.75 966748.375 659373.5625 1612722.625 4211916 325382.3125 8023739 2248077.75 1838814 2405543.5 508267.0313 393107.875 2916459.25 723532.0625 5378854 1056092.375 1425593.5 3062426.5 1355913.875 887836.4375 719230.75 442399.9688 881571.1875 2175455.75 562942.375 1132013.125 1194527.625 1458045.875 810992 2654625.25 3281610.5 437978.6563 634215.8125 1252942.25 1948357.125 2229930.5 558770.9375 387549.3125 6002924 757147.3125 816338.5 1502360.75 1226596.5 1705574.375 1869460.5 1198882.875 3271973.75 504462.3438 1487824.625 699449.375 1509750.25 104005.1016 4294245 1358540 3018817.25 581079.1875 4008229.75 1277156.5 1009180.813 1264209.375 3524286.25 1074861 2941587.25 579704.25 987377.125 1095429.875 8496352 1294517.75 768859.4375 250991.7344 3285589.25 865613.3125 1127421.875 1757838.125 2212139.25 2864418.25 2947820.25 3198230.5 1130670.625 523702.5 998269.75 700377.3125 5610627 1765729.125 975427.5625 1106126.875 2863674 4004578.25 5330553.5 868365.9375 665682.4375 997691.125 1150102.5 1270683 1240803.875 1445299.375 1367957 207082.0938 415821.25 891834.0625 1807894.875 3325537.75 4451870.5 944736.3125 1707567.625 1021235.063 812418.6875 1967446.875 1408069.375 8727809 617184.0625 2529952 1244765 822782.5625 3460103 841625.875 885380.5625 1083496.125 1327226.25 901935.0625 2716580 600480.625 445550 1471831 1653495 1612322.25 878749.3125 723261.375 2379008.75 2811897 230804.8281 844456.5 552849.875 2518320 451905.5938 1588126.375 511201.9688 791713.25 937316.9375 1-arachidonoyl-GPA (20:4) 340977.3438 139112.1875 596604.9375 607423.4375 511365.9063 417209.8125 250320.3906 186563.8125 399251.6875 521320.9688 452931.7188 253532.8281 193380.0938 652298.4375 205947.7031 1068525.875 396904.125 273004.5625 3135197 416244.0625 463142 704091.5625 1371582.375 199424.9688 387794.1875 559291.9375 176619.6563 386806.6563 407303.875 247478.6563 755432.1875 371765.1875 273818.4375 335280.8125 245983.6094 293244.8438 131957.2656 620431.5625 295902.7188 231185.0938 497014.5 1035353.688 694392.75 616319.4375 710177.875 102108.0703 139004.5938 189800.3281 40930.5781 306900.5 391250.0625 440409.5625 108016.9297 245153.1094 109835.5234 125347.125 92057.3672 374100.8438 227261.4063 137956.7188 299105.1563 216798.3125 453139.625 306900.5 96645.1484 576172.375 373405.8125 346784 886818.25 168015.5 453421.7188 213336.9844 657649.5625 253896.9219 702361.875 736453 209271.4219 633237.5625 888624.0625 113055.7656 112068.8984 723815.1875 759105 119919.8672 189933.4063 176137.8438 569780.6875 150571.1719 475722.2813 300041.2813 375830.75 197140.9219 321522 253888.6406 191388.6094 253575.9531 717255.9375 219757.2969 654081 191691.2188 223502.2031 152130.8125 361960.1875 249360.5469 303798.25 538609.9375 130483.3125 993085.1875 100725.3203 56544.832 316350 304173.9375 253107.1719 710918.9375 257227.7656 285417.6563 217316.7813 407234.0313 115584.5469 1369284.75 443650.6875 291749.4063 672570.75 67379.7578 418836 586442.5625 191291.6563 344666.75 126176.8281 385877.375 430931.2813 304187.6875 330294.2813 206740.3281 179520.1094 109785.8047 185601.8906 421191.625 317898.25 590528.25 1717389.25 309613.3125 363313.5625 408064.7813 80610.5703 1047044.75 261948.6719 142467.375 234159.6719 226006.7969 3-hydroxycotinine glucuronide 148474.8281 242400.125 103283.7422 185790.7656 39423.8086 390574.2188 74832.4297 186850 459975.6875 577629.875 134846.2656 13269369 186850 52701.4063 562835.9375 50114.6289 318228.3125 53964.0938 36379.8906 186850 188012.9375 929989.1875 68930.5938 156296.7031 135810.0781 54251.2813 401246.9375 183883.8125 186850 217403.3125 215762.9219 1635576.375 109358.8125 143919.3125 145017.5469 2965496.25 396000.125 627129.6875 217509.9375 1179533.25 6-oxopiperidine-2-carboxylate 1076945.125 777204.9375 1156765.625 987333.75 736875.6875 1390648.75 736623.6875 271953.5938 613759.625 1031717.625 603937.4375 513131.6875 1059763 691796.5 417835.625 529683.3125 363906.7813 538330.5625 1081301.5 474210.7813 684618 507950.8125 908567.25 915786.625 887039.3125 752836.5 697600.4375 844971 582383.75 1022070.063 982505 515196.1875 947227.9375 604822.6875 232243.5156 990971.4375 1807201.125 909440.625 277824.4063 393825.4688 492324.625 413466.4375 333251.7813 693629.25 413206.625 574476.75 423810.9688 593386.5 504844.9063 13692136 16172532 2250728 2849853 14194147 5543255 778201.5 4095080.5 1778030 7934269 40465432 4703460 13252375 986610.6875 12685033 6728271.5 2726898 876776.875 5275767.5 271155.75 7570712 2055025.875 2852187 4268748.5 9284042 5427669 1673410.875 2678432.5 1743525 2021993 2079154.625 31107086 2075439.125 8491075 2224374 12043121 1642311.75 2078724.625 6421009 1171775.25 2882474.5 523056.4063 1695773.125 5017370.5 769084.4375 5805684 16261392 10558327 5343368.5 1184130.25 1163790.375 5881209.5 3384843.25 3045956 2036551.125 2784938.5 3169194.25 1178985.75 621172.125 1251846.125 1853513.75 2581225.5 3882055.5 2995617.5 3433887.5 2396866.25 1943727.5 2779292.25 4934150.5 4293506 3550596.5 4829373.5 805252.1875 6758441 2502678.5 2165927.5 4402148 2786862.25 2681519.25 4004834 17494588 2190154.75 2408395.75 1825607.375 1888539.25 5006603.5 7989161 11027892 947151 4862731 15748601 15450902 68070992 2225539.75 1138343.375 1535621.625 8569747 1037609.563 2067056.625 5323222.5 1400572 2129820.25 1383240.5 7642584.5 8018269 830521.625 14278709 3668582 4473303.5 1304969.125 894493.1875 2122541 7507570.5 4633696.5 6985162.5 2825889.5 6390790 8829602 1378674.5 2313886.25 13933023 1074070.125 7374286 2818863 1339565.125 3901649.5 7691705.5 2554798.25 3128889.75 3459215 1889037.875 4406024 2945192.5 5914795 9885442 1377319 1685879.75 4795900.5 921475.8125 2587398.75 3132494.5 2924436.25 2174521 9304750 1511130 6577342.5 836500.125 3135441.25 6772251 1263958.125 6473514.5 1958082.375 16577604 14884612 1568979 1094910.25 7278661 17308942 2157861.5 17648290 3684115.5 594631.125 3981763.75 4057179.75 2638848.75 2753129.25 1741214 16174548 4212974 5025442.5 1743589.125 1616368.375 6963403 2722186 4609281 1034340.625 1634979.5 2765117.5 868463.125 970442.8125 3429177.75 7154434 3370367.25 4746976 1457676.125 798622.375 4877632.5 2659811 6901914 839645.6875 2016117.875 2237001.5 2850524.25 835900.3125 521446.4375 809534.1875 1996227.125 1989713.5 3487096.5 3020236.5 491750.0313 2035073.25 5492923.5 4005050.5 17897330 11446172 992874.25 3184199.75 907220.6875 951848.625 2644109 3136715.5 920905.1875 9478580 561950.5 8847112 977123.25 1442623.375 3093874 1013608.125 12264838 1334033.125 11731418 916659.75 2087220.5 1105661 2035427.5 1994353.75 1541047.5 1018398.188 1745380.125 1510058.125 2264942.25 1157673.25 2716099 2643405.75 912917.375 32166720 1056810.875 471248.8438 1607387.875 1514771.5 2122541 1237583.5 1804381.75 1982810.75 2689528.5 1910829 1788981.875 N-delta-acetylornithine 1251584.75 1381908.25 7059371.5 2039749.5 5477388.5 4437307 7172452.5 2461870.5 3109246.5 6209895 2931950.5 1981618.875 3367187 3161498.25 2996434.25 3622518.25 8128776 4545127.5 5310893 3961747.75 8281779 6542825 7107854.5 7781576 8924538 3194797.25 2567179 2505387 11301287 7099841 17954988 4603477 4635312.5 7328375 6970875 2852081.25 4736820.5 8672341 7952601.5 3045488.5 1807342.375 4274709 1888793.5 2305966.75 2343852.5 1967277.375 7759765.5 3895438.5 5751985 5324956 5406006.5 5559006.5 1455211.375 3405007.5 1742046.375 1221928.5 1008397.25 1228161.875 1878873 2642183.75 3240847 1051921.25 605902.8125 1246775.5 7839861.5 469118.75 2653775.25 2401646.75 2877634.5 3105967.25 1571098.625 355025.7188 2109062 354602.875 5600924 2677292.5 5090863 1292811 703529.6875 2094456 2641689.75 1507201.75 1016664.563 675135.6875 450324.75 573964.0625 2837745.5 1692065.375 296094.625 823925.3125 430123.4375 558515.1875 1493495.25 3779979.25 1311342.25 1755504 3734585 6558905.5 1188293.625 1435970 3389797.5 2773364 992659.375 715553.125 317262.2188 6845684 1015218.813 191812.8281 2284634.75 465561.2813 9821519 5906094 1115089.5 8362407.5 905428.8125 1232729.125 3662342.5 1793406.75 983765.625 891463.625 1264945.5 2856920.5 1721804 1673879 290128.375 619457.5625 1544598 2717259.25 3033434.75 1691115.75 467281.4375 4440995 4460171 2807847.5 228827.6094 592967.0625 2053699.375 691487.3125 844464.625 6806791 1545090.75 596986 1861601.5 816482.3125 1913764.625 3058314.25 831432.1875 596932.5 3685210.25 2609013.25 2001322.5 1257602.25 625436 5593017 2904143 4440934.5 242834.4219 896937.625 877420.625 806999.0625 1272295.375 1175840.875 1249013.25 1457155.25 2512269.5 2400785.5 1340102.75 959050.5 1950858.875 2257793.25 333850.0625 1871125.125 4095974.25 2218295 4938966 1379884.125 1247283 780627.5 640935.1875 2368292.5 483015.1875 7253976 1055066.875 3225760.25 1314979.125 2340683.25 2728902.5 3780842 19102684 1427968.25 671597.625 3426319.5 678930.5 1928605.25 2594882.5 3064054 4666176.5 7463573 3377831 807260 4725750 1111610.5 635870.625 715273.5625 2152513.25 157405.875 265873.9688 46196.7891 3894159.75 1061761.875 412917.25 931617.0625 988669.5 6978648.5 2555801 2343852.5 2615300.5 5022120 1540342.375 999097 6797905.5 327924.875 1777957.5 1428618.5 686016.6875 2437413 1586788 2924089.75 2934930 2343852.5 1603300.25 2343852.5 1870303.75 2480537.5 3667035.75 3150221.5 3980103.25 4237193 3677078.5 5261297 3020710 10260078 2926960.5 5304274 2809746 1642131.375 1452058.375 1791705.125 3491487.5 3077323 525518 5322661 5764730 5405133.5 1619288.25 1852896.5 2825038.25 4799072 1383235.625 3154247.5 4224469 929843.875 2023307.125 15592229 3503527.75 1150255.625 2510919.25 16496144 3383749.5 1492502.125 4448988.5 491767 2763667.5 578366.875 2244291.5 1212255.75 6728509 832183.375 2998642.25 2274853.25 2434335 2012980.75 6400907.5 1338392.125 2412852 6754993 8087591 2050756.5 2664782.25 3005268.75 3012640 12939009 1363140.5 3813496.25 3776663 5067127.5 1041982 1860017 1422724.5 5414215 acisoga 208071.4531 188519.2031 143440.1563 160047 369738.8438 486781.2188 96160.8047 282419 134914.625 553527.4375 118527.7813 418162.5625 124999.375 192034.6406 219745.5156 376110.6563 193076.5 264037.625 248255.0313 355999.0625 135844.5469 212643.6094 319017.875 237399.0781 1118075.375 295680.25 514588.8438 275586.1875 369536.2813 305881.4375 344767.6875 100800.3906 587481.75 246572.5313 274949.5938 364856.3438 378091.5313 469501.5313 356852.5938 386862.5 348602.875 657678 288904.2188 354661.4063 286348 560179.8125 406183.9063 357429.3125 295879.875 381173.6875 841864.1875 2463279.75 318943.75 2036212.875 5858626.5 1336885.375 216767.1406 569798.3125 229624.2344 1540712.625 1284665.25 919478.6875 5552937.5 206055.6094 3294910.75 175479.2813 431398.5938 200727.1094 745416.4375 392195.375 1418803.125 212986.9688 420377.5313 354751.9063 1370174.375 591038.25 363584.9063 802748.625 2921869.75 715499.0625 1400084.125 2592086.25 3342742.25 717789.8125 98858.8516 2521693.75 222489.0156 1208942.5 542141.9375 266285.4688 329469.75 134554.4375 657678 2467185.25 404463.6563 777729.875 1412840.5 2868911.25 1079792.5 283201.6563 1520585.375 840424.375 863658.125 540677.6875 91740.9375 3070788 540125.625 175163.0625 454413.5938 147339.4219 751900.6875 1810242.75 825550.625 1027630.125 332427 769526.375 670586.6875 971509 854509.5625 705425.5625 376912.6563 2410919.25 323816.9688 1145816.25 3199364.75 375873.3438 792576.6875 882773.3125 2710732.5 1584247 767107.6875 2289163.25 1235500.625 3960748.5 770767.4375 186855.9063 2563686.5 639949.9375 671867.6875 7144829.5 457059.7188 1322067.75 652784.875 801601.8125 559770.1875 221752.6406 465758.4063 657678 2601589 883807 1335037.125 758624.4375 280410.0625 1005902.813 2607573.75 1078185.375 563746.8125 1640630.75 1169762.5 355064.625 712676.75 701279.875 765379.0625 345498.8125 2044024.5 759354.5625 1985150.125 574434.5625 100350.7656 452937.2813 196305.2188 160294.2031 1087699.75 616993.3125 512388.0313 431462 440436.375 997382.25 168870.4688 718763.3125 494093.625 2783975.25 281377.5938 3778382.5 3183641.75 694774.1875 1793156.375 772790.8125 1564602 681031.5625 1583137 1132033.875 263388.875 1265886 633033.375 1862812.75 1513854.625 1190601.125 4452645.5 327260.0938 2868233.5 262169.25 4617655.5 438778.7188 258317.0625 364557.3438 520425.0625 323028.4375 2259474 1775693.5 2162366 356370.4063 778225.375 793629.8125 2055611.75 807359.0625 366782.9375 3325628 855305.8125 578598.5625 2054137.5 305621.9688 5063303.5 657678 916606.4375 173813.8281 568107.625 1991348.875 559009.3125 206161.9219 954169.5625 571641.25 485537.9688 658464.0625 765709.125 597075.9375 1314227.75 3309457.75 3469841 212450.2969 1669907 2010550.625 1632868.5 1512976.625 560159.8125 352419.5 475008.25 389834.8125 913825.1875 1253937.25 240872.0469 2025609.875 1906821.375 1009032.688 1112548.25 1870683.125 1318977 1114392.875 334875.1563 664265.6875 531019.0625 1056088.5 218490.6563 3334664 806484.25 684978.1875 597946.625 1303028.75 948041.3125 345967.3438 1784371.125 451799.5938 3161249 614182.875 314793.6875 334223.5313 853312.4375 934119.0625 261063.4688 289492.4375 297273.875 46340.0859 1181209.625 745557.75 1379390.125 1086163.25 1628950.375 856200.375 1322254.75 903749.1875 175356.625 1391294.125 453221.9063 1042979.063 460320.4063 460502.375 404420.3438 264363.4375 2442178 1078146.5 S-(3-hydroxypropyl)mercapturic acid (HPMA) 74538.7344 212620.5938 30789.0898 36539.0156 47423.3438 47815 77887 307341 33925 30375 51387 21714 50558 76863 65831 45143 53033 412871.9375 54445.6406 44857.4688 52501.3047 22600.8457 75457.8516 34939.0273 36296.1484 68426.1484 83612.8047 30161.2344 73283.0547 37514.043 362442.1875 1318330 128448.9844 211140.5 273719 25249.4434 22077.9512 783965.75 129335 31011.6133 294903.8125 37749.6289 249861.8906 543732 107927 261937.9844 305988 59035 443705 95256 381795 330009 196490 404226 207565 32234 153384 515861 36909 132695 496665 134073 182077 1613716 217684 542323 86326 91859 122060 41316 233565 48640 129335 107299 62838 71793 59331 434814 122662 365987 413612 29884 248662 189252 127493 66383 87544 158339 808283 40729 605430 148634.9688 40294.3867 60268.4805 284199.4375 169170.7344 256518.5469 86780.5859 54214.0469 161216.3281 66716.6641 201147.2188 153518.2344 259607.75 75691.5 74861.1875 133298.7813 20380.0859 105995.6406 1261352.875 113955.0156 87736.0391 68362.6797 56640.3281 125371.2188 83102.7266 57031.4883 692915.625 28656.041 176248.4063 58621.1719 61498.0391 380662.625 25476.6719 771409.875 663077.75 135831.4219 104671.9531 421696.0938 203410.7344 260980.4688 23503.127 183557.4219 111507.3828 499073.2188 473619.5313 492967.9688 194624.7031 244139.6094 347415.9063 240965.6719 352753.625 363162.5313 27533.666 144714.9688 216626.5625 63377.7031 1481395.875 337888.25 83038.5313 87604.7422 18888.4531 806001.1875 322126.9688 114527.1563 97632 85694 124436 236509 1697074.875 34419.4258 352143.2813 256018.9531 87664.2031 86774.4375 1426332.75 303818.5 98457.1563 199595.7656 437409.3438 182179.4844 443276 768242 562301 129335 273192.3438 34538.082 769738.9375 173884.75 339621.875 54514.4844 892685 42994.1445 4659565.5 120650 129627 482988 3070658.75 976343.875 62146.0547 108694.2734 74511.1719 64855.8281 181419.125 159829.0938 75098.1016 237886.3594 652150.3125 208534 317481 90960 131521.9063 55132.4609 60384.25 49816.4102 90615.9844 135811.6094 1H-indole-7-acetic acid 135925.2813 224752.5 71166.2734 576254.6875 280874.0938 1391608.5 619729.4375 507180.0625 317547.9688 107652.8125 528012.3125 610941.8125 296738.0938 573190.9375 243165.875 366650.4063 462678.8125 758737.6875 306404.625 162060.2188 105861.4688 276039.9688 566327.875 422832.7813 219386.6875 450595.0625 744070.3125 391783.4375 372858.1875 608547.3125 116156.5391 297511.3438 167842.0781 175306.875 927204.625 407925.125 123478.9141 197186.3906 210286.875 135681.5625 714144.125 412260.25 122335.7422 164044.8281 780819.8125 214275.9063 376939 371696.3125 319885.75 396333.3438 312432.25 1423146.375 233503.4375 434443.1875 84276.2969 119866.125 184533.8438 176504.4219 291862.7813 252016.3281 884279.0625 174347.0156 120719.3828 129956.9453 1010619.375 723818.9375 93577.8359 467826.1563 422051.5 318943.25 756204.1875 254115.5625 1379463.875 371673.1875 221154.4219 1297562.75 337749 140913.125 198592.8281 636562.375 103674.0078 60318.4727 151583.4063 202606.3438 864887.125 315680.0625 87090.6484 24574.0859 280225.5 1007013.375 184421.5781 90156.25 404863.5625 320446.4063 251321.2188 1409825.125 398335.2813 509744.625 554592.25 416841.1875 792548.9375 624230.1875 636665 1462177.75 239863.9688 292572.3125 452845.75 499215.2188 1747757.875 823385.5625 117133.1875 118154.7656 129019.6875 89269.4844 128685.1719 136877.7813 1773524.625 103395.5 560862.6875 974738.5625 140986.3438 337749 337749 1116587.125 701444.75 1002184.875 69709.6328 847019.4375 929936.8125 67665.5391 187419.6094 208047.0625 1147520.625 355612.2813 325947.1563 2235127.25 1883408.375 288022.125 1163398.5 181347.5781 304311.75 639191.5 407797.8125 570192.25 655454.0625 833818.25 903169.1875 158748.7188 428033.5 945173.6875 316955.5 188244.7813 147910.8438 124886.2813 363039.2188 337749 122164.1875 454918.7813 358569.3125 425802.0625 312614.5625 981240.875 2039955.5 262675.3438 971084.875 259725.25 3-methoxytyramine sulfate 64633.2109 88616.6875 77527.2891 40895.832 208012.8281 42526.0313 33466.3164 49629.125 142044.0938 33585.5469 53470.2969 77452.4766 77038.7266 166942.75 64362.9531 137393.2344 83359.7109 53359.0742 129375.4375 32765.1699 44298.4688 70664.0234 50895.3164 78718.7422 74801.8672 48724.2422 66288.9844 55745.2656 340884.5625 43170.7617 146995.1719 51982.8516 49395.6484 32513.0371 97187.3281 81847.2891 59487.2109 62035.0938 71557.6719 109248.3516 23625.7285 65154.5586 96355.3828 88553.5625 68613.0781 51582.1563 55115.7617 562676.4375 303917.6875 95172.8828 72172.5313 438050.4375 2057410.5 42289.1055 4583645 7839771 127025.0703 515736.7813 34403.9883 735740.125 5727598 47173.3398 1001701.813 9260843 21210284 52600.9844 85664.2344 8356966 229546.5938 135013.0781 59312.5742 205451.4219 36749436 8186847.5 643956.9375 111062.9297 178168.1719 4084086.25 151460.625 96662.7734 583206.5 101939.1484 35196892 20480.9004 535338.25 46778240 514197.1563 739099.125 594468.4375 479981.625 545762 28304.7148 32207696 454153.1563 135299.5781 117020.8828 61394.6563 497254 172260.0469 49791.957 79380.6172 99951.3906 219565.0781 122037.4453 124652.5 57270.5352 15887018 100329.5391 340585.5 248900.1719 104379.8125 572753.4375 6002237 38580.7539 18344148 837136.625 213324.1719 73955.6484 1279348 355217.0313 172016.25 785813.3125 313860.1563 118929.3906 176353.2031 71562.8047 558859.25 110004.5 108617.9688 1759548.75 231850.0781 237159.2031 5660203 195107.5 74329.0078 112789.0156 109628.9531 1160224.75 212534.7813 115091.1797 437867.25 106593.8359 504964.0625 3925923 40860.3086 208108.7656 267864.9375 43844.1211 104475.3594 67615.2266 2976432.25 57180.6523 531711.125 113011.1172 178487.8438 66682.6641 15380556 144464.4844 144771.4375 44491.1641 481374.1875 168932.3438 53162.9297 78930.7188 242104.9531 44976.4492 34824.4688 66882.4297 110905.8516 210454.2969 170026.6719 191606.2031 1566545.625 57474.9375 44311292 69212.6484 6343718.5 413915.8438 86692.3281 184710.875 36110.7617 1005220.438 271344.75 318469.9063 7537779 726077.0625 3124056.25 70162.4766 272364.0313 63066.4219 15153110 134608.7344 37409.7227 202086.7188 533424.1875 649943 930164.1875 103402.4688 103746.6875 396629.3438 204421.4219 164427.3906 757580.5 587316.125 286262.8438 351589.6875 237737.3906 124476.2578 472590.375 18710230 279417.2188 89662.8984 91364.1016 174578.8125 7656974 84584.9297 144851.3438 12954845 93598.5156 1483474.75 227790.0156 338708.5625 13591384 438806.625 43357.8633 58598.4961 381069.5313 166235.0938 278539.2188 118091.4766 4278649.5 54106.2109 528877.4375 13638322 115327.6328 339478.625 20951.5938 32637820 214876.1875 195263.2031 196841.0156 874098.3125 457721.9688 98934.5391 26671.1152 1428642.25 1157725.75 141244.2813 725242.5625 221103.5 6637379 111787.2031 125310.0469 321893.9375 1371289.125 1930582.5 25243.5234 247830.5938 277019.9375 232370.6094 39121.8555 172723.9063 91197.5859 27555072 104956.0859 72223.0078 130946.1719 19998598 223191.1719 525777.4375 92482.2578 648102.75 20008464 33315.0547 241138.6406 148199.5781 276626.7813 36369.3359 162605.7969 261980.5781 38738.2383 665999.3125 N-acetylalliin 186863.4844 219667.5469 142385.1875 154539.9219 671860.875 79752.4922 783468.8125 218103.0938 214200.4063 238773.0625 645787.125 56128.6367 86305.625 295713.8125 367056.0625 198074.4375 160914.1406 345451.8438 105722.7031 40104.9336 361306.75 932801.0625 379410.5313 110386.7031 758106.4375 236225.9375 205166.3125 128551.9297 1237049.75 144299.5469 507404.8438 214313.9688 127148.1797 98176.0703 704761.3125 363609.375 406893.25 572212.8125 54126.5547 24612.6152 105178.0781 113113.8203 263221.6875 47182.1133 121579.4297 124122.2266 1026472.375 1500303.875 157030.3438 501701.9688 173838.5469 28535.75 151245.4063 19803.166 46582.793 394808 182678.1875 28490.2285 189960.3281 612608.9375 255412.3125 80813.4844 1753857 335046.3438 96344.7656 63390.9297 517463.4375 206512.2031 132227.3438 40253.8516 182910.5 29839.4355 108819.2266 51478.3906 60928.8008 79617.1641 683180.75 31932.2461 34961.2656 680591.5 120474.6406 24560.7461 3915522.5 64795.3555 1503140.75 142676.6094 79381.7734 143010.2969 138469.3906 189785.0625 60416.1133 181894.9531 128722.5469 53050.4688 303378.5625 60188.1523 93717.9297 62918.1016 40856.1758 47182.1133 130189.6406 274328.9375 56527.7695 184541.75 1649869.375 60486.7383 63957.3438 119443.0547 97304.8672 5244579.5 294903.0625 110208.7891 88223.125 22939.0977 304099.8438 347172.8125 214739.2188 280246.4063 53067.2695 139288.1719 2049920.625 1452545.125 438110.375 1490065.125 79695.9141 1416706.375 50070.3789 367408.8438 55184.5352 617860.5 72002.4141 36184.7578 432367.375 27994.4199 97739.6406 32095.0645 83164.4219 454425.9375 254864.3438 601355.875 180817.7969 375445.5938 4559259 441001.875 73350.5938 102997.4297 60348.1523 71085.9766 245653.6719 207206.0625 34730.5977 182910.5 1205222.875 642178.3125 3742061.5 183843.125 26806896 4141715 13524142 182910.5 138929.7031 1221790.625 664167.6875 2474703.25 909303.25 614367.8125 182910.5 964019.125 211224.7656 1428630.625 145390.6563 363609.875 124450.0156 692629.5625 119947.4609 1665243.25 53538.4375 20123040 143333.5938 181977.8594 2722279.25 373270.2188 O-sulfo-L-tyrosine 1977255.25 1612145.25 1834723.5 1600721 1760728.125 3229800.25 880023.125 1232230.125 1305422.375 2909302.75 1877676.75 2109918.5 1449261.25 1641228.25 872073.625 1426514.375 2015700.75 2319184.75 1674662 2300779.75 1353716 1170102.875 4602867.5 2303558.75 5387107 1349281.5 2351768.25 1164933.625 1403520.75 1760419.375 1544797.75 821154.4375 1737424.25 1621951.875 1899526 1353857.5 1485131.875 2550190.25 1135573.375 1116110 1255140.625 3522546 1987477 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3365499.5 898508 864862.125 681562.9375 2328673 7127377.5 1673148.875 3049471.75 7734095 527113.1875 7126455 9738444 2715558.25 475399.5313 1848780.5 3379046.25 1182268.625 1539618.75 997959.375 2328673 1096210.375 17315080 2122484 4504856.5 1243128.625 1840914.625 2583166.5 1587777.625 3127876 10142043 1552598.625 1491878.125 1791661.625 3269789.25 1368694.125 886067.75 3058394.75 1052924 14331797 1347351 13843478 5759826.5 2017387 5652972.5 2176718 4232353 9098855 2566523.75 6053236 650688.5 4686943 2559922.5 15622615 1853213 8292073 10918977 1186522.75 26979214 880683.375 3387502.25 3595885.75 1208919.375 880769 938961.25 1093370.875 12226438 4676502.5 2924256.25 1498137.75 977846.25 3929282.75 7760030.5 2221209.75 1028229 17366842 4419570 2459906.75 4381585 916066.125 21536346 6038150 1710025.25 1779488.75 1954446.625 6363104.5 3649033.25 3055615.75 3733809.5 3104879.75 1219164.875 9407454 9107990 2976065.5 2450830.25 14361908 20865728 1303872.5 4922305 7291390.5 3397391.5 5514552.5 2845347.25 1466001.5 5413247 8075459.5 6464287 18114016 1104681.625 4004008.25 32387664 14027436 1444663 7624932 3732967 20064502 805250.75 1978374.5 6003931.5 1570722.125 637723.9375 16399370 3941479 1071924.25 1808821.125 7803659 6470045 2036312.75 7438374 751850.75 11121564 529587.125 1499644.5 963285.8125 4636809.5 1318139.625 1271345.25 1987866 2010359.25 781100.4375 6455537 12457271 8334481 7053616.5 10983393 1082411.25 9130933 3517426.75 1536038.875 10784236 1755303.25 21511822 580044.3125 4330878 1311900.75 700073.625 23667878 10330974 ferulic acid 4-sulfate 924322.75 1697680.875 79578.4531 568506.0625 321145.7813 734119.9375 949802.5 98023.8438 973160 407345.0625 530427.8125 85091.7344 279763.4688 345026.4063 365280.0313 285429 290111.6875 404383.875 150432.8594 528301.5 113148.0781 353545.4375 352025.2188 236198.5625 1613692.5 1391311.625 697471.75 318569.0938 1272482.25 209471.4063 113901.0156 305239.25 814947.4375 357723.4063 735552.5 144498.5938 1600634.125 1008751 322001.75 207626.0156 128008.8906 282257.2188 458348.9063 62028.9648 120913.7188 539833.1875 340316.2188 189761.4688 116066.5859 22500.3672 4176361.75 46207.7109 92765.6172 1917137.5 316435.5938 1334667.125 2451756.5 407006.875 35394.4766 70089.3516 2059211 105873.7891 652779.3125 284906.9375 138873.5469 116691.2266 33832.5195 128920.5625 37159.3398 2604490 81232.2813 231291.0469 1164309.375 1997840.125 277929.7188 20365.6875 330731 522162.0625 143364.0156 315684.75 350477.6563 565363.3125 63710.7813 209706 730647.8125 365610 97973.7422 312488.125 1982018 306695.7813 671202 110418.5859 172979.7813 274037.875 342892.9063 251745.2656 152660.1406 1556624.75 124767.3203 184230.1875 1865459.625 662736.9375 772557.9375 2053759.25 278647 131112.5156 354971.9688 565267.5 314346.0313 1518007.125 88037.9688 1225156.125 997736.0625 562719.6875 769882.875 330731 561064.5 36098.9648 146007.7031 142721.2813 2450216 629019.375 676279.6875 60172.707 394445.7188 493082.6563 825298.5 147694.7813 3-(3-hydroxyphenyl)propionate sulfate 187698.1094 239053.7188 375251.875 184633.9219 429875.1563 51713.1172 194474.3906 316318.75 278948.3125 73372.2734 423064.5 504991.625 79379.5547 52909.5469 287592.2813 19206.4746 715570.1875 77657.7969 1677238 250415.0156 473623.9063 24092.252 355551.8125 942830.9375 356203.1563 997765.5625 933529.625 68194.4531 93352.6172 144975.625 233822.6719 537213.875 162243.7656 108898.7109 116280.9297 293268.3125 1812217.375 164334.3125 1077050.25 35606.3008 550444.4375 1726462.125 607001.1875 266161 385966.875 31386.7988 138361.1719 44068.9336 3507857 22005.4063 26989.2285 5491643.5 22067.2441 141540.9375 25563.3398 158634.5781 79157.8047 56042.3594 65806.8516 1107844.125 132229.7031 281907 124864.4844 254154.8125 435377.1875 437421.2188 381838.9375 326141.7813 160090.3125 731879.3125 176118.8281 121705.6719 9816280 50291.1211 358231.4063 332206.0313 3382555.75 56527.6055 695949.25 74350.5547 99887.1563 840727.6875 1987897.125 2522859 1364873.625 93536.0234 1134994 266161 1380972.375 1611026.375 11-ketoetiocholanolone glucuronide 124241.4219 77475.1484 338508.8438 89349.2422 147049.2344 123517.7109 120249.0781 191384.0781 309850.7813 806837.4375 441580.5625 162139.6563 593451.5625 145670.4844 4508611.5 200197 1127777.875 347995.5625 207304.8281 91365.0078 35647.0859 151144.7813 1444075.5 67119.5703 163122.5938 408346.5313 239295.1406 492544.375 390025.4688 930015.625 471530.375 2115435.25 97203.2031 466416.4688 306296.125 15084.7725 1772545 60005.5313 386602.125 144262.4375 423075.8438 1751001.125 36014.1367 1781337.5 318273.2813 121583.3438 341390.75 4087939.5 216687.125 106761.0938 329832 137588.75 126851.2031 349813.2188 310940.9375 729379.5625 175359.9844 194780.9531 210475.7969 5278977 956855.3125 803768.6875 5470792 2373093.75 942898 4610433.5 687001.375 2260583.75 321155.1563 291989.2813 7174585 709478 390314.6563 181163.5313 434412.1875 990938.625 177313.1094 2455790.5 174589.5469 353367.875 61955.8398 etiocholanolone glucuronide 190081.9219 363469.2813 536688.5 102077.6797 196984.4063 737904.875 39987.707 427229.2813 164177.4531 1432595.875 550552.3125 290552.5313 280156.6875 132806.9375 76773.9766 111445.5625 205509.1406 146808.1563 213467.0156 201459.1094 133406.4688 626917 264313.9063 737466.5 195309.6719 67947.6563 602796.0625 182018.75 421456.0938 304253 68797.9531 706237.3125 408370.9063 238785.5938 129042.9531 640215.8125 265126.4063 117629.2891 164903.3906 149813.2188 224054.6563 298843.0938 289928.2813 348873.6563 72805.4766 112679.2109 239887 203148.5781 3054439 1934253.5 224906.625 234010.5781 1668177.875 2285106.25 44240.918 113022.75 91187.7188 1282117.5 524052.0938 31566.3398 2716266.5 120476.3125 6800298 209733.875 789929.75 24841.7539 126168.5781 68917.5313 2209843 109051.9531 122154.7734 71467.8203 5532753 269327 572435.3125 1117399 454666.5938 3968000.5 581374.0625 673269.5 1538958 53114.9844 109709.4453 636420.75 97538.5234 130865.2422 76778.5 71401.7031 554757.25 474897.7188 139850.1094 862269.6875 2309183.5 1036627.5 16257.1758 24495.7988 236692.2031 213343.8438 49241.5547 49956.1094 75935.3516 62239.3242 328986.1563 313008.8125 198583.7031 34272.2031 2682260 281897.3125 30185.9453 14226463 52328.8867 863615.5 2473604 375312.4375 367781.125 367479.5625 1786534.25 2434006.5 189236.5625 7467628.5 45038.543 883098.5625 274340.0938 53870.2695 251242.3438 629784.25 38594.1953 83570.4609 1291292 63656.1563 136629.5 61503.5156 1304997.5 91594.1563 269327 818454.9375 171700.7188 5804899 152868.1719 65069.2891 258894.625 172206.9531 278847.7188 142557.4219 181189.2188 104896.5156 1537973.875 52342.0586 398835.25 51562.0898 4247688.5 208892.8125 135831.8906 659892.375 56590.125 139882.8125 4783148.5 184056.1563 6929751.5 2882258.5 230228.4688 862013.9375 169385.7656 696232.125 252809.4219 1132865.875 48330.293 2709327 833041.1875 953227.625 134368.2813 19499338 183785.8906 1414204.375 177521.8906 51929.0273 25900.2188 769915.375 371899.2188 98849.7734 224752.0469 114517.4453 489571.5313 562232.875 44766.9063 1551453 179855.5625 304803.5938 1459162.5 4997575 1484608.25 311999.5 269262 1014578.75 51286.4961 179694.7188 18247.1289 893261.625 1162277.375 368191.3125 5071377.5 12642595 165800.5469 2272510.25 84955.875 1186746.75 83709.5156 360116.5313 869800.8125 1243241.5 1310208.25 536270.375 78492.8828 208357.25 9936534 7125402.5 157678.9688 390693.2813 337421.2188 7664967 64840.6016 746446.625 101620.0234 1284919.5 467880.8125 244886.4531 656308.625 360595.7813 97669.9375 483842.4375 182591.5156 2302103.25 67869.1172 28457.9219 768210.8125 269327 269327 157101.1875 5244596 35255.6719 847314.625 8711504 66399.5234 127320.8672 169711.8438 110246.4922 315590.8125 15296219 1421131.5 290176.6875 17749978 1387683.625 17alpha-hydroxypregnanolone glucuronide 90256.8516 1347289.25 186647.2969 2349467.75 444059.0938 393649.8438 776001.5 437506.0938 150215.8281 516174.4375 26315628 4285072.5 590795.9375 2168288 26259620 2935390.5 243575.7813 7659211 1707625.125 501987.8125 4981332.5 12509005 2900700.5 624566.9375 283806.2813 3021276 308475.9375 6026351.5 522786.6563 2759279.5 9139125 1143054 5475190.5 2405840 4383965.5 1591913.5 249616.6406 3534139.75 468140 577709.4375 805039.4375 1826736 2298108.75 3493759.5 3141583.75 2498377.5 498725.125 845437.8125 721787.625 105381.5938 497254.2813 1624173.375 737687.25 633978.4375 791007.0625 7022276 2955072.25 21641222 3293582 7357293.5 3004971.25 1569956.5 4687808.5 5705655.5 883636.375 4573061.5 595640.3125 11899796 1754187.875 7452795.5 522215.9063 357498.875 7974653.5 98353.2969 1863875.625 7022515 1165733 1010297.188 390899.875 7467844.5 3001314 586823.6875 7159040 6638372 145546.9531 68532.1641 571358.6875 6676282.5 219787.0625 13210144 999173.75 246907.7344 3180750.75 3354618.75 1826736 1707818.125 7602012.5 868536.0625 1429625.75 872023.8125 2223905.75 5753268 729182.375 2989017.5 3478951.5 100909.8516 7316221.5 1363178.5 1710316.125 1804964.5 2446458.75 6882394.5 3622693 5907911.5 1065162.125 25179754 3027630.25 913842.375 3548435.25 4930315 474445.4688 5650256 2567849.75 3610029.5 144854.2344 7240291.5 3223170.25 63157.2539 2389174.5 1539587.25 2261211.75 1712687 1848507.625 1712548.5 8370975 727886.8125 539801.4375 2040372 8371586.5 1899284 6923048.5 1089179.5 2517056.25 8464663 900180.375 8795353 3490849.25 1670164 1442010 5601470 127519.1484 86790.2344 9139905 142680.3438 943449.375 1959132.375 1706098.5 402100.7188 2034836.375 861801.375 567058.75 12187277 1826736 1277353.25 7618764.5 954423.8125 955612.6875 4365646.5 2009417 1-palmitoyl-GPG (16:0)* 596083.8125 511848.6563 460066.6875 713138.3125 824712.0625 893941.5 498720.2813 291422.5625 414598.9375 496774.7188 1478936.625 344432.6563 390476.125 563326.3125 694858.3125 884848.0625 427614.375 459174.9375 678707.1875 451184.0313 396490.0313 389038.3438 1031809.938 447689.5 1617179.625 764033.125 687811.25 373003.4375 678125.9375 325729.6875 602130.875 311676.5938 345894.5 306975.0625 444722.6563 562139.6875 545588 325219.1875 294048.4375 226047 175908.6875 334296.75 568157.75 755287.5 452620.875 809826.625 407290.3125 645681.3125 485552.625 704312.9375 78787.0391 924051 612561.0625 297957.9688 206404.2031 151295.3438 226047 155819.0781 435965.5625 68592.8359 422025.9063 95586.9766 125393.4453 94895.875 121946.6953 119341.8906 308994.875 195812.5938 170576.5313 82754.1953 323885.25 172012.6094 132893.0313 220185.7813 424611.3438 318051.9375 181867.1094 156128.5156 121659.1641 149320.6719 93381.6953 80548.6016 116306.5859 302542.1563 198972.6719 178138.2031 234324.0625 127529.1094 483651.9375 168068.1875 637206.6875 116188.8047 97340.9453 536571.3125 482794.2813 120788.4375 598692.5625 191006.1719 242865.5 203936.1094 181355.8438 193375.7969 153738.8281 351772.7188 472658 226047 400896.875 391259.625 351711.6563 1962063.5 223078.875 345406.3438 962146.6875 252153.7813 154939.3438 293346.3438 265919.5313 178763.75 236781.8125 156057.8438 232210.1094 170219.7031 98667.0859 171622.625 144297.0156 251338.9063 140123.1406 678937.5625 168247.9219 197720.6719 363604.2188 415506.0938 131885.2188 128410.7734 128983.125 101657.3125 116540.125 159394.4688 321298.4375 159570.5625 302741.25 211521.9063 255309.7188 176354.6875 168678.1406 150268.3438 209216.2813 169363.0313 77425.8906 204274.5625 359397.4375 212840.5313 84943.9063 229184.5313 117544.6953 373259.4688 124776.5391 90271.6719 250612.9219 100000.5469 396511.9063 144665.5156 458488.7813 424396.0938 235316.8906 139353.5938 221080.7031 296434.4688 244381.4844 107281.5391 145218.8281 340252.8125 194540.9375 146862.8906 259482.5 107444.8359 214685.4531 232078.6875 110934.3281 217312.1875 117440.0547 189165.5938 222701.7813 231854.3594 69094.5625 208401.3906 160365.0469 192301.5469 184020.1563 447145.9375 106024.5469 124648.4766 181410.7344 182921.0625 150160.5469 506273 367831.7813 173774.3906 233334.1719 387160.3438 139502.625 77803.2188 190743.3594 260477.3594 294569.2188 107193.5547 424685.4063 255615.8281 289403.2188 131152.4531 166376.5 216643.5625 145066.5313 150472.7969 226636.7656 167537.4375 422017.1875 106566.5234 205165.5625 338454.9375 427259.3438 179188.6094 206183.4219 281391.9375 238624.8438 171629.6094 223270.8281 222752.5625 254935.1875 163599.0156 345419.5 193149.7344 131170.5 348380.4063 279389.7188 368700.625 161659.5313 133950.0938 145477.25 72972.6797 127120.7969 149638.25 212734.9219 333779.875 656825.8125 226047 331378.4688 91528.7188 185906.5938 151776.5156 329850.4688 305800.9375 376164.4063 304055.7188 766546.6875 184075.5 159939.4844 106949.7109 129463.7266 230248.0781 190727.0156 128864.1797 119546.9297 280416.4063 552866.375 103698.5938 271409.0313 226047 99836.4531 9-hydroxystearate 880136.25 1402202.5 1756524.5 571427 2817212 1900267 319724.5938 8192379 1240003.625 1469955 5928646.5 1036022.75 3060694.25 1601321.25 3099505.25 554604.8125 3085469 2780908.5 3241519.25 2378466 8635523 914948.8125 670199 798687.875 3429613.75 896844.5625 3023570.75 862755.125 8379587 940111.1875 2378466 1081893.625 343793.2188 522887.9688 539306.875 11148176 2113503 537453.375 2187020.25 33916244 2378466 2943356.5 3515850.25 574251.25 393553.125 10529787 557658.9375 1945458.125 5727958.5 1005658.125 701879.875 363437.3438 3495549.25 715058.3125 3706326.75 1266990.75 1373022.625 2744859.25 2765064 727269.875 1393059.875 484431.9063 3083329 1988703.875 1152176.375 4181372.5 860026 2948787.75 1918452.625 1856430.75 798674.875 2230210.75 1181159.875 2021332.25 1094786 1394833 1220733.875 2403981.25 1327089.125 869755.8125 2340031.75 6019299.5 4829804.5 2542012 409184.2813 1507271.875 2912260.75 2090422.125 2851229.5 2437931.25 950493.5625 3352963.75 961593.0625 2973296.25 2011405 7879917.5 5388379 1817150.75 4042478.75 5390910.5 2076374.25 7194102.5 7052870 2378466 2632950.75 13399709 7886134 1714503.875 1959344.75 2510009.25 4972404 1764240.375 3481502.75 1941139.875 3677228.75 10678645 2372180 1156787.375 450214.625 1155695.75 5731299 1637297.75 4870693 4462659.5 1477573.375 2263345.25 534545.3125 2153830 1987653.25 1004633.125 8218111 6124321.5 4520240 2856885.5 4655945.5 1567498.25 851156.75 2074469.75 1125212.75 3047922.5 511606.7813 1318081.875 4987694 2802413.5 2792420 2321477.5 1261887.125 6225279 2131038.5 14155784 1229688.75 4863650.5 5798758.5 1779842.75 3065862.5 1639864.875 1393502.75 1968569.75 2953472 264302.3125 2134674 13375159 1867612.5 1145314 2878961.25 2764959.25 1758001.75 255628.9531 5176186 2763020.5 1531094.375 5887277.5 1987128.5 803781.3125 696439.3125 4294817 363184.4063 3573805.75 2738679 2547975 3527206.5 1013014.125 4031544.5 653523.8125 1742362.625 3533069.5 4049488 1892572.25 664649.125 2528938.5 1402996.5 577312.4375 4595770.5 8024254 2789547.75 321587.875 3721490 6935317.5 1919290.875 1561972.25 9588844 3161296 5403082.5 4982295.5 10149327 6848173.5 11671431 2435454.5 5066924 19962552 941503.375 2479835 3038339 9576889 9615751 3861441.75 142205.8281 1322987.875 7745641.5 1355404.375 7855104 7118079 3258401 460402.2188 2257957.25 1025024.938 5474668 4893140.5 3029958 987596.0625 6312811 1872116.375 2401795 3697983.75 1653770 10307713 1043651.875 4925425 1249019.75 5261640 1123781.625 6660405.5 1624402.625 2142809 2447593 1800458.375 1637375.875 1729739.625 11473877 8646269 2804746.5 7235493.5 5348542.5 3491039 7725596 5261421 1080821.75 10237909 5772326.5 15251161 6789864.5 3020733.5 methyl glucopyranoside (alpha + beta) 359529.3438 480144.75 2619842.25 435419.25 377813.25 191943.5469 74624.875 426619.625 549668.75 526551.75 234601.6406 1100742.875 1264912.375 546745.375 616221 778135 303785.5 783882.0625 137613.5 790212.875 1002262.813 334761.25 448973.9063 2636576 1031130.563 176671.9844 425256.4688 406772.25 941828.875 796229.25 1204273.375 1499001.75 540909.3125 942062.125 872071.5625 526244.5 362405.5938 1416775.875 870372.3125 4403966.5 7560309 231277.3906 241644.9375 474826 843506.1875 496934.2188 1146822.5 296864.6875 34451.8008 390450.4375 114844.9375 768897.375 783478.75 293181.5625 155094.1406 96205 524267.3125 477209.7813 154202.2656 688124.625 28103.6973 130802.6406 36458.9102 22358.0625 29665.6445 150036.0469 841169.125 98722.6563 346329.6563 108034.3359 509069.4375 30774.0527 1047624.438 1042090 146703.9844 484452.7813 784323.5625 1847347.125 5833379.5 126908.3984 464544.75 231448.875 169788.3281 726694.75 147740.2188 663130 884923.6875 173416.5938 209400.5625 310233.0938 385281.8438 387355.4063 78634.8359 274013.9688 482222.875 352852.4375 791324.0625 500559.25 51931.3281 304177.0625 544500.8125 400520.1875 200991.7656 59998.3672 81413.7969 825589.6875 1348856.375 235830.625 213423.1875 22036.834 54976.7656 1251878.5 75539.5 399461 840258.5625 253214.1875 375097.5625 273029.6875 114464.9375 634889.6875 362996.4375 440005.5313 110535.375 514545.1563 478356.9375 1085730.375 370202.5625 828420.5625 519047.1875 215396.4688 223900.7344 829146.75 598156.375 162324.875 458029.5625 256159.9844 1876464.125 70544.2891 1979511 689878.75 855008.125 1382954.375 398401.8125 126329.4297 69139.0625 391494 111198.5 550113.4375 338844.75 420886.9063 145604.1094 366711.4063 238327.4375 34124.4297 293398.25 678662.4375 340169.2188 309712.7188 407428.0313 1512910.75 115414.9219 620447 208517.7969 80106.1328 1198671.625 86509.5547 795263.8125 153786.2031 394840.0938 136067.5625 404081.9063 1573006.625 286330 160274.2656 115333.2266 899171.625 801408.5 211813.5781 891064.875 243485.2656 1469828.5 378035.0938 679092.125 alpha-CEHC sulfate 97102.6797 157990.3438 93246.6016 179976.6563 91119.2188 274464.8125 95569.4922 139844.8906 665709.8125 104452.5781 96846.9141 50372.2734 87048.2891 77475.0313 192252.125 135073.75 75294.6797 115609.1719 753117.0625 506253.3125 446372.2188 283205.375 1539453.375 655784.0625 61680.6328 1024595.25 127126.5234 59419.9297 455579.0938 493009 1104457.375 329275.2188 55271.1914 190444.6875 53462.0117 82784.625 394139.6563 171810.1406 142475.1563 173237.3906 144848.75 80409.5 514655.7188 38838.5859 945664 60765.2188 1403822.375 49664.2813 361794.0313 793117.75 159315.9844 313788.8438 134300.4063 552015.4375 168983.5 185948.7344 199972.2656 1201838.75 54915.6367 75380.4297 48508.4219 804575.5 305605.4063 64292.1328 3846183.75 75865.1797 1251930.125 113126.1016 147879.2344 165385.4844 538449.0625 172581.5156 80127.7031 563328.375 1119085.125 1067814.875 139400.6719 179344.6875 240107.8438 42882.8867 166894.375 93520 79533.8516 1462599 103665.5391 74823.0313 264600.9375 83706.2266 295352.3125 659119 223720.9531 396240.0938 6694032 68672.7188 71744 72982.5859 25671.3066 89312.3125 497856.6563 416778.1875 1590963.25 567387.0625 171072.6094 709179.1875 100403.25 222131.6094 123078.0625 157842.5313 137755.0781 152302.0781 424698.8438 79558.2031 477023.7813 168983.5 342918.1875 29890.1621 47306.4063 298974.5938 alpha-CMBHC glucuronide 140895.4063 61031.1563 29947.0781 36996.5039 42393.9336 302552.3125 176837.5625 49099.6172 111327.7344 29615.4258 33400.043 62782.2461 26244.6836 125858.0781 51070.543 44618.8281 40474.3945 62739.3516 55671.8125 52073.0313 63446.2383 43745.2344 19468.7344 89676.5 92060.625 171885.4844 229649.7656 193269.2188 195450.1094 30866.5293 385189.2188 91722.8828 26794.7578 53288.2734 377065.125 134267.0469 36929.1875 149739.9688 64823.4531 34502.457 22762.7188 103228.4922 21149.4238 258628.1875 52038.5508 19660.7832 30525.5527 85056.3594 39105.0195 127183.4063 27681.7109 108157.0703 294075.125 30865.1504 198464.8281 135901.9063 112657.3672 349279.5313 121263.7422 33452.0156 58198.1914 343918.8125 28544.793 60279.4219 124942.7344 41643.0703 142588.3438 648827.625 90079.5469 40192.543 46916.3633 85244.0781 268406.5313 166772.8125 23736.4238 28153.502 42309.0156 75999.7188 572624.3125 103238.7109 889597.1875 71730.9688 48682.375 315977.5938 61829.8828 189021.875 346703.7813 232355.875 129946.7891 350224.7813 240908.8281 198744.625 43963.0547 26380.7363 49709.0039 107335.6016 169468.2813 380564.3125 81072.875 70729.7109 152831.5156 49384.0781 133443.2031 891624.25 91569.6172 48890.6484 90834.4688 1063308.625 154606.5313 65868.4766 49650.9688 377294.4688 33174.332 89676.5 374896.5938 71236.8906 120876.3359 89676.5 56591.3789 87783.3828 32436.5723 442583.8125 165988.7813 353714.6875 225782.75 40273.2227 133740.3438 50249.3125 101648.1719 25880.7207 62501.3906 89676.5 147021.6875 113657.9688 98771.8125 133918.8906 "5alpha-androstan-3alpha,17beta-diol monosulfate (2)" 223694.7344 272022.0313 4616978 1657192.125 648689.25 1635916 1615383.5 1394249.5 12214975 932314.25 966965.6875 433522.625 2511166.25 590063.4375 1349698.75 409990.875 1261282 366956 288772 6427751 977220 2214847 583197 639745 442757 176036.7656 524787.0625 308594.7813 768677.3125 114171 412427.5 228752.2813 319835 668430.8125 177772.0469 223321.6406 391332.375 175617.0938 366265.1875 183609.0156 192796.0469 333190.9063 414864.125 607420.0625 283454.4375 155601 180124 410736 564200 63800 414118.9688 121791.9922 270824 138298 237158.6875 412427.5 715221 426117 219264.0156 163879.0625 249841.3594 505987 561954.5625 192309 572972.75 233320.9219 1357589.375 168970.5625 943587.5625 175010.7656 N-formylphenylalanine 425349.4688 183010 198550.4375 231299.9688 203694.3281 115662.2109 80075.875 67060.5391 117287.2813 87111.6406 99146.4453 110044.2109 245763.5938 69599.9609 110726.2344 93682.0234 198110.4688 189639.1563 102007.1875 81586.0625 131000.1797 306400.125 265844.6563 99879.3594 300496.5 94262.3516 186938.5469 320002.3438 140653.0156 96781.5703 232011.125 201053.7813 196639.5625 317312.3125 272718.0938 233828.5781 243106.1406 134443.3906 138383 179441.5781 207158.875 165245.4375 72634.1484 178095.6563 150111.9219 749113.125 1181413.75 307646.1875 291549.0625 713352.5625 556562.3125 130998.7422 291451.875 225901.8594 380090.9688 347473.2813 826442.875 843912.9375 207255.2344 229897.0625 213401 512487.25 95856.5938 600417.75 374648.2813 2098407.5 125369.9063 477744.8125 179434.8125 329032.9063 982944.4375 241661.1094 202663.8281 165243.0469 243261.4531 765106.3125 893362.8125 1494726.875 393798.625 133633.9219 662610.875 36907.707 431477.5 217016.2344 119752.0703 503491.5 180132.375 1014274.75 820125.75 342831.8438 986747.375 1508049.125 880626.25 1616603.75 361738.6563 858743.6875 804796.9375 350635.6563 200423.9531 249980.0625 555270.9375 381702.6875 242376.2969 195180.2969 333300.1875 231969.8281 1072626.625 314118.6875 88924.4766 293801.2188 152476.4688 123809.9766 875792.0625 358826.0625 1280278.125 195463.25 1434521.75 1998142.75 1883300.5 201007.4844 514554.0313 133902.375 590763.8125 705489.875 452227.0625 343124.5625 466831.7188 357298.2188 403380.3125 282628.0938 109637.9141 1112751 171507.8594 205567.6563 939757.3125 1182588.375 487229.3438 189230.2344 223042.25 317778.1563 1021855.938 194561.2969 89894.1328 310951.875 155427.9688 652924.125 1370945.625 622492.4375 562150.8125 313120.1875 123044.7734 239666 349928.0938 581165.1875 453067.5313 454837.6563 615641.625 502209.5 923494.875 447220.875 295334.5313 494436.8125 371348.6875 282166.7813 197639.625 135611.9531 382313.875 333128.0625 305658.4375 236837.9688 847341.4375 246599.4375 152422.5 1148107.375 289481.3438 156287.375 493068.7813 421725.125 395023 514879.6563 194860.2188 1031848.813 152024.3281 516113.6563 241158.8906 266922.7188 1117248.5 252398.7656 271181.8438 146435.2656 174603.9688 2344101.25 669519.8125 428830.75 156735.4063 3212533.5 540617.1875 182151.1094 123986.3984 758829.375 938676.3125 310342.0625 113472.5391 1126144 521320.2813 399545.3125 218123.2188 1111575.375 385776.6563 515551.1875 584003.6875 293368.5938 221400.2656 892449.6875 124925.25 221773.7656 236551.1563 250097.5313 572184.625 1257476.5 1012441.125 211339.5938 524655.5625 688599.25 153222.8125 402613.5313 202682 926814.6875 1279357.625 211537.6719 287792.6563 260252.1094 374681.4063 438043.75 97038.2109 662292.125 290076 487090.7188 1418220.75 214860.2031 140664.8438 182065.6875 583841.75 840242.0625 339050.9063 575893.375 307191.7813 432927.5938 238515.3281 242299.5938 1221181 447524.4375 147635.0781 607993.8125 197578.8281 264024.5313 109180.0781 300496.5 215990.1875 404838.4688 358483.5938 238447.5781 323654.9063 298988.9375 104847.6563 1122411.25 302004.0625 248358.1406 340791.25 494957.2188 377969.2188 215231.3906 147321.9531 405166.9688 276354.5625 227683.0313 408845 230863.6094 234940.6563 124333.9531 4-hydroxychlorothalonil 124419.2109 198856.6406 579478.8125 576825.8125 588574.875 274992 241612.2969 280375.3125 383730.25 957277.1875 909538.1875 1698537.875 217307 254641.6094 101327.1797 511181.0313 411623.9375 822502.875 912647.0625 429286.7813 811289 228539.0469 397911.5938 472049.5938 171520.5 1862210.875 610906.3125 865950.0625 77099.7031 379457.3125 565965 762465.5 459247.4375 1718202.375 184282.3125 128663.0078 2095607 482003.75 45407.6406 115306.7891 23569.9629 562528.25 170002.6875 265656.5938 109896.4844 374135.875 196640.4844 74002.6172 446379.5938 88109.6641 364438.375 211987.7344 110558.6094 187014.7188 122785.7578 125692.9766 1048807.125 243452.9844 112584.1328 129624.1797 129400.1094 155804.8906 30318.0527 250988.25 404926.6875 424940.0625 452681.6563 205309.5781 292872.3438 159230.0781 114534.9766 243975.7969 178949.375 234723.0156 122237.8828 113038.1016 224249.0469 210364.9531 58953.0938 424712.2188 185980.7031 146659 111309.7969 71698.0781 240654.9063 860776.3125 269534.75 131903.5469 101375.6172 102122.9063 45896.4844 467779.4063 146086.3594 528553.625 264390.4063 65872.2344 55558.0078 50011.6992 110791.9609 217307 205729.9375 235757.3594 35824.4141 200368.9063 144344.0469 101094.1484 43247.7148 285679.2813 753495.3125 150705.4375 250507.5156 108813.8516 47093.1055 87807.5703 217307 395309.9063 145343.125 isoeugenol sulfate 137899.2344 409041.4063 130759.3516 252400.5938 94150.4766 117027.5547 332015.3125 98469.4531 95302.4766 113251.4219 140205.9375 205404.1406 234707.4219 595531.1875 232421.7344 73827.8984 113234.3906 185127.625 298575.1563 344492.5 113039.7266 185991.6563 259188.3594 141249.875 117705.1563 1222491.375 74086.4922 277100.8125 79378.3359 199720.25 342103.2813 233896.2813 52137.2461 196145.5156 299160.7813 291994.125 182725.9844 476450.9688 224507.5156 141808.2656 90228.6406 140031.5781 72010.1563 273884 66451.1563 162125.8594 96478.6484 51367.8516 90836.3281 288873.625 129962.2422 95253.7344 100263.8281 476995.125 52613.0391 182402.375 102326.8047 281005.5938 355824.1875 92313.1484 812891 437650.625 181538.3438 84743.0938 101750.1172 161646.4219 741056.4375 61070.7773 372537.5313 101899.2031 239784.1875 178294.8906 200810.4063 62306.9688 137654.4063 48750.0195 289500.1563 260212.6719 199843.625 473426 226280.125 183765 773628.6875 185606.3906 779865.875 394490.625 55833.5156 751295.75 576878.9375 106226.7969 198579.7031 45479.8789 259403.5781 tyramine O-sulfate 2255397.75 101474.3281 743170.6875 488785.75 1779638.875 895488.875 1665665 1757759.25 227597.375 2930096.25 86088.8594 2979633 1512328 899185.4375 541912.5 1217484.75 233134.4219 794684.625 1165364.25 1051898.75 304840.2813 1401642.5 1309274.25 312243.6563 2405971.75 180400.6094 529168.4375 161908.1563 217473.2031 715844.3125 1293692.625 330696.625 202943.4219 442267.75 120868.9766 648444.0625 336080.8438 3893311.75 170802.2031 2893353.75 597297.3125 123317.2578 90907.7109 404197.5938 393634.0938 31251.1563 252937.4531 4665450 394920 82451.6563 2630293.5 31462.2129 345627.4688 718277.8125 151942.8906 215469.7813 1227680.25 219246.4688 191804.4063 214120.5313 28530.7129 30457.8105 1858891.375 58697.2148 29449.4473 20235.2441 535237.1875 24825.9121 246140.8125 698543.5 20015.6426 754343.375 1180623.375 398121.375 503548.4063 975053.9375 471447.3438 564424.4375 99887.7422 844097.4375 601710 21301.1211 300269 186527.8438 264793.2813 939083.0625 27224.3223 391718.625 85806.5078 4714165.5 64961.7695 38698.0078 2573829.5 30085.834 120977.4922 459101.25 186229.0781 151805.7813 31563.2754 2528016 616749.5 438865.9688 134140 19905.0977 96113.4844 1569151.875 32505.9082 1467126.5 885127.375 299079.125 37624.6602 1462582.125 247904.3125 105946.8984 1169571.875 521284.4063 2869530.75 32494.7051 4213309 1255530.25 2661792.25 216130.9219 199418.2344 85058.1719 470462.6875 394920 4515231.5 146505.0938 51882.6563 103111.8359 1351515.75 62480.375 95749.0234 149728.1406 717736.3125 40151.1484 1137972.125 3900126.25 419254.5 160879.6563 2344926.25 521477.6875 395925.9063 4579264.5 985552.1875 3167717.75 2994666 2463842.25 91463.6406 7658330 284191.7188 278962.7188 945315.8125 486865.9375 24247.0781 6560460.5 288076.875 2290994.75 33676.5508 490943.6563 1276014 376951.0625 130756.2188 2268795.75 29397.4844 119170.5156 403326.8438 652744.75 702026.6875 6514526.5 684467.4375 45348.707 366339.8438 4520073.5 115462.1797 871992.1875 1005832.375 62225.293 54570.9063 393747.7188 38228.5547 388886.0313 232412.625 982805.8125 181484.2188 348467.125 230675.9531 1425255.25 88923.3047 3290129.75 1503891.5 102953.0703 61278.957 40797.6445 655950.1875 175276.75 1558124.875 275924.9063 906528.6875 11755744 1248045.75 393914.0938 56888.2461 173656.9375 182191.5 340246.9375 111884.7031 558168.0625 396092.2813 140718.1406 251876.6719 67505.8359 848596.25 1595718.25 65228.4258 250839.6094 224701.6406 2658047.25 69967.1094 1500796.125 1378726.75 25634.1406 544423.1875 6960243 208495.9844 179921.1875 36354.1211 242362.0625 151899.1563 53778.1563 493237.4063 177099.0625 984840.5625 409391.7813 182527.0469 263897.7188 54307.8398 563948.875 2115189 229707.9375 57770.8828 2102492.25 505883.0625 96219.125 624956.75 1807404.875 183570.7813 82473.6875 434937.8125 4638020.5 6780007.5 808276.5625 2626415.5 1789631 654833 47939.5664 631850.125 882371.4375 3-hydroxypyridine sulfate 29249268 51294228 276001.625 19856052 1088517.125 1295576.75 29948362 1949037.25 1056479.125 39265692 13088547 751818.125 22263276 219065.1719 4382437.5 700687.4375 5671327.5 651062.5625 8458862 16048703 17581760 29198158 1161854.5 28163048 1894298.75 39106152 2380320 11554605 27727514 158263.4063 1096074.75 26517436 22111772 95352784 18403884 120674.2969 2670196.25 19443598 38790960 19834402 12080007 1055715.5 34986772 1026867.375 211876.7969 6336570 193040.9219 329820.7813 888246.375 842021.5 879431.1875 369418.6563 782491.875 1481086.5 211627.375 1217241 116803.3984 118393.5625 218947.5781 4791792 140454.7813 479704.2813 1037018.75 4835830.5 27321.7188 4775333.5 283547.1875 614739.625 318547.9063 398009.8125 71486.3516 91362.5391 893011.9375 214950.875 99006.125 210974.4844 510901.875 519883.9375 375772.5625 6941365.5 416539.9375 637360.25 335000.4063 102573.4531 1565229.125 89667.3438 75584.4922 181914.5625 750495.875 543122.9375 3150604.75 334572.3438 427736.5938 50405.8359 57299.8086 586344.625 110894.3594 1279940.25 48949.418 45045.3359 213373.625 260642.125 1499249 233996.5625 2067248 2087193.625 586565.3125 726925.8125 106251.1328 1234998.5 1676344.25 300288.9063 330253.5 596537.6875 151026.2969 674796.25 4738193.5 3901055.75 3640092.25 77210752 673990.9375 665310.0625 62699.2969 77695.9922 484170.625 1068957.75 227363.7188 63266.0703 507599.9688 429699.875 485796.4688 240931.7813 999848.8125 1415342.125 2706285.5 1902089.5 503626.6563 138800.2656 44963.2227 1314949.75 993444.625 124287.1797 111443.2813 63501.9492 742913.4375 92721.8906 183105.5 200791.4688 314298.5313 1939533.375 75940.1563 438349.5625 37887.8281 424227 2298290.5 428252.6563 2485810 293422.5313 168943.5938 186497.375 2306267 1247338.375 4085694.25 210238.4375 8378055 407022.4375 501594.1563 1717628.625 170477.8438 4112308.25 1700741 226273.375 756858.375 33673.4727 619141 535310 130658.1563 1169821.875 3449242.5 91678.3906 6932367.5 91553.2578 136655.75 2061050.125 313332.7188 24798.8535 24796.6289 1208031.75 266094.5313 678851.4375 257953.7188 359912.1563 714002 1341367.625 594650.0625 1023561.75 1263232.125 221904.625 133911.8906 1522263.625 2583858.5 578259.9375 50282.6367 237144.6094 1768333.875 1240774.75 6438006.5 508786.25 7403180 1324388.375 181542.0938 1999733 361407.6563 1965358.25 117813.25 531827.3125 3310994.25 74314.3594 687831.1875 716284.1875 388448.4063 368419.6563 343980.7813 99847.75 447624.2188 8022474.5 5590950.5 127122.3594 135495.6875 2283957.75 31515644 853605.9375 478266.8438 2564114.75 32067462 238875.0781 393057.3438 9612707 197676.875 33188.0547 1659391.375 428896.2188 75758.5781 225265.6563 172996.2656 31328.7266 1208233.5 11870229 111236.3984 586455 175751.7031 162186.3281 6567841.5 156070.1094 66492.0391 479714.9375 1245128 382508.9688 352822.4375 131935.4063 11992575 693195.0625 43528.5742 130982.4531 660185.4375 243879.5 19292642 341269.375 5192574 35439.0938 474836.125 472282.2188 246243.7188 3715335 2149127.75 4-methylguaiacol sulfate 70709.3359 172006.4375 458090.6563 114564.2734 116258.1328 209281.9688 39651.9727 77267.8906 149403.3906 739915.125 1979700.125 946324.1875 512296.875 403666.3438 51561.2813 112801.0469 165261.6094 309641.9375 78136.3672 230412.5156 50812.6719 585943 241379.7656 532231.25 171445.3594 115395.6641 233376.6094 210191.2344 270681.7813 206453.2188 2041706.375 368493.75 129436.3828 817286.3125 119229.75 666178 777218.6875 122949.7656 464020.6563 1349684.75 891002.125 279191.625 1270995.5 749258.4375 3778795.25 1610788.5 61161.7461 309850.3125 60666804 9099443 270728.25 176904.6094 170358.2031 402077.4063 30260.6641 4641069.5 630602.875 3188049 329598.0938 379120.3125 1100430.625 289034.9063 183164.8125 1014530.688 108760.7188 1352253.125 466409.5 383970.5 63006.5352 923558.875 557482.625 108273.8125 65272660 1110995.5 817767.3125 1979965.375 123335.0859 187342.2656 220539.2656 248332.6094 501276.875 1019414.688 367522.0625 337348.8125 5536662.5 167395.0469 525167.0625 15952104 356506.0625 3806908.5 81599.3594 113760.9375 95611.2969 2415468.5 3313746 8272168.5 36464.0938 377196.0938 834590.5 772212.875 310656.7813 2512753.5 96714.3594 232125.7031 312136.9688 71923.0391 470411.9375 57129.2617 437084.3125 45889.9766 2138669.25 4090593.75 363622.5938 1173706.625 1250332.875 492272.5 7217943.5 258413.3438 46028.6797 26877.0078 79257.8516 1077294.625 20136.4004 266850.2188 392385.2813 141476.2656 82167.7109 270719.1875 985792.125 12141857 52629.7656 187929.1719 187350.7813 1585823.125 247311.7344 169684.1406 29847.8867 1100131.875 50715.6211 2451311.75 5732047 8004278.5 420095.3125 144098.9688 2958885.5 2027634.75 32401.4414 48306.8945 48705.8945 83041.4297 305637.5938 933660.125 263227.8125 1681098.75 273512.75 766391.3125 452529.25 72420.9141 498911.4688 1421358.875 2420554 78860.7656 286382.75 390744.9375 6501573.5 2606665.25 123088.8672 408509.5 4048497 50810840 28783.0215 62052.4609 383970.5 397299.5938 5271280 517049.5313 186470.5781 1228318.875 262551.25 6449711 13050017 131597.5781 1268176.875 13289549 3329618.5 441883.9063 817416.875 375555.7188 17806966 150060.2344 615496.375 3411927.25 81668.2109 84469.0859 1946763.5 1552863 247414.4531 4223183.5 1524304.625 301435.9063 587416.25 34561.2656 11071733 206086.2344 105414.4766 459187.9688 710148.6875 47176.6563 25444.1758 92489.0938 696073.5625 1438424.625 218952.6719 14504847 9174332 236080.2344 10117353 1486086.5 195184.4063 1351953 129730.4453 4735278 354857.9688 73865.6328 5375140.5 4232211.5 maltol sulfate 69803.5547 204680.2188 98459.1328 154638.4063 1168027 60326.5273 549937.0625 50168.3945 93981.7422 139127.4844 7699840.5 64448.0156 216733.5 98974.2188 675531.3125 633488.25 135838.7344 45025.4609 594834.4375 2079640.5 52413.9336 81206.3125 228786.7813 120418.5 397856.1563 39567.6719 417981.4375 855236.125 157559.0313 104562.2969 1168796 986975.3125 2102260.75 150560.2188 86623.1875 93546.7969 148437.9219 198999.3438 210631.2813 1861463 222835.7344 115382.7266 79544.9766 178609.7031 95386.1094 724471.1875 7061712.5 444497.6563 4296971 411577.375 156143.8594 337196.5938 239010.0625 70215.9063 66814.6719 105740.9922 1130698.375 180710.4531 53893.9258 1225741.25 639808.8125 55588.7656 221678.6094 553051.3125 2003792.125 155394.7031 62653.1445 176489.4844 216733.5 90984.3516 134958.75 661925.5 91534.5625 310459.1875 286191.9375 367247.5313 1038733.75 517735.9688 248437.625 241320.5313 138020.2813 364040.8438 179626.3281 696604.375 226565.9531 461584.1563 122822.4297 205856.375 238438.6406 245831.6875 248444.5938 2248161 194456.9531 278536.5625 methyl-4-hydroxybenzoate sulfate 946900 36706872 16228581 27274294 697982.6875 52625220 2394583.75 250619.3125 494540.625 1450354.375 291742.25 5775755 5249700 4704392 4072384.5 309845.25 12702314 25873096 2481347.5 9723622 3231891.25 1993630 2387044.25 1810593.625 560935.125 143702336 856193.125 34735.625 25160522 100036.8672 1316138.75 15336899 197650.9844 3526475.5 439024.1875 1793324.75 29404888 338570.8125 16983284 3846014.25 13569047 878177.375 157381.75 242790.3438 52525.6445 19076604 11135914 15824623 20810776 407824.25 5789709 3331849 7492945.5 11281288 179298928 73149200 7389366 960863.9375 1779039.75 54247472 4121961.75 715717.5 316277856 3789527.25 2892191.5 402195.6875 13091876 150022496 1717610.875 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8323794 18063792 6900749 531822.4375 713953.125 363911552 3237339.5 486904.4375 1386105 9701423 157699.8438 240187.2344 788420.625 1767628.875 6807290.5 1422358 2255440.25 68122472 1832758.25 20628942 1596337.875 412216.3438 8103183 216383.7969 28760808 7120442 902819.5625 128340072 16401898 acesulfame 22434.9629 24320366 9930573 64355.3867 9045172 239930.1719 318650.625 3701104.25 184137.8125 39873196 221803.0313 61920816 78108.2578 40249716 14502750 102441.0156 740320 36965.0273 6202954.5 76314.0391 740320 260659.3125 9736839 740320 1208509.375 217557.5469 8205917.5 457674.8438 133320.9531 267731392 4059480.75 2741916.25 1041018 173916.9375 3002115 2857858 204712.1094 894014.75 362542.875 239824.9844 863703.875 29082358 2571798 1267013.625 795356.9375 549843.3125 15415.0518 231186.2656 317661.125 80244.6797 9929757 187745.0469 189076.1875 19155240 740320 10849694 2600347.75 86873616 764722.25 21555.4824 463093.75 92869.8125 66761.9844 740320 11049969 183406.5625 278661.9063 ethyl maltol sulfate 5548630 2407919.75 1509444.375 240569.3594 44363.6328 1182049.125 119813.4922 135261.0938 149671.9063 142466.5 131769.5625 48086.3164 96251.4688 131794.1719 70164.5703 159139.75 153163.4375 142466.5 327882 25488.916 41153.332 307866.6563 syringol sulfate 87836.4531 49421.7109 23737.7324 106353.7188 55962.6797 179667.5938 139792.4063 84585.3672 149349.4375 145422.0313 65679.7109 26289.9004 33240.4922 38526.2734 142294.4531 139038.2031 296011.625 58510.1484 102340.1875 54724.3086 21663.3066 24806.4043 36746.3555 142140.8906 209721.4219 148297.0938 53038.1641 175005.9844 561366.25 486031.75 1817008.25 43134.3711 470705.2813 74497.2422 43103.4453 48187.1719 311853.9375 226020.8125 959510.8125 71759.7422 145015.9688 38467.4531 322551.125 405229.9375 33598.8516 848291.375 1010182.75 80601 60526 105684.1406 349845.4063 19399.1895 289022.375 1773465.625 59488.3711 114660.1875 130855.9844 27452.1055 337996.5313 83679.7344 316739.8438 105075.8438 392648.875 142539.5625 1658624.375 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27350.7871 55764.3125 25726.5059 147492 88979.25 358058.625 266351.4063 534934.875 41825.0977 32931.4609 219263.9219 203431.1094 189789.2656 946546.25 72094.3125 149915.875 1962652.625 25710.125 66763.5078 763483.75 1478637.5 378680.25 60995.0703 98513.0078 162871.25 23514.4863 322375.0625 93444.2266 64095.6797 101633.8906 968480.625 135229.375 209373.0938 119875.5 1411019.75 465783.6875 30637.8887 39964.2734 100089.375 119448.7813 545996.8125 821121.75 3977089.75 69759.625 147492 80126.7109 27706.5215 206707.0781 75643.3594 84963.5 87165.4453 94760.3828 257144.5156 42453.4375 189776.4844 232948.6875 887679.125 689175.1875 572502.25 53160.8672 79222.5547 130841.7891 1148545.25 192238.7031 117972.5938 49520.4883 92328.2813 223614.8438 252812.7656 69247.5859 96497.8906 46934.3281 112560.7734 289482.9688 184251.0625 57505.9453 45792.9961 766578 147492 105499.7891 39411.3906 157423.5625 481403.9063 47287.2656 358619.6563 546650.1875 539294.0625 140186.0781 1509731.25 85785.0234 117501.9922 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14977643 438873.6875 9666149 156921.1563 51761348 548787.375 781963.375 332781.25 579853.625 2082440.875 238763.5469 365034.5625 4001862 1621329.25 262063.5781 59015.082 1116126 1256134 10974750 260597.0938 582346.0625 1227962 4921493 9668592 190940.2031 482234.6875 584083.125 513035.7813 491297.5 797846.9375 710979.5 507064.5938 33860084 866378.1875 235424.3125 739344.5625 164072.25 19176666 1095363.25 4263838 291914.3438 2014480.375 25657582 302784.375 2850674.75 375230.9688 1727331.875 284589.625 495061.7813 737588.4375 403788.5313 208872.875 2608278 daidzein sulfate (1) 146110.3438 3085392 84978.8125 532846.0625 228644.1719 2038029.375 35686.9805 414048.375 287508.8438 45445.9102 1499906 240995.75 53839.6445 123022.1484 818979.0625 149849.2031 371114.7813 56719.1484 125300.6875 9497522 1652531.75 266310.0938 200088 856016.25 350934.625 261816.9219 47840.2656 202039.3906 185997.4688 77903.2266 132612.3906 1018020.875 97003.5156 1556807.75 200088 4097759 121737.1406 184466.7813 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5265431 634189.25 838978.3125 194394.1875 34622.6172 1060163.25 5830477.5 2854710 88530.5078 1054996.875 316975.125 157922.1406 741197.25 1282706.25 29923166 3773925.75 45959632 248620.4688 17071690 1115424.25 1011719.5 3437299.25 786292.5 561706.9375 27678.3848 1092818.5 412926.2813 148872.5156 1133334 1405394.25 141798.2656 89933.6172 1310502.375 52837.2109 2998672.5 2651421.75 38693.6367 1228546.25 1362895.5 9039676 49723.5898 1481702.375 19138082 6689466.5 65931.6797 930620.5625 88088.0938 28100552 1680836.125 1998757.25 12295714 704374.25 4690076 238558.0938 30773.8828 310658.2188 43084.1836 276559.8438 70501.7188 171820.4531 1667187.5 1901300.75 633911.125 2396607.25 722866.1875 445459.4688 51407.1992 535775.75 2946626.25 2413203 10499136 6743949 335185.625 1474216 190559.0156 2839853.5 30806.0879 108595.7344 1199952.25 149462.8906 5581173.5 605313.5 23616980 1121876 2486957 184186.125 2015130.125 1097594.75 925844.3125 1011719.5 41425.6797 1756216.125 1032786.875 6972066.5 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186090.2031 2569710.25 1712960.375 4782808 518908.5313 "trans-3,4-methyleneheptanoate" 648837.125 186430.6094 131388.2188 241921.3594 168440.7344 131639.4531 420690.6875 99137.2344 82487.5078 596115.0625 188399.75 356958.8125 245513.0469 205055 388462.0938 665726.375 74281.7578 237594.3125 240585.2969 331898.4063 313793.0938 115630.6016 725468.0625 108005.0625 566420 272970.1875 205055 233486.0625 625278.1875 359924.9688 283397.75 652729.8125 109920.25 196490.6094 213619.3906 74384.7656 215455.6719 371414.4063 160654.8906 86038.4688 233890.4219 553849.375 389788.9688 40368.2969 159947.9063 315994.875 548726 82988.9141 143390.875 131973.25 133580.3438 81204.4922 721083.375 57290.4844 151987.4219 199419.5313 63498.6992 96265.0703 70881.4609 278327.9688 248390.75 99897.9219 146760.4531 68965.2578 96669.6875 403976.4063 124643.5859 1092292.625 210690.4688 114359.4141 314499.8125 166327.5 382859.6563 107499.5391 194654.3125 450190.5625 276159.5938 622216.625 60748.2305 458887.9375 223282.6406 119488.2188 161309.9375 487195.75 113009.7578 90849.5781 367924.5938 152343.5938 187259.0938 218400.6563 136863.9219 43414.1094 215049.125 302198.6875 44296.3789 81176.6719 375677.375 46022.1641 508313.375 319113.5 73358.6875 336729.5 phenol glucuronide 74075.4297 25123.832 24783.4629 97199.2578 100250.5938 630381.3125 53777.2852 259208.9219 360557.5 2837937.75 129453.8516 198500.4063 953066.75 113948.0078 79530.2813 70908.3359 55398.8477 72096.7578 54265.0273 81997.2109 52547.0938 83136.8047 66322.3203 237814.5938 828770.5 41442.5859 294954.7188 66896.75 799838.75 51486.3555 229278.25 237025 139434.0156 834616.9375 344387.7188 361637.3438 19967.918 120371.9375 106595.8828 41338.1016 254239.3906 140975.4531 48898.5391 166807.4063 863436 12531814 4260071.5 1661998.5 390826.5625 1311225.375 83249.3281 105824.7266 417295.8125 8803333 769306 3700645 456765.6875 54361.4844 141262.5156 2319249.75 1308452 59996.9141 295634.0313 69876.4375 8584016 5305521.5 102567.0391 9808387 412602.7188 1062689.625 114837.7422 1110626.875 386068.3125 398019.9688 360557.5 17054714 313456.4063 7610915 2407399 482658.1563 2189943.75 224969.4688 1595502.75 156074.1563 24474288 347045.5313 498089 6117023 398020.4063 27094690 1218212.25 379826.0625 1068889.25 9222278 67174.4375 676292.3125 360557.5 6802294 7054444 63209.1836 360557.5 2255173.25 540200.5625 6858864.5 438880.625 3174013.5 98920.7969 1565021.125 6348215 108167.4375 881182.3125 2317748.25 174975.8125 195195.9688 330288.4375 305813 25810428 140994.0156 738094.125 417510.8438 linoleoyl ethanolamide 252449.6875 331976.0313 185493.1406 270993.3125 247617.5313 344348.375 263425.25 117796.8281 42417.4336 96090.3594 273534.7188 228416.5 128711.5703 261112.7188 170206.3281 153083.1719 301573.125 338767.0625 208759.0469 386844.7813 52171 64691.9883 124975.7813 217794.125 93623.9219 238662.0156 884482.625 43595.7695 108885.2891 205160.4219 88662.8359 151575.4531 127676.1875 185033.8125 37323.7305 261721.5 912233.75 760119.125 227021.0156 174533.4531 380893.9063 472528.9375 378941.6563 556997.1875 279375 438824.7188 188471.8281 128801.7188 497500.0625 261721.5 299732.0625 1164642.25 444296.25 202604.2031 1007311.438 43618.4688 220689.9844 514981.5 314205.625 601197.75 214432.7031 281061.8125 360123 171583.5938 253224.875 451038.6875 255575.75 612525.8125 3697054.5 209204.5313 107671.3203 397057.875 343617.1875 580501.25 507999.9375 195134.4063 1958263.75 114484.0547 126348.4688 1775679.125 455960.4688 172741.8438 133654.75 738225.5625 222296.7188 117903.7891 896538.25 604515.875 357995.2188 159630.5625 939768.625 432552.5313 213732.8594 332380.8125 326584.1875 85886.9141 236397.6875 706514.75 463516.6563 536849.4375 529248.125 1479673.375 116463.9141 448370.5938 261721.5 309349.7188 484984.2188 507573.2188 576482.375 292064.4688 410360.375 160771.1563 113774.3438 67284.4375 154204.6719 368483.4375 285410.8125 942257.25 314923.2188 981783.5625 710577.9375 566342.875 72125.5703 225109.0625 375921.5 1069139.375 335676.9375 67538.4219 854933.4375 309540.125 487739.375 544893.875 184871.5469 465995.4063 308184.25 261721.5 292367.8438 79445.6172 232602.2656 897387.0625 160181.0469 341146.5938 92824.7656 461543.5938 150654 181291.375 110562.0859 651085 240581.6719 68407.4922 210502.3438 359414.9688 261956.9063 307521.0313 61287.5508 112336.7813 826658.4375 388853.5938 25473.625 98529.1875 589555.625 239309.1875 321884.7188 512667.2188 272955.25 335349.1875 510930.9688 155619.5625 254963.0938 372081.0313 355497.7188 668031.5 399187.4688 40061.1328 174042.5156 422177.5313 535668.875 433865.9688 670831.75 589223.4375 344871.0938 399029.0625 945949.5625 1788462.375 376011.2813 52972.7227 200512.8438 598272.5625 98441.3984 194797.4688 254555.5938 1370151.375 183235.1875 193641.75 305408.3438 518138.8125 52154.9648 124800.0391 79534.7734 377129.0938 492758.1875 257514.7813 197678.7188 628769.5625 237754.4688 38173.3203 136431.1875 276386.9063 525003.625 235975.5 795207.875 443593.9688 99634.2813 93105.0547 224262.75 146346.5469 139123.2969 195040.3125 202802.8281 60082.2578 235126.0938 303416.9375 29110.8809 204890.25 670127.5 184124.25 401658.75 310552.25 280105.5313 259413.4375 200097.2813 105031.8438 189571.4531 98417.6094 485927.5625 142195.9688 70683.5703 343281.5 215692.5625 216997.7188 240314.25 94135 146573.1719 190920 165543.4063 64443.7773 2-methylcitrate/homocitrate 1179168.75 1249847 328255.3438 1698677.375 864929.3125 106826.1484 636955.6875 639866.125 755634.5 94701.7656 842997.4375 945721.5625 877450 3462165 1491809.625 1879986.625 2704831.75 1136602 1182207.75 1088283.75 963673.1875 1194940.375 407594.1875 688168.125 1214020.5 319306.875 1188462 1848809 455617.25 211373.5781 541539.375 1308527.625 709950.8125 748667.0625 11248736 7848539.5 2783042.25 4580553 7405608 5339737 221100.1719 8487270 5525794.5 95164.7109 10386786 1722748.5 17193774 544964.3125 4783406 1146661.375 4082619.5 271088.3438 6046258 3184373 1569618.375 21480266 4955768 1662209.625 515612.875 6047483 2338859.75 10852093 5597530 6970874.5 4130956.5 1288258.25 1827148.125 1223352.375 7008583 508932.0938 1259721.875 2505787 8947467 3570517.25 3160510.75 17013952 10706949 9198344 824542.25 3262964 1718720.375 4304531.5 2974483 1042376.563 4781582.5 2423195 235306.0156 1177682.625 715476.5 1976838.125 5963870.5 4315519 1125183.875 2201097.75 1382268.25 5944151.5 12053641 2147290.25 3299934 3820208.25 11175657 3664848 7708958.5 6601235.5 2676662.75 382243.8125 3032536.25 10833935 14374498 1704151 13758170 2287421.5 7533913 1790533.25 1984016.375 6264377.5 3478327.25 2111997.5 15461811 3103683.75 1906774.75 5125195 4216806.5 1848272.25 2628556.5 2845282 11410307 2656234 5683328 4984241 595264.6875 4179933.5 14229673 2891951 2367655.75 1481165.25 4788621.5 1613189.25 2414116 1760940.75 3417794.5 1053968.125 19750590 3901414.75 3017265.25 2043649.875 2165990.5 2788198.75 2626975.5 905983.75 8438127 2037404.375 3509266 3393800 2920232.5 3103882 1383691.625 5320700 18791890 2879194 21028116 8445282 3180573 8493643 2776159.25 4559841.5 6745764.5 3611644.5 13083836 1257364 3556194 1632135.5 15510749 106267.6719 8450809 18232258 3028733.5 17309358 2458448.25 3371889.25 1741580.375 1962618.125 2293753.25 5743804 4297687 2903678.5 1547846.625 2810804.75 7935893 9235444 2486714.25 1574722.5 10778855 5172621 3844044.5 5621621 1196851.5 26155138 3089362.5 3189007.25 963942.4375 1433208.375 7082131.5 1531841 4734136 8065922.5 1814830.875 6475150.5 6041386.5 3562119.5 4049549.75 15944734 17235820 183433.0469 8596967 8530310 2074281.125 4473731.5 4726742 3275304.5 4222455 11653233 1528385.125 4516699 30581412 16597545 2866133.5 15891036 3140657 12684970 2719459.75 337138.0625 4231240.5 2931700.75 1235498.75 14427734 2654282.5 1030490.375 2472478.75 7641179 4639396 1525289.625 7566999.5 619579.5 8353235.5 876712.5 6197075 1926923.375 2256940 987167.625 1357206.75 3825034.75 8305380 2908603.25 2974483 3063156.75 437426.6875 5602396.5 4289818.5 5726706 1518748.625 14386594 1471460 5461338 2641211.5 1929845 22795888 8845588 oleate/vaccenate (18:1) 4177889280 11269957632 7681521664 3751951872 1148595968 3585345536 3214121472 5036265472 2337171712 6561362432 5477193728 7728942592 1915714688 3452609280 1812345856 4018022912 1805380352 4434293760 5910691840 858062848 6543191552 3894095872 2951629824 3483085056 4058817792 10317379584 9692093440 7324851200 4734384128 4007476992 1783356288 786891136 6692014080 2418313728 1272048768 4321632768 2513856000 10436866048 1430352512 1294703360 697048704 7967857152 1516197120 1457405056 5851744768 1335615488 6979611648 1743755136 8070515712 982808320 13282243584 23390613504 6013092352 10637869056 11773888512 1877521792 1170629632 12482724864 6952544768 5023818240 13287911424 8016872960 5006523904 696455168 5066527744 4798008832 7892831744 1567737600 8831287296 5289458688 5975340544 6543049728 5704648704 3526232832 8346252800 9262887936 5661426176 9902502912 6520446976 6972536320 7999570432 6397560832 7537155072 8952422400 1454192768 8807375872 3182417920 7083673088 8859901952 8159609856 8202076160 7338878464 3368784384 10388152320 8645520384 14201026560 8254597120 7391696896 5970035712 4255116032 3278557952 9134206976 6609165312 9756752896 12974647296 1406239104 9413585920 7214402048 6836682240 7742400000 14754911232 7824632832 8878607360 14051254272 5880167424 4320610816 7680899584 4550747648 10616736768 5505947136 7010863616 7265077760 5234506752 8979582976 6123799040 7466475520 6724761600 7186432000 9642360832 10547664896 7043579392 7693838848 8776539136 8700573696 6350486528 5524514816 6332918272 7756823040 3433384960 8212708352 5230396416 10335449088 13975533568 10350466048 9074779136 247532864 5810680832 6749746688 2763211776 3653872384 7470031872 6592412160 9164813312 5334917632 7508731392 6801020416 11035874304 10156654592 8726168576 2611874048 5895216640 6241399808 7287516160 7672760832 2772019200 9494915072 9767831552 7742191104 8317729280 5407235072 9247238144 7309887488 7488869888 13177040896 1422761600 6781091328 12437336064 8453607424 7950228480 4092116736 9377011712 3795051264 4427707904 3681756928 8570309120 10122302464 2179829248 8691502080 4659577856 9721356288 8077033984 5280483840 6024210944 8289707008 7406285824 3432609024 3549191680 9975945216 3612387072 6671407104 8780371968 5879249920 7011110400 7670975488 4999740416 4162361088 4670479360 10453736448 6227190784 9386148864 1572322816 8042326016 8112212480 7116007424 2540160768 7918682112 8071512576 5636053504 8377460224 6091978240 298590464 8984131584 6364059136 2066112768 8163420672 22031392768 10565479424 1866472832 4922588160 2704829184 3592206080 2107726208 7401187840 14297492480 12599731200 8623989760 9507459072 11784828928 6749746688 4062470912 3638116864 10061168640 9764259840 5577081856 6246792704 10878150656 10031325184 7711745024 6105677312 8724185088 4233019136 10092839936 8791367680 8014970880 8973686784 4924839936 2934195200 3423968768 2214467328 6484454400 5992756224 6749746688 4724842496 9426923520 6980068864 6471828992 6461551616 6749746688 11528471552 4996272640 8289498624 7966117888 11103022080 11731957760 9196756992 9254798336 5638410240 4799659008 4401323520 6546948096 9170838528 7572570112 1827520128 4691174912 14617686016 5744992768 10360441856 6542930944 8684443648 7523486208 9051319296 534572256 5751394304 4634902016 7867099648 6091684352 8054713344 5763340288 8528677888 5639785472 indoxyl glucuronide 463418.25 97239.1563 50573.5664 70310.0234 125767.875 101406.5156 533277.4375 3886875.25 48293.3906 1659630.875 358343.0938 29378.6953 254890.9063 133454.8125 139323.75 14310754 85104.2422 358248.1875 498547.4063 306617 121106.1875 27147926 237275.5313 148727.25 655965.5 4575237.5 79136.7188 283239.625 1876855.5 99300.5859 168548.7813 813952.75 167770.8438 30608.8125 238096.9219 84444.5 8267903.5 75556.4922 540277.375 45769.0781 215896 789038.625 155295.2031 93660 125666.7656 2114260.25 72268.8047 36758596 421574.9063 230406.5625 39929.2422 282099.2188 2530552.75 39583732 274108.8125 116893.2813 253366.6563 75870.2109 73752.2344 87662.1719 337309.0313 3676329.5 1080899.125 240619.75 53889.8438 492033.875 68215.9141 19170492 64974.1563 133017.375 112489.5859 8280775 413817.8438 709221.3125 200946.0625 10026707 206450.25 247774 101721.5859 135920.4063 306617 138030.625 184747.1719 137829.8594 29420378 62685.3711 1194729.625 537440.3125 71970544 276096.4063 82643.1094 674862.75 395547.6563 770494 57442.0547 152428.4063 4961814.5 52773.1836 3302814 1092912.75 100788.3438 546167 564120 128059.9375 645741 6644826.5 527475.375 2857346 138467.3281 254939.9531 3642167.25 12720809 101394.9375 86952.9453 217686.3438 2842588.75 1440690.5 1275486.625 10574142 339125.1875 30902356 27897770 901103.6875 919971.1875 14349983 177531.3906 1359558.875 3073659.25 326861.4375 84544.1328 707971.875 7701863 446713.875 4573768 40523.1367 26897.7266 56142.8047 66772.1328 64853.9375 3203104 1578016.375 561861.1875 3107556.75 1911844.375 50659.2813 5222076.5 207042.9688 2559447 595892.75 69650.5234 10532781 974576.125 phenylacetyltaurine 249496.0781 106482.8359 615936.625 63678.3984 281493.9688 380517.1563 950764.625 353205.9688 90216.5 115803.7734 624786.625 465945.75 315990.25 1000304.938 159584.75 139005.0625 7050433.5 72714.1797 1211178.375 89304.9141 135809.3438 269325.3438 112227.375 1148980.5 330636.4063 88975.2266 369784 548744.1875 105058.3828 113649.5859 1002785.813 408242.4375 265038.9063 516201.0313 537006.875 256186.5 110642.5547 51114.4023 185715.0469 244781.0625 938645.375 1057430.625 151794.1875 66583.6094 929496.4375 138138.3281 112310.5469 369826.875 138039.1563 513773.3125 104855.4297 109617.1875 908249.25 347414.8125 107196.8984 56450.5781 140262.9844 557793.375 131512.8438 291162.5313 243047.6719 202979.9219 267146.1875 112682.9766 546044.5625 270898.5625 1700953.625 2493322 2688321 63557.1328 1100951.125 120205.5469 164958.2031 96543.5547 192052.2813 262876.9063 44317.2539 256186.5 71065.4609 385766.2813 1-palmitoleoylglycerol (16:1)* 8119076.5 1843609.625 2903271.75 3630875.75 4587378.5 4024025.75 11616350 1500912.375 3362341 16998744 30601080 1879210.25 2449975 3581396.25 5700763 6486173 3549018.75 2724432.75 15401182 1893928.5 3165528.25 3907323 2502683.5 3053341 6264849.5 8840518 10411158 4024571.5 3028648 6422179.5 10960792 1773539.625 3495849.75 2016610.75 3834234.5 3739663.5 3340599.75 13276190 4985127.5 757623.5625 707321.875 3658329 8443468 4340351 4088942 6118110.5 16271875 10033144 5311871.5 8849957 4143415.5 5713678.5 7849074.5 5020554.5 5197241 672962.75 471111.75 2520539.75 1224782 1238064.875 1565554.5 812437.3125 1021767.938 453277.75 736542.125 4044733 828223.75 2250934.75 4913920.5 892827.9375 3885462 2246452.5 370747 9225709 6723291.5 996990.6875 15300811 888865.75 2119132.25 1815492.125 747803.25 1218920.25 4214105.5 952202.5 2583817.25 432631.875 2277871.25 559312.1875 5239060.5 3897128.5 2582706.5 1629014.75 1154520.875 1889300.625 1279858.875 7888956.5 2270901.75 10202320 969582.3125 1271135.875 2508430.5 2183803.75 799693 3659144.5 2106081.5 2314368.25 1280208.125 1390712 4611099 18861452 1958174.75 903499.6875 7183205.5 1430106.5 2781096 2502683.5 9375477 1132268.625 1935677.5 6057696 16689138 6156064.5 666471.3125 1122944 3428891.5 3271046.75 8104315 524572.25 4722550.5 3264069.5 2355090 945451.6875 1289740.875 2276866.5 1945631.5 641211.8125 1739237.5 9609645 3053810 725534.125 1478384.625 726564.1875 1991001 2876535.25 2502683.5 2886096.25 2509018.75 2999103.75 1629367.875 1168559.25 525402.5625 2075126.125 1008352.063 21863098 3132237 5197917 3890123.75 2478691.5 4789329 1094875.5 2788932.5 2667741.5 4203576.5 654414.5 9414480 1758449.75 2053853.875 6131987 4412848.5 338010.0625 1023039.625 1340712.5 1094936 619474.4375 1323474.25 1057304.5 2449154 1931420.625 1715862.75 2216844.75 1920895.75 400457.5313 2123632.25 20250830 6479370.5 6375468.5 2739518.75 525304.125 274860.5938 665511.75 863831.375 1422983.375 2915248.5 1563253.25 1911072.125 753283.9375 2502683.5 1380078.125 3579615.25 14922655 794244.1875 22269828 1397219 6313485 1314815.5 2743509.75 1360264.75 3547753 1774623.25 2723329.75 4682025.5 1034370 3715290.75 2619783.75 3661704.25 5206034 22725536 1276638.5 648540.0625 5735922 4964597.5 3023822.75 2731695.75 3021781.25 6092005 873299.3125 2437350.5 2010848.875 3138705.75 3150877 1907995.375 13763290 2508574 2429801 692398.4375 1195824.625 52468732 2508708.25 5199496.5 2394445.25 7252459 592966.9375 57049444 2283579.5 1776924.375 1347811 2781029 1042309.438 3676143.25 2839351 860511.1875 2413193 4775418.5 5572001 1683746.25 488328 2255113.5 2486178.75 20461708 1613743.5 1211904.5 4364927 1476382.125 568997.625 1138814 5602826.5 1323232.25 671626.25 3502656.25 2484827.25 3975236.75 1107724.5 902666.875 15293449 2202837 3205911.75 2139917.5 1763644.5 8215117.5 2563459 6999107.5 1318088.875 5-hydroxyindole sulfate 90028.6328 338504.375 107785.3359 271046.3438 208842.8125 163442.3906 235682.7188 64212.7891 90232.1094 86036.4063 56995.1602 87782.1328 46518.7109 248112.9531 68636.0469 256943.9375 74352.0156 246427.6719 86384.2344 74838.2656 366620.3438 302903.7813 373048.8125 34691.1445 54577.1992 125198.9453 53512.543 131881.9688 62458.3398 34333.6133 73908.6797 592696.8125 109535.6875 148134.0469 76330.0859 1191128 575796.375 290928 106375.6328 1287258 365183.875 90458.3281 255637.9063 153815.3281 177050.6875 591646.125 125913.7109 201694.5469 119549.7266 655883.4375 367134.5 518041 204324.875 334845.0938 355009.4375 52685.2813 138922.2969 168864.1563 140419.3906 170608.7969 259725.8438 385571.25 393992.5313 52872.0195 198957.5313 94790.6094 56742.2656 80834.4609 303552.3125 78856.125 219002.3594 173056.6406 104997.0938 226512.3594 213267.9531 830293.125 171917.0313 92997.9453 200770.4688 688860 58190.2734 258315.1719 92309.6875 46829.2305 338579.8125 329438.2813 683203.5 305670.4375 321381.9375 207713.3125 582547.3125 96021.25 212356.9844 164493.9531 956695.375 283741.9375 79934.2266 192014.6719 100104.7109 41114.8438 151190.8906 89049.0625 251197.1563 849286.75 158555.2969 165659.1094 304753.4063 211340.8438 794875.5625 56955.2695 207022.8125 216556.8594 63958.0977 63843.6875 420909.1563 250117.4063 72951.2813 194233.2344 145566.4688 88321.2734 1232592.75 192017.3281 435284.4063 42161.2266 401855.7188 470504.6563 546519.625 247130.0313 489790.0938 181080.75 53796.1875 89806.2344 301217.7813 198321.8438 489705.8438 1272815.375 107257.0781 567735.6875 149833.8438 246953.7031 201027.9844 101559.5781 116133.4531 192705.1719 59223.5547 54973.6641 502399.0938 113190.1719 339616.1875 47027.6641 924593.75 302068.7188 219530.7656 84796.5156 817214.125 142001.8438 172255.2813 278162.2813 575950.8125 257527.1094 103731.7969 533959.8125 1121565.625 49373.0898 198700.0156 178212.7969 30112.3242 234715.5781 270653.125 210919.75 491465.6875 525772.9375 139874.125 690616.375 53506.9258 299958.4063 262465.5938 412043.7188 33048.8711 124652.3125 186890.2813 510170.3125 120124.3438 223954.6563 358355.5 40618.2656 153367.5156 259539.0938 71575.5391 592233 585676.9375 208289.1094 358973.875 294086.9688 334826.3438 121445.6797 74752.0859 134060.2344 311953.6563 265264.125 603865.6875 478325.9063 104267.125 199864 289391.3125 92222.1875 623407.3125 45952.0977 803172.875 133532.2344 98427.7734 181150.8438 531100.375 7-hydroxyindole sulfate 847816.8125 22009.0098 127221 49194.3477 29087.418 72983.5078 143241.4531 60461.8047 34849.0234 57384.6758 107033.3281 124600.9609 133405.5 115484.6797 56971.5 56546.2734 34446.6406 29675.4902 117973.2031 56971.5 24645.7969 34686.7109 113136.8672 27410.0508 59141.8008 60138.2813 66272.9141 98268.4063 60175.1875 24386.3945 20341.9492 28632.4785 57936.6094 36284.9453 21333.9316 47888.8281 32096.2637 56971.5 149558.2813 56971.5 45777.9375 104708.8984 36905.8398 42822.9063 57396.7266 53354.1094 388273.375 22864.2129 phenylacetylhistidine 29118.1348 119248.1797 75066.5078 29434.2285 18971.0625 23413.0586 98182.2266 47055.6328 108634.7734 203654.75 47063.1172 64281.8828 1125574.875 254978.5 155139.0781 29351.8691 68501.7422 46644.9336 92191.0625 75678.5156 89123.9922 32795.7383 162298.3125 334188.6563 43519.3555 103408.5 42708.4141 1055526.375 49995.1875 463161.0938 115612.4063 95960.2422 409365.1563 1626591.875 52860.2695 198691.5156 34495.0352 239642.1094 92563.2109 20176.1543 257161.8281 20142.8672 18316.8594 236631.375 99085 14838.4746 276357.5313 38970.7461 120279.5313 241587.6719 708269.6875 186414.0938 150163.0313 45557.8516 27514.375 107732 29587.252 65866.4688 69545.5469 155260.5781 62552.8438 230435.7656 640192.3125 41579.3281 103408.5 1094485.5 114253.7969 489437.875 418508.0938 29795.4473 38601.2617 2323451.5 474690.0625 231586.2188 159253.4688 157163.5156 44152.5234 217840.4219 31185.4492 31691.7324 237462.4531 62478.4922 218794.0625 154073.25 144480.9844 324378.625 43676.8906 33566.7109 877168.75 108805.875 phenylacetylglutamate 25401.8691 29854.1738 30810.9766 121128.4063 38072.9961 393139.4375 53065.4688 612179.5625 29500.5059 157669.9063 158684.0469 91655.8438 488212.7188 112951.1328 125137.4453 64405.4805 303788.3125 234857.7813 234055.1406 34381.3711 77123.7109 78285.2266 72140.6797 69578.9844 325181.125 318222.8438 108932.8047 43396.3555 56983.0664 139681.0938 277019.375 4514706 855604.8125 984079.375 1089725 2439567 27064.9766 40289.7813 1584738.875 77754.8984 66393.9531 470719.2188 150328.8906 15228003 26230.5645 5535418 712647.5 138012.2031 8833050 407637.8438 39817.1602 235182.5313 412763.4063 3011800.25 2128146.75 210959.7813 1551954.25 1845881.625 107274.125 391287.4063 3168542.75 178933.0781 106343.7813 130678.2578 63775.0664 1883715.875 325035.25 29902.1152 400046.75 28947950 683269.3125 982125.75 292885.2813 74835.2266 283149.375 380110.7188 99319.9453 72694.2656 100811.7734 214287.2656 75247.4297 337446.6563 21966.2285 204140.125 731001.125 21766594 854170.1875 494643.6875 15295888 34026.0781 269505.25 2227098 158268.9531 156885.9531 22520.9688 1381657.25 9191685 52767.875 47043860 351716.0313 1607043.375 84029.9766 373947.6875 73224.2891 806197.9375 27328.875 108686.5625 188645.4844 60769.0234 7975.125 156185.2813 75965.7969 148090.8281 404824.9063 154632.8281 508091.125 5001321 1232127.75 282622.0313 638943.75 210631.6719 99561.8984 33730.543 393157.7813 131571.4063 6178363 449691.7813 326045.6875 18834.7441 55587.9805 156748.8125 62876.6211 9062287 68280.7266 313209.9063 144685.6563 225171.8125 176776.9063 329274.6563 281771.5938 1790916.75 341554.375 7166281.5 300228.375 314129.3438 726763.125 231071.4063 1090957.5 1329587.375 620784.25 393914.75 56374.7031 6588280 55096.4063 6340427.5 5609899 70962.6094 43677932 71906.4688 203473.6406 768977.8125 60845.6797 1949190.125 393526.1875 2356290.25 258160.2188 228691.4219 103062.6797 180141.0625 492833.2813 2961920.75 117320.0781 1456390.75 548168.5625 62516.7031 3990408.25 1420638.75 62885.8672 362594.2813 1209437.875 709550.25 134148.2813 318368.7188 407761.4063 4754087.5 1775785.625 470355.7813 380844.0625 6033813.5 23135484 18837.9297 1026278.125 1334143.25 2150086.25 1444940.125 165470.7656 1885034.125 1378947.125 698092.3125 15520654 85122.0234 1730825.875 10964072 5233959 586341.3125 2811812 471268.8438 44294064 122152.9844 501094.4375 14638572 243873.875 124804.0703 3751077.5 402794.4375 143387.2344 109449.75 2382425.75 7426428 754235.9375 1491625.75 135275.7188 8688930 63698.8789 91631.9063 230568.2656 824415.625 47674.2539 73815.6016 58207.0859 46540.1602 797459.5 8620590 403558.9063 904679.0625 7777912 280809.7188 1141783.5 217936.4219 86044.6641 2776969.5 72534.3984 5067195.5 321702 326607.2188 9894361 2068028.375 1-linoleoyl-GPA (18:2)* 829030.25 382329 1144643.875 911311.375 606732.0625 885337.3125 672505.4375 384092.1563 1027293.438 2484273.25 998339.375 888983.875 895221.5625 841123.4375 750350.375 2270254.25 1233757.75 932037.4375 1049140.875 858486.875 1306467.375 1360910.875 3866119.75 605174.3125 533780.1875 2700089.75 866633.1875 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155359.3438 373980.8438 499086.9375 862410.25 668763.0625 232994.9219 83891.75 931884.1875 172972.375 50580.4023 69811.5078 386120.3438 802421.25 468541.625 294783.5313 238976.7344 295042.375 578943.0625 714164.125 57119.4102 1-linoleoyl-GPG (18:2)* 236887.1719 189989.4688 281880.625 211098.9688 156430.5313 243905.2656 262940.4688 203854.4844 235128.8438 534032.8125 790981.25 121723.2578 267695.4688 128211.9063 217925.7031 456406 289108.5313 275917.75 628688.625 212395.4844 241053.4844 210268.9531 498769.7813 391864.4375 390265.2188 542152.5 286911.9063 325201.5313 134942.0313 537539.625 200840.0313 195309.3125 357034.4063 348914.8125 378861.7813 319494.8438 830572.375 250941.1094 123930.1875 145443.1094 132138.7969 196816.1563 279811.375 409835.125 319972.5625 312270.1875 411266.8438 181430.6875 250824.4219 1451797 102266.5469 118049.1719 118492.9375 71527.2813 63258.0586 242195.875 96512.0859 60809.7734 104199.1406 107651.2734 318927.8438 370499.4063 348739.5938 59646.1914 120123.6172 146149.3594 125737.875 161387.9688 136056.4219 764320.3125 72538.6953 382057.2188 89801.625 78410.3516 50513.9414 429642.1563 119754.1797 88678.4141 111107.9453 185634.2969 160785.7031 116148.7109 410671.125 103784.8438 151850.3594 148476.6094 110814.6875 284213.8438 96857.5625 254010.9063 59090.25 369882.9375 330566.625 55037.9688 131166.4219 62227.8008 118723.5078 136953.1094 173210 158280.75 172202.1094 108357.5313 164989.3125 83544.1484 102191.1797 38500.3633 184265.7656 112965.0469 187949.8438 86972.5469 322917.5 146601.0313 162661.4688 275022.3438 1515097.125 78669.3672 211126.4063 131102.2344 108370.6094 162181.1094 109817.2031 287717.9688 95461.5078 63814.8438 78578.4141 173210 126390.2969 112484.0156 phenylacetylmethionine 62568.4023 543299.125 39151.5195 137598.6563 26607.3594 73433.5859 28118.7461 148552.0625 153319.0156 103443.8594 175594.375 65426.7188 87965.0703 46370.1875 82595.9609 54481.4102 145439.0156 375538.7813 434270.375 156886.5938 597653 822698.6875 15289.7764 182654.6094 131236.6406 278770.2188 102229.4453 3466451 664857.4375 135550.5469 45092.3398 87965.2734 23327.9316 902628.625 193403.7969 75058.625 295960.375 74531.4609 172161.8125 97442.0078 334763.5938 147235.3281 260149.7969 35975.2539 336011.9688 235842.3125 54544.4688 21863.7852 59827.5156 949047.8125 163485.7656 291121.2188 3443979 213663.3438 542542.875 97969.1797 22035.0918 242588.5469 245644.6094 41564 33695.2695 81614.6406 114442.0234 49445.0352 229736.7969 877654.75 406378.125 273497.5 37399.6484 1981218.125 204357.9063 1627045.75 616859.5 78777.2031 653671.4375 1505093.625 8843781 123379.8594 1085077.625 174053.0781 314304.5313 32820.625 786612.5625 71273.8047 295162.8438 639558.875 51854.5234 96712.8203 78687.75 229521.5938 137266.2656 53825.0781 201300.2656 1748596.25 178141.6406 313719.0938 1972514.375 75825.8594 708098.875 108066.9844 3099127.5 202901.0625 41229.3359 1321264.125 108760.0313 58878.2578 59544.8477 135069.6719 150070.4219 903328.6875 489224.1563 1796772.75 85379.7578 168349.5313 68681.9297 148687.625 626804.6875 184109.5156 106930.6328 3378068.25 1027215.188 2482206 62237.6758 4576876.5 58036.3359 145126.4063 495048.125 89816.4141 56577.5859 5601513 53757.2578 92788.3438 1634382.75 107314.375 150834.9219 367954.375 56023.332 985803.9375 319812.6875 40873.3281 168685.5313 181574.1875 124339.9219 126905.7344 136925.8281 18002.6094 626128.75 288737.875 73574.6641 217865.7656 1200187.875 4200117.5 109883.0391 490492.8438 371738.7188 55627.4961 559599.875 205469.9844 116090.7266 1989701.125 289453.9375 1555923.125 3036743.5 418282.75 1827617.75 132753.9688 13734070 82283.3438 228468.3438 1116889.25 1762497.625 64484.0156 295028.125 514125.9375 328941.5 162896.0781 816416.875 30797.2715 214986.9375 208797.4375 31903.2598 89543.5391 1156151.125 23405.4141 171081.3906 692792.4375 92139.3125 20845.4121 477928.2813 2095950.125 179682.9219 157992.6563 5096397.5 648843.5 glycocholate glucuronide (1) 34789.2266 477374.3438 333040.0313 433610.6875 112435.6406 138769.25 43777.0664 51534.9141 43053.707 201050.0313 374347.25 205588.5 23650.3848 389839.5938 427503.25 76163.875 308828.4063 42002.3047 71293.4609 174527.0781 195983.0938 126373.7813 92936.2031 1469455.75 152306.6875 2600148.5 244663.8906 108785.5469 377019.5313 727098.6875 139442.1875 411382.0938 244814.5 112297.8125 234083.9375 111664.5391 167195.4688 155829.8438 31943.0156 49910.7383 280285.0938 264019.9375 138490 79643.1406 183673.25 197858.4375 175771.2656 277630.375 57020.8984 477550.7813 222193.1406 469458.75 457713.875 96079.4766 334753.9688 44279.7227 18400.1133 153161.625 131314.9844 227353.9219 143542.6875 113840.0156 277285.375 134194 109228.7188 162132.8906 150675.375 1179786.375 105866.8672 1312852.625 46394.8438 273406.4688 94247.2109 683803.9375 98798.1484 27318.2148 115616.4219 644122.875 106747.6641 360616.3438 58174.3516 126470.3828 151918.5 64726.6445 231968.5313 132717.9531 103973.0781 584267.4375 132157.7344 258695.9219 76720.3906 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214542.9219 201513.1719 47740.2539 263799.9375 118597.9766 32449.8652 60261.1211 355251.9688 1103835 145899.3594 3496953.25 162575.9688 111615.3203 219816.2969 283513.5 74354.1094 887493.75 125256.3672 145522.9844 141855.1094 70328.6797 294465.7188 130774.4375 139537.6094 145100.9375 336517.375 190043.7813 107555.8359 188893.2969 150731.6875 133855.7031 232331.0313 252305.6094 125328.7266 147192.7969 115427.9688 171858.7344 257449.0625 377976.9063 184567.25 153356.9219 305666.0938 198415.25 127978.3594 102391.8281 118648.2188 55411.1328 181192.0938 644435.25 215361.1563 109388.8906 118445.0234 phenylacetylthreonine 74040.0156 22102.6895 183812.1563 34511.3594 76962.6719 48410.6328 182257.8281 111195.1094 51949.2422 47733.7422 24893.748 42015.7734 101922 36349.4102 33815.1563 142850.6094 120929.2734 22419.252 93977.5 614065.9375 109866.4922 57605.3086 801212.8125 183091.4531 50756.2227 263370.5625 93169.6016 38009.2461 125780.2969 94701.2109 1199248.25 94449.0156 78780.2969 50566.5664 30746.9336 51330.3203 474699.3125 325133 151342.9375 109142.7969 433852.4063 5022437.5 64087.0156 122317.5234 140392.8906 42762.1055 49724.7734 39163.4844 246111.9531 57368.4609 33870.6328 456498.625 244592.2031 39609.8594 176586.3906 41637.8555 310107.3438 23285.8145 40235 40388.5625 265594.4063 100975.8672 115640.4609 1564775.25 44439.3984 144515.8906 80032.1094 41257.8477 102868.1328 158727.7344 40049.7383 31890.082 33329.3359 40596.7773 160587.5938 63466.7422 324340.9375 691219.3125 122236.0781 273525.9063 62486.2344 1802195.375 81526.4844 3106313 2487059 28881.3848 315275.9063 7664378 500088.4063 179617.2969 112035.8203 148752.3281 22716.1504 155819.5938 67156.9531 471474.25 38432.5039 215618.4375 34954.0469 269012.0625 1345043.625 55513.4727 39470.3203 3849751 201796.1875 phenylacetylserine 128228.3906 42538.4023 172498.7344 63186.332 63476.7227 38157.1953 46096.1836 244448.9531 103240.5625 286268.2188 147828.4063 87976.3828 85017.3516 236336.9531 113751.6953 344827.6563 57836.3203 81498.2266 143552.4844 312463.3125 125420.3984 193790.2188 86068.3828 192402.7031 154895.9219 257258.2813 108848.4219 125513.0469 94258.9688 242959.9219 73081.6406 162468.0625 123688.5547 1465824.5 57857.4609 214176.375 377734.2813 119368.5391 3175302 301248.375 129406.0313 47226.9063 32659.2168 790555.4375 98780.7969 253512.1406 132667.5938 209048.375 212601.5938 74551.3828 138493.1406 74086.6953 43594.2305 143417.6094 183601.1875 418613.6875 68857.5156 219465.3594 60756.375 54012.3164 1577082.25 148679.4219 170316.5625 186849.6875 99742.8438 197155.6719 163052.3125 176850.5781 119532.0781 229611.3906 223560.5625 111898.9063 72107.1094 312390.1563 697752.625 90897.3203 1209683.875 78606.3047 310777.3438 116300.9844 85797.6484 418205.5625 493255.375 4057250 136285.9844 274632.875 79400.5 72321.9219 253178.0469 104872.2344 203101.0625 64356.8008 132914.1094 226715.6719 147400.7344 53593.0313 75653.7656 40366.7383 91301.9219 95674.5625 334949.6875 55183.4336 88148.5234 440963.7188 153628 53670.8203 133194.6719 84799.3359 150416.9063 107904.5 129606.0078 391496.8438 106957.0781 62406.4844 128663.5938 48370.8594 191105.2813 97948.7188 153220.7188 753461.0625 262617.125 209745.1563 190551.1563 2515656.25 207998.8906 115555.5234 267428.5313 82588.7734 65694.7344 362365.4375 55764.9297 94368.4922 96630.7188 215407.8281 145623 277615.9063 214903.5156 81755.1797 131407.3281 86166.6484 120118.2344 91846.2891 280912.7813 324818.5625 32944.6953 450778.7813 1217994 14920.1162 160569.3281 319534.625 115520.0547 151103.875 84651.6953 108184.6172 1559485.875 1693126.625 1683691.75 125578.6016 204997.5625 5169286 164410.5781 1181932.875 143845.2813 330281.1875 126939.9922 29087.4902 242163.5781 187394.9219 277657.875 44926.4141 196910.4219 430556.9063 41868.5352 229697.4844 149720.8906 224599.2656 1473984.5 59348.7578 413236.1875 141525.1094 35448.4727 61732.5586 209205.0938 1933917.75 154960 85659.6406 42476.043 4713025 229543.0938 perfluorooctanesulfonate (PFOS) 773249.5 2826752.5 1758636.375 2627128.5 2901571 6099204 1136454.25 1579598 4544020 2356747 729430528 2435979.75 1687125.625 1382734 2460262 2938535.5 1502731.75 2418931.75 2804853.25 3168259.25 2424856.5 2378649.5 509918.375 1635136 2347452.75 1160296.125 3910063.5 2015255.375 3026737 2459881.75 896699 1105533.5 4502950 2765059.5 4548143.5 2054773 1909970.625 2955652.25 3395923.5 1952471.75 1893643 5094708 8051899.5 2244803.75 1493573.875 3884437 2658972.75 5991579 444177.0313 2812266 1403698.875 2706910.5 1108043.5 3698697.75 322818.25 116047.8594 952091.875 3364768.5 1361769.125 174849.0625 1947844.625 1924794.375 675560.625 2705472 395082.8125 3149373 758900.0625 29900144 858290 1266601.25 1360419.875 2417561.25 2511748.25 1976302.875 176531.6563 826477 3338450.25 748582.625 669841.875 2073343.875 5351669 652344.5 1326697.75 1295321.375 307145.2813 542133.6875 3189259 1477316 1004792.25 2354150 664036.8125 2288364.25 1026173.938 1184514.375 7708009.5 4049630.5 1487275 3064221.75 644481.3125 643554.6875 1938677.875 3623580.25 673055.5625 879934.5 2677712.25 477958.8125 1216765.125 1463310.625 4647798.5 1560493.75 3541383.25 707049.375 1191353.375 4176316.25 1069520.75 557626.125 2138130.5 986147.9375 2469737.75 419718.5 869085.625 135922.0938 1130662.75 1318702.125 364589.4375 475511.3438 2116775 1410874.375 9847631 1938107.875 1743703 169785.4531 1803429.125 698171.125 1029369.938 1444726.75 3006293.75 2188777.25 651077.625 1749127.875 2177968.75 1483177.25 2543515 3029329.5 1400881 1279305.375 1973648.625 2137178.75 1130091 1020952.563 487675.0625 418608.9688 3547960.5 998241 457130.1563 1350014.25 328091.4375 1161534.375 2995607.25 934503.6875 1561434.25 2391097.75 1931331.875 4608508 935183.375 1382734 598220.0625 1382734 1531063.5 1164269.75 1708551.75 976799.75 752301.9375 1899431.5 4326253 1115532.5 551624.875 590886.125 2791517.5 1782027 1282183 443748.3125 2280885 220958.0625 3532121.5 2141765 891443.1875 542700.75 1917202.125 961893 1235953.625 303641.2188 1351601.875 1571217.75 1020782.188 53881.0625 700786.25 1645618.875 165655.625 1578185 195435.3594 877913.125 1439999.625 2949975.5 1482406.125 2721633.75 1285673.5 401836.1563 1284383.375 2713599.75 129357.0391 2268527.75 694990.25 2208598 297248.7188 3294856.5 1146007.625 167251.0469 612938.125 1879823.5 1072280.75 1587697.125 322960.2188 938728.5625 1870455.25 2564825.5 1305440.75 1626066.625 732233.0625 863369.5 1321469.375 1178770 1796216.625 852535.875 501815.1563 5642175.5 1630563.25 1394883.5 354880.25 2131076.25 1209279.25 2308130.5 1189393.5 1514018.875 1077713.875 2004405.75 2930662.75 446637.5625 603445.625 70935.5703 807161.125 1382734 722463.875 238629.4844 1139450.375 1793067.125 615327.75 230795.5156 1006867.188 702712.5 746465.25 1449222.625 1774871.75 1529313.625 762425.75 530614.3125 2092309.125 1803848.625 4517491 816540.25 254455.4688 2121510.5 679807 1370556.375 2497303.75 2712464 109628.0234 556285.6875 1450387 440742 4307461.5 637563.625 996365.75 109085.8125 1688520.125 928524.375 226470.1094 1288360.75 691106.3125 956414.25 2617266 926841.9375 187506.0625 82867.2188 6717230 1119885.5 891219 1289239.125 70250.4141 143051.7188 2-hydroxybehenate 753685.5625 1097969 768168.9375 1649479.25 694950 834160.375 518462.0938 636828.625 616442.3125 842651.5625 1289442.375 848085.8125 501420.9375 512131.7188 480614.4688 1067677.375 528294.5625 919337.6875 689151.4375 534145.375 1015278.438 480181.0625 604404.0625 788603.3125 509571.2813 1159865.625 1540036.75 845464.625 1655307.625 730922.625 398339.375 503354.9688 777575.375 620439.0625 529290.3125 901463.75 694950 1451073.375 606153.1875 769501.75 378972.4375 752157.375 646297.75 528879.6875 1004771.438 519883.4688 518199.5625 437842.8438 1189736.125 306718.5625 861368.375 1176673.375 637463.9375 697311.625 1338825.625 329024.5625 366469.7813 1209033.5 734793.8125 560461.25 1723468.75 572752.0625 580242.5 362468.375 311447.5938 896389.9375 714166.25 389980.4688 1946817.875 574837.375 500468.9688 709684.875 809062 554859.6875 694950 1235349.5 566769.75 1194449.25 586420.375 615774 1547628 344244.2188 839394.125 1082126 488661.75 2338205.75 333001.625 1550241.875 946110.3125 948897.875 1599751.375 879391.1875 438684.25 1511955.5 770439.625 2226372.75 818062.0625 811675.8125 555173.4375 398035.75 364166.0938 1353753.25 448476.7813 1061581 1559804 465986.875 742782.5 702810.3125 933692.375 1240361 2354818.75 638442.6875 525478.5625 2215093.75 417081 648090.6875 447157.875 839884.3125 911629.9375 1128082.125 397714.8438 1064723.125 378212.25 669747.1875 936341.6875 1620213 786335.6875 817487.6875 877500.5625 1538805.25 948669.25 476205.75 832535.125 1104590 843117.5625 871469.25 834979.625 826682.375 628008.5625 948994.25 795429.4375 807400.9375 1225360.5 694950 768589.875 274198.2188 526764.3125 769392.1875 516195.9688 486668.3438 603231.5625 1163309.25 633646.1875 1190756.875 608864.4375 936127 796963.125 747760.6875 766186.75 665362.5625 550457.875 756614.8125 856077.4375 1781745.625 673982.75 896541.5 545887.25 730501.0625 818564.125 1512180.25 1858340 676609.875 303424.125 893817.125 586104 600381.5 5040934 606201.1875 644897.6875 466194.1563 1051988.5 458472.6563 620257.3125 403417.7188 3119179 830762.1875 536264.5625 674992.0625 545833.9375 792542 743996.75 652914.5 531694.4375 807810.6875 1599370.625 418581.25 541830.125 823334.4375 347268.8438 643468.8125 406115.5313 682874.6875 554094.75 1572466.75 748940.5 1203317.375 1777305.25 298451.875 664403.5625 1106541.625 607791.5625 894863.125 622466.375 499381.6875 577902.0625 1360795.625 518782.7188 527576.25 2413570.75 1221964 309081.4375 950128.4375 1610249.5 387862.0625 889301.75 966104.9375 601430.625 292059.6875 323297.7188 287123.5313 540461.625 536902.8125 1132275.25 995763.0625 574066.4375 1047263.563 669683.5625 2588508 570050.1875 727673.6875 516566.25 635941.875 2718993.5 560852.25 694950 1492318.875 889193.25 440510.1563 1955178.875 293582.4375 409677.1875 892377.5625 440819.0938 528240.125 1833981.625 976987.8125 469095.5625 350829.1563 525729.1875 711749.375 436631.5313 975376.125 465880.2813 1203608.375 502978.25 480302.4688 818429.875 517651.0938 851382.1875 418024.2188 731503.25 1205572.875 1025311 781539.0625 870637.4375 728013.3125 616755.875 831004.125 460448.0938 346058.8438 604314.875 263994.4688 376817.6875 1164009.125 617188.625 650319.1875 424724.7188 1551025.625 654206.625 671143.25 319509.4063 256765.6406 421682.9688 525069.5 612607.625 510787.0625 512025.0938 382840.25 370143.75 2-hydroxynervonate* 2663383.5 4640369.5 1878824.5 5051949 1736952.625 3480043.25 901033 1539598.625 1174640.5 3463113 3167328 2751745 851038.75 922916.9375 697793.1875 3447337.25 835937.375 2256472 1912302 1265338.5 3176804.25 1553731.75 2210066.5 1785802 1371686.625 3325536.5 7670236.5 2045656.25 4041999.75 2126619.75 1115472.25 973067.4375 2875523.25 1101806.875 1305754.75 2342255.25 2167952.75 5791329.5 1614481.375 2276331.75 1011222.688 2801556 1630696.875 791334.25 2736606 1191034.75 1644996.5 1639666.75 2751745 1461065.75 4134847.25 5687766 2053179.375 4398028 5685066 669945.75 848551.8125 8368019 2883132.5 2258265 6554339.5 3246531.25 3460161 893130.8125 526285.875 4056854.5 2352507.25 1731714.25 6784847 1688843.625 1266570.625 2847052.5 3177110 3371320.25 2948651 6174431 2240336 3971667.75 2684870 1934927.625 5498320 920718.9375 2957917 3585444.25 3266492 7923132.5 909987.1875 6030921.5 2526210 3326928.5 7425680 2486748.25 984728.875 6310679.5 2772080.5 14117886 3323506.5 3188286.25 3077753 1547249.75 1324811.25 5115355.5 1451444.875 5013944.5 6798201.5 1665229.375 2773432.5 2941232.5 2771760 5940939 10332772 2375619 2218351 7315659.5 1653209.625 2366340.25 2222915.25 3047471.75 5511457.5 3869791.25 1449900.375 3600633.25 1423491.5 3529776 3594047 9190353 3895635.75 3650691.75 4965782.5 6676279.5 3554218.5 1760109 4937112.5 4184183.25 3391314.25 3581800.5 4732452.5 3700428 2903782.25 4944889.5 3673098.75 2573072.75 7617732.5 3208928.75 2751745 699181.1875 2345392 3727621.5 2597596.5 1859225.75 2044396.75 8228203 1980675.5 4987830 2343158 3314185.5 3184313 2683355 2595794.5 2751745 2494497 3606364.5 2951057.25 8791507 3736527 3806276.75 2589284.25 5492428.5 4516670 6507606 7528366 3700777.5 833773 4637337.5 2065233.75 3404154.5 30148196 2433136 3631062.25 2262124 4106910 2023801.625 2945681 1590240.625 14036138 3696049.25 1927675.125 3408428.5 1609949.25 3924428 3472112 2494814.75 1958712 3990994.5 8954361 2425385.5 1294617.375 3290086.5 1069788 3356955.75 1165429.25 1972396 2694270.5 8132251.5 2391340 8756680 10273179 1115675.375 1703574.375 5721938.5 1716216.625 2645505 2808732.25 2620898 1914030.125 7231351.5 1674028.875 1773355.875 9103468 4237133.5 656260.25 5415856 9626176 908245.5 5392505.5 4195969 2335257.75 635899 1157913 1067901 2262198 3709070 5534423.5 2967827 2426624.75 3601171.5 3981849 14534330 2327807 3110636.25 2475935.5 2862855.25 14976345 1626132.625 2015055.25 6632774 4828044.5 1627732.625 8702931 644769.4375 990347.9375 3494119 1456837.375 1690441.75 7716252 4578991.5 986227.9375 961924.625 1709199.375 2883218.5 2178903.5 4012392.5 1216645.625 6469434.5 1545460.625 2418996.75 2481878.5 1822895.875 3839372 1839105.625 5421489 4963636.5 3632196.5 3090818.25 3484553.5 2979291.75 2231536.25 3735680.75 1044362.5 2840106.5 2052783.75 1904742.875 1314365.5 1174074.25 4397323.5 2340455.75 2327321.5 1383786.25 5492408 2751808.25 2552970.5 428088.9375 463929.5938 1103020.375 2135355.75 1416329.25 2433990.75 2070349.875 1166626.125 1213856.25 N-palmitoylserine 773293.75 246862.375 942547.375 824522.3125 795529.5 863622.75 478926 263298.2188 657859.3125 312508.75 1884878.25 336321.0938 757112.0625 521985.4375 500563 987918.8125 563093.625 402104.8125 634369.6875 589721.9375 1072211.875 710152.5 843969.25 553683.6875 974427.0625 1456841.75 1512166.875 1164138 309650.5 774012.25 304722.2813 496250.125 695898.25 646455.375 493873.875 757995.1875 634052 466333.125 720510.75 1034265.75 856795.875 891347.375 744847.9375 473046.5 1019113.75 490051.9375 651808 652054.6875 399988.9375 377822.1563 439908.6563 524576.5625 301438.9688 323783.7188 375636.6875 249968.6563 591730 705479.1875 736997.8125 192174.4688 165018.3125 483648.2188 430335.5938 602494.4375 239872.5 413048.375 1978947.125 158829.3281 614612.0625 549841.4375 571406.1875 180600.375 227137.9688 551737.375 221715.4688 480538.5313 568337.4375 347810.7188 436368.5938 33711.5703 400151.2813 1062253.125 576731.75 398858.3438 419157.0313 761363.8125 78967.0625 315190.9688 283665.5938 192835.9531 304564.375 243618.125 484805.5 328120.8438 115565.7734 389190.5625 623645.5 447528.7813 156018.8594 140888.8125 380118.25 150698.5781 114927.7422 76288.6328 466503.6875 533077.5 193628.5938 675901.375 369003.3125 599572.375 151852.0938 251915.9375 649089.4375 341753.1563 571807.6875 467800.0938 510323.1875 904256.6875 182912.0156 198135.2344 192242.6719 198334.1563 346019.625 478926 463545.9688 277255.5938 138857.7969 358568.25 N-oleoylserine 264930.3125 135088.9219 307615.625 261417.6875 100589.8203 246299.5313 150295.7188 222533.7031 192151.2813 294753.9063 547479.9375 222367.4063 232595 215953.7344 188990.7031 310455.0313 253499.0313 266913.5313 447393.9375 169415.3906 681559.5 377099.8438 389865.9688 297451.4688 339327.4063 556762.875 988481.9375 229766.4531 357208.625 168545.8906 303657.4688 129016.5547 318247.875 212736.375 310934.7188 289643.0313 190517.3438 812736.4375 296124.5 161193.5156 276778.0625 291568.2813 237005 213708.7813 300465.3438 286528.25 401971.8125 387918.1563 282779.875 168094.0781 224984.0938 717710.125 200853.1094 240205.8906 332622.4688 162345.125 161359.0938 265975.9375 112126.6641 112074.1875 202979.6094 219720.1406 104831.5469 83988.6094 265353.1563 264523.3438 107200.5078 257547.9844 454125.8125 320092.9375 116280.1094 117057.3125 130603.3125 208103.5938 169649.5781 75039.6719 100712.1719 256870.8906 250133.1094 195216 137005.1094 142536.3438 311720.9375 276014.3125 322312.5313 94043.1094 298283.5625 532789.3125 1328354.125 187067.1875 898852.9375 161197 154437.1563 237680.7969 275953.25 165943.4063 260444.7031 639810 245693 293727.2188 373069.5313 276274.8125 295806.8438 1514118.125 258792.7031 260135.8438 808679.8125 151477.6406 75039.6719 286329.3125 128692.5313 235115.8438 205598.0313 304477.4688 131739.4375 139250.1875 281672.8438 175779.8438 341099.625 220727.2969 105839.5469 815281 170714.4219 241353.8594 412890.4688 282137.7188 177347.4531 236185.0938 217500.4844 170846.25 260131.7813 246631.4219 547146.8125 292939.0938 200752.375 167404.6875 232595 390967.875 112418.8438 179527.2656 134871.3594 186993.5156 291611.2188 160506.3594 232595 211025.5156 490641.1563 228620.1719 156216.1563 284332.3438 266891.2813 237979.2031 251712.5781 102092.2813 280074.2188 605952.875 190297.5625 112847.6094 132101.6406 217094.375 808130.875 190036.125 1134482.875 199796.3125 297466.0313 256363.1094 294476.5313 347990.9063 101530.1641 123374.9844 465356.6875 108090.0703 311564.625 368933.7188 85245.2031 284237.3438 382624.6563 187653.6875 256048.5469 215577.9844 190048.375 267997.5313 102064.5 303365.7813 220148.4219 370653.5938 500045.125 180448.3281 297737.2813 104157.625 155620.2656 228184.9844 250031.625 464931 228131.6719 134000.7344 189598.875 295242.9063 204607.7813 89089.3203 221165.625 162342.9063 208360.375 185110.2813 286941.9375 560471.5625 271459.3125 118727.9766 124320.3125 313958.4063 194769.7031 433087.5625 194020.7344 271180.6875 351340.7188 632207.25 76772.6484 369122.4688 151572.1875 413369.9063 230905.3906 172620.4375 201764.4219 419694.75 181623.2031 221679.2813 291019.7188 118693.1797 137789.9531 230098.3438 226723.2656 237429.8906 371297.375 261880.4688 150744.5313 194765.0781 163949.2969 277538.4063 158061 127196.8672 96713.2813 109753.5938 328819.5625 373794.125 735211.5 209351.4375 431332.4375 222384.625 200342.4688 364786.6875 217561.8594 337625.5625 125160.0391 269235.9063 110720.8359 302283.8438 153999.5781 169884.7656 296871.7188 211003.7031 374530.625 113441.9375 160311.1875 205790.9531 180315.1563 338716.3125 224230.8594 150731.5625 204120.0156 heneicosapentaenoate (21:5n3) 918442.0625 2232721.25 348837.4688 56928.9258 672096.5 523253.7188 362802.2813 247699.3125 159464.6094 200283.2969 144970.3125 194086.6406 664424.5 271083.5313 813988.6875 861277.375 336027.25 208462.125 1938083.375 511468.6875 432695.6875 169898.0781 874890.8125 629323.0625 76659.6797 155457.1406 574082.625 200334.9063 322362.3125 312608.4063 212084.3906 400277.5625 421056.1875 177267.5 309607 156031.9688 357946.9688 141652.6563 432342.9063 120918.4297 307792.6563 606951.4375 137576.6875 324531.875 94501.6484 252498.8125 588409.9375 162041.8594 345392.4375 618056.75 275057.9063 86501.875 272054.4688 186980.5156 184381.2813 291932.6563 170235.8438 66546.3984 187618.4531 309607 558327.375 623747.25 623914.25 468817.6563 296405.2813 1020683 595594.3125 359540.5313 270267.1875 64868.0625 385306.9063 281368.8125 1025541.375 1061729.25 245539.4375 409539.0625 1553292.375 274184.4688 725876.9375 1343881 372614.8438 356413.2188 382118.9375 81676.8906 719661.875 571935.9375 116305.0547 252482.1094 787466.5625 406146.375 182497.3281 231623.3281 210533.9375 422707.5 558460.5 231522.0938 1879182.125 271099.5625 509899.6563 203305.3906 1772435 156969.8125 391401.6563 473831.7813 532191.6875 54549.293 306605.5938 259473.4063 311445.9375 227371.1406 264100.4375 691632.9375 230037.625 1174140.375 301510.4375 557596.625 228986.1719 66869.5078 58947.9375 578164.6875 521032.6875 300415.1563 210980.0313 447892.9688 173241.5469 307768.0625 422391.625 215561.8281 109762.9766 115720.2891 90786.9531 297855.5313 210299.3438 522597.25 89523.75 153184.0156 490557.5938 3570602.5 521162.0625 849969.4375 423099.7813 354553.7188 362290.6563 224005.4375 701966.6875 2068080.625 1304922.375 309607 411863.6563 937159.25 225156.2656 818102.25 226482.8281 487720.625 317896.75 684005.8125 305509.5938 3995574.5 185136.1094 473242.25 62381.1367 169898.0781 100090.7031 71323.0234 115397.5703 64146.6719 184252.125 504888.6875 220501.5156 857828.3125 234110.75 802980.5625 821191.5625 154201.4063 421018.5 146022.6719 146226.3125 255842.9063 545622.875 255126.2969 130283.0859 703672 129448.1406 170275.0625 312064.7188 ethyl alpha-glucopyranoside 82713.7813 154551.9531 48999.6719 16876982 13518746 178229.2813 36932.7813 163377.9219 2233176.5 1146080.75 1615423.5 165405.0938 50735.9883 5299634 338901.75 136143.2031 113557.2891 328852.4688 240197.6094 22492128 125893 184695.3438 11578641 144572.0469 269454.5625 118698.3203 53377.1133 212335.5938 58707.5547 45497.3711 376039.4063 50085.8516 34325.7617 50131.4063 85210.5391 90710.75 41512.5898 163283.3125 131190.7969 34346.7891 149032.2969 295458.75 188214.7031 63063.7148 303254.125 60100.4531 30224.8457 373122.7188 333922.8125 135128.2031 791403.4375 81509.5391 43969.8594 197704.625 10718.3467 325009 29972.4453 33067.0391 153749.6094 180234.5938 40886.1641 153313.9219 62769.9375 38563.082 297413.1563 334573.5313 398454.3438 94868.1016 18174.3535 105541.0625 30544.2598 4034735.5 153436.4531 145810.0781 152571.9219 145805.1719 122253.875 44104.6641 99512.6641 195254.3594 598273.6875 2335187.25 118566.9063 1116606.125 197235.9531 170055.8438 79542.7969 100777.9922 250692.0625 68336.2344 51567.9766 38241.0195 104980.3125 347764.1563 235852.3906 30189.1719 14001552 150091.7031 45210.5391 86140.2813 14630439 400575.5313 167991.5938 146552.0938 45501.0781 322283.1563 84268.1719 280860.5625 801998.0625 35550.8086 586307.3125 82550.3828 80072.9375 2740300.5 447365.1563 558200.125 650340.5 126429.9609 31302.9102 449477.75 149562 cortolone glucuronide (1) 247584.5156 287460.9375 263557.8125 97484.9688 96190.7344 272401.6875 128848.1563 415303.9375 184632.2344 793076.4375 248305.5469 250392.3906 128938.0547 109435.4297 83229.5 173741.875 278228 364374.5 266093.375 119825.6016 217800.6719 521037.4688 229060.7813 348417.1563 256360.3906 375089.0938 137939.7188 203553.3594 120867.2578 215196.8594 120969.2109 274814.4063 319668.9063 215843.1563 102956.4063 128595.6094 379598.6875 110429.2188 94235.9063 361532.3438 228451.1094 315880.4375 416392.9063 278243.0625 151945.4375 110258.75 249797.9531 104490.25 827256.125 1688839.375 148383.3438 329170.7813 7654964.5 1399155.125 31882.6602 122835.1172 67550.3438 1695310.625 284054.3125 66110.4141 844229.625 140462.4375 3508070.75 89312.6641 994872.9375 119179.0859 254716.2031 3670603.75 43823.5234 77634.6406 77046.4531 3173123.5 627408.375 442180.3125 347051.4375 894447.625 2225089.5 971068.4375 657470.4375 1271787.75 247522.2656 39447.0977 762159.3125 69864 78859.7656 192436.3438 400089.75 678249.875 71134.0859 51849.5117 2838096.75 2310179.25 1103398.75 151281.1406 2134547.5 322611.9688 207430.5781 138940.8906 44411.6992 208634.6719 103527.8359 202230.6875 554500.1875 283916.5938 141711.5469 100923.5938 180141.0469 90450.2109 840224.3125 225266.2031 125668.1641 269429.25 3566779.75 96046.9844 2225968.25 1159760.625 687860.5625 108557.4609 396493.7188 1336217.625 2046398.375 29234.8066 3324153 300095.5938 1114840.5 137508.8281 407279.4063 116985.8438 182540.9531 608934.75 184650.9531 140951.7969 369520.5625 709182.5625 87834.4688 103182.5078 112079.6016 91182.0781 595090.6875 147208.5 289322.625 187207.2813 55448.4336 2615930 197749.3594 358134.0938 362340.5313 174963 281641.5938 111035.2266 596995.75 89812.75 2869691.5 296349.625 239216.9688 62977.4336 39830.6016 245855.3906 163409.6094 4276064 284496.2188 121030.2031 191185.2656 641101.0625 596002.5625 71673.4297 265214.5 38663.6133 1797413.75 150455.2969 4399093.5 1143730.75 193028.5938 1108999.625 94908.3516 833411.4375 811447.9375 745260.875 1756537.25 70376.2578 106605.7656 157677.5313 4102970.25 156260.2031 2818699.5 2455073 221905.6875 4640727 77765.0781 585229.375 633400.875 64823.5 50582.1758 100222.1172 199473.25 42532.0898 417619.6563 208784.7813 278212.9375 426437.0625 1127452.25 183962.1094 143609.9219 723919.125 458610.8438 349038.125 486827.0938 3749696 340002 31546.9746 188263.3281 613840.6875 1227023.25 490616.4688 535843 219218.0156 762011.4375 161187.4844 4478122.5 5560136.5 1106541.75 534890.375 4475850.5 6999083.5 377749.875 208076.5781 275975.125 273772.125 1122042.75 307233.25 532743.875 1749570.75 1264832 833851.9375 1577777.75 221498.0469 193339.8281 3483519.25 3500530.75 148357.0781 791517.1875 1078272.75 4600452 92013.8281 154662.6406 1108652.75 110273.0938 140424.8281 1894791.25 488342.1875 94129.4297 1039630.813 986333.3125 3177829 154172.9063 505825.7188 378215.0625 4207578.5 290574.3125 199289.7344 90638.1563 841282.375 192931 56565.6953 398192.1563 309318.2813 25830.7109 98378.6016 827007.375 488138.1563 83626.6953 5372345 156379.7813 651205 442880.375 205164.8906 85472.2188 540039.625 11126479 104723.7109 1977543 1791859.125 38707.9766 7291809.5 778092.25 2-butenoylglycine 126820.4141 1270704 76011.9141 158523.2969 240551.0313 171351 211542 204320.2813 76295.4844 90054.6953 609931.625 250031.3594 134159.6719 258936.125 527006 741620.75 81054.8906 211539.5469 114687.7656 159984.6094 78977.6563 199638.625 215346.875 106056.5391 1162291.875 222843.0469 194921.9375 182691.2188 302777.8438 207737.125 295938.9063 300308.4688 256736.5625 83032.0625 346631.8125 289102.5313 164274.9531 195216.7188 162545.7656 199092.4219 200802.4844 172143.7656 241164.8594 108996.8047 355969.4688 151634.5938 366608.8125 282557.125 469367.7813 374120.2813 395951.5625 197493 158434 128071.9922 274167 252417 163817 181696.0938 275709.0625 439956.75 131855.8594 105656.7188 98806.2969 95166.0469 163226.1563 211906 129033.7734 234466.5938 601045.625 279793.375 210515.7813 113203.0938 133300.9531 260966.1406 287751.2188 134083.6719 626863.1875 251192.8906 139111.1563 211542 369090.4375 295034.4375 96691.9922 231436.3438 293742.75 202710.0313 430865.8125 247736.4375 106954.4063 328737.0625 114510.1016 403519.125 295290.0313 147244.5938 211223.8594 227551.1719 86261.3438 221537.2969 317483.25 118450.0703 180190.3438 98712.7734 212159.4375 330840.625 306882 160551 146864.6406 913705.625 244976.8594 131856.6719 252558.4219 388336.7188 285004.6563 211542 98721.5313 47822.6055 269287.8438 221228.6563 220378.7813 82586.1484 303079.4063 140984.2969 211544.4531 95886.0781 90848.0859 273505.0938 183413.5156 105179.8203 522689 253449 273862 hydroxy-CMPF* 4511331.5 21993496 41271748 19444148 29225982 22165204 19496852 11842890 89545536 948815.6875 55166132 17649434 65942228 48407300 26909118 26537530 66728728 20151126 46787800 51577376 57538304 61527288 18774952 32001158 22860576 46282640 19129762 8122760 43079336 53704920 18442852 48900988 38126404 48742004 100949088 12394639 44327648 26567800 55932368 37491748 38692676 26610132 44627068 44427868 19984426 41222000 4065884.5 37454304 8808063 20409390 36652636 4806239.5 18793132 49479976 20888144 24635444 19768232 4256864 25834234 23484446 27061164 48715456 5862611.5 19854324 35609992 20495670 39357016 21217052 7341338.5 12730988 30698540 44187444 13464077 13467820 14016253 32382574 99818848 21458146 18120500 31770078 18024010 42269684 17125130 28047318 5327456.5 16654127 35958356 4677386 13558589 56703200 9886616 31171980 21358982 27172836 25236784 15586045 19535624 19547862 46911604 5333099 19986810 15573037 21241378 25421132 14409688 5785028.5 44101100 21322664 15489726 40327248 28820158 49354020 104171776 22079348 39668392 17129958 28108944 4830174 12717705 35828116 5939240 20359830 61358220 40935024 102286416 1639503.75 25355222 31351868 61300272 21291118 12187984 9286919 56524520 22079348 34854476 14663694 20639290 27342894 11148991 46410432 29809240 26324116 10937224 37426292 7050003.5 11827726 66721132 70060000 33636676 4824119 29152150 13422963 72082312 37670180 9521239 43897232 6618092.5 30040374 19204290 12440116 21200434 31090312 32813458 59968404 27452500 18925680 15213145 8832739 21446558 5017016.5 10242235 4797382 29612876 47011496 32457230 26527042 12465788 10312458 20964858 27393856 17751010 117916904 33754716 25224540 19174984 5741033 28430996 12094845 25897772 29337674 18482560 6639641 12482558 5252774.5 4401480 5793094.5 10579418 36103696 8682320 5104278.5 21769090 16662161 10599793 22079348 20601276 26054154 14362900 3268054.75 29788358 4191237.75 5262405 70025432 12135357 6426193.5 12437935 2815666.25 45181852 18441804 4522709 33008138 69702600 10102254 19399988 22950734 35494948 33843276 40104820 45085224 31655486 3827897 3882270.25 2024973.25 32018170 43346844 13077940 79347648 16601602 30456140 43270172 37549056 30568758 64539620 27149752 41121580 35167472 27943106 31409050 4503639 8201480.5 19071076 40144440 53522472 11000717 23830384 53231264 12194846 31240566 20211638 13784417 18309182 12274026 19562018 30435212 3351068.75 27237376 13587446 48148468 64227628 4342579 17265298 8796889 37714620 62634260 25076542 51788844 22079348 5206115 16835916 26957022 6591735.5 11947542 19130128 34524292 46218152 19838602 27819120 173143.2031 18442204 22333816 32253710 26886698 72991680 2623306.25 9878850 3973735 21357080 7760289.5 16705527 16081934 39557820 3-hydroxyphenylacetoylglutamine 22492.3379 55201.6445 52603.4141 49405.25 42325.4063 21502.3359 21115.5469 27685.6758 34280.1758 312682.2188 30159.7422 78818.7188 20314.1035 33069.7305 74529.7031 190882.2344 28746.7734 23311.8145 86826.1953 48052.043 53289.8164 44766.7461 684069.1875 152693.8281 10621.3818 86910.0313 221397.3438 218979.5156 11765.959 509287.4688 44678.9141 126384.6875 735462.75 185291.4063 76607.7031 29113.0898 473862.0625 117245.0078 53835.8438 171754.8281 181212.6406 177898.9531 172312.2188 238664.1563 94096.9609 42615.7617 140288.1406 26203.1582 130119.2891 155988.6406 280186.3125 77736.2813 761545.75 185570.1094 490235.4375 272670.9375 80918.5547 27814.959 133768.875 85856.75 68307.0859 38134.3008 254910.4063 32907.8672 110504.2656 662445.9375 96554.4063 91912.9219 29159.7148 90549.0938 152219.2813 292913.3125 48270.3125 969638.6875 123556.7969 49432.1484 420180.1563 47221.6758 45209.6484 59223.0898 96568.3516 43997.7031 77294.0781 288825.3438 235367.8438 36086.4219 70524.9453 36601.1133 38844.0938 28659.6895 523338 19526.4824 155927.9531 38256.832 102405.6406 450650.4375 45901.2773 53407.2773 56834.8281 42323.0039 49856.918 529573.4375 454280.0625 102050.6016 130714.7578 115914.8828 170675.3125 53007.582 99067.3984 83968.3125 597024.75 46436.0625 131428.1719 412743.0625 884615.3125 86977.1875 82514.6719 242856.1406 30648.8906 47686.5078 63495.918 107111.7422 160123.5938 489918.7813 106676.125 67206.2188 56159.3711 832758.8125 94760.0781 26870.4609 30216.5059 149719.4531 67469.9219 125532.8984 58838.6836 100559 394782.25 279817.25 67299.4688 338849.75 117115.0781 84126.5625 63178.5938 149382 165716.6875 102656.8359 100559 172044.125 3164136.25 3128763.5 292313.1875 389500.4688 679875.5 105132.9141 61890.6172 162078.7188 209359.2813 120156.3359 336408.0313 318942.4375 100559 15236.6143 12175.5615 61539.5117 406560.5 100559 279665.2188 456173.0625 280776.3438 61030.1367 208650.3438 1376767.375 185965.9219 196849.75 trans-2-hexenoylglycine 130214.3906 164069.1406 151511.75 164977.4219 95475.5391 73228.9141 100748.8281 93296.5859 24905.9355 213284.9219 256488.1563 106047.2891 182139.9688 489505.0938 763544 147555.8906 145338.75 119780.7813 381965.4375 36403.8359 108612.6172 92385.3281 4622920 155716.3125 169498.9375 173381.0781 193156.3125 138023.4063 192452.8125 123626.375 95755.0703 114150.2969 88502.0391 242003.5 196898.9219 209782.25 506104.9688 205516.7344 45363.7109 133722.7031 126590.4297 83218.7813 313873.75 161027.6875 151835.3594 276697.5313 130667.1875 172659.9844 171555.5 105595.7969 1312275.25 88939.3672 494169 228483.5 146324.6563 564590.0625 96918.0547 299673.6875 158372 116471.4063 40654.0859 109091.2969 109339.1953 93575.8594 109046.4063 256591.8906 360909.4688 78693.9609 58289.1328 155920.3594 101879 60475.8008 163884.3281 88371.7188 101576.5234 1076636.375 174432.0156 81046.1328 49160.8945 64678.7383 283210.1875 57407.7813 299152.8125 163837.1875 288090.6563 129122.6641 116792.6953 1210050 80891.2266 464361.2188 808666.8125 163602.2188 302214.5313 154592.7344 73890.8281 295803.5625 312055.9688 64420.2813 517651.6563 191646.625 264443.7813 135663.1875 122898.2578 62904.375 213328.4688 280470.4688 81502.7109 315838.1875 562551.75 108532.0469 163974.8281 77704.2344 162151.2656 74185.2813 105199.4922 836460.4375 109811.0156 1894791.25 643249.1875 53406.2266 403148.3438 396688.6563 123342.9219 264538.3125 140044.7813 276701.0625 197835.7344 160823.6406 344198.0313 322576.875 76117.6953 251731.2344 81939.7031 128364 77032.7578 1175222.375 169188.1094 358649.125 134246.9063 144280.5 106994.5703 3021599 244056.4688 3097102.5 193827.5 2-hydroxyarachidate* 491792 784601 590797.6875 1481739 746533.3125 1165584.625 849140.3125 395363.8125 665346.625 594663.875 2321183 558707.4375 724546.5625 505606.9063 692606.5 1205998.5 688483.625 871405.125 850296.75 401882.8438 864716.375 651883.25 480705.3125 1014510.563 539454.125 721905.6875 1328995 612388.3125 3010336 248067.6719 463216 378883.5625 518453.9375 507130.0938 759008.625 510731.9688 630335.875 870671.6875 308325.8125 462707.9063 365249.625 531605.75 673373.25 752041.5625 765792.4375 548065.625 355553 610747.8125 822224.75 388566.0938 447694.6563 824508.5625 640208.0625 478831.125 648515.875 181932.3594 226013.0313 592927.5625 511039.1875 280436.4375 762864 348738.9688 291524.0625 167819.875 192393.3906 517143.8125 499162.3438 438817.1563 854341.9375 330967.875 304959.75 532521.5625 553844.5625 332491.0938 299579.5625 648236.9375 383066.5313 614021.5625 266410.125 444262.2188 632339 136489.8125 458596.0938 793219.875 415515.1563 1193558.75 236824.5781 752906.8125 373230.3125 523158.625 1024640.313 465743.0313 219722.9063 900201.0625 418885.2188 1666840.25 395007.4063 332364.5625 362678.9063 348530.8438 261728.2813 718226.125 360467.7188 887080.5 1350738.125 422203.2188 551724.75 352610.4375 454533.3125 594015.9375 1765413.125 429273.2188 407453.6563 1163584.75 378025.9063 392796.25 402952 563238.75 636993.5625 642309.75 268687 686080.1875 405040.6563 584728.3125 605544.4375 965632.5 480716 527944.5625 635234.0625 940013.6875 746833.8125 474197.75 611635.9375 526728.9375 480716 413767.75 721045.1875 740390.75 440317.7188 490582 562456.375 430736.75 759053 561486.9375 544433.5625 364182.4375 385273.5938 586163.25 327920.1875 511751.0938 325608.625 507778.375 325560.875 505665.6875 386374.375 505701.8438 249165.1563 391883.2813 443243.7813 399685.0938 286282.7813 382271.5 614186.8125 1082210 375662.625 558220.0625 358951.125 631650.5625 569467.3125 761437.25 790608.3125 621389.6875 248448.5781 714124.5 535361.625 411429.375 2390223.25 480716 534426.1875 602769.125 359185.2813 358345.2813 271849.0938 1507309.5 361997.3125 474033.0938 452368.375 496504.7188 649030.4375 374242.625 336448.6875 334967.8438 566905.3125 529562.25 379631.4063 657522.5625 241903.0469 267754.4063 255201.4375 303808.2813 592174.1875 1166317.875 395492.5313 688674.125 1140336.75 358966.7188 357446.125 650976.4375 279142.4688 519213.3438 411249 311062.7188 337839.5938 788888 453710.3438 312440.2188 1299499.875 511566.75 228133.2656 668948.375 771896.375 242778.4219 699911.3125 608861.625 412948.4063 263290.75 307410.4063 185803.8906 341406.3438 508728.625 745841 515580.125 371849.125 423914.9063 559271.3125 1262890.625 461643 432007.125 495320.8438 480716 1576295.125 443507.9063 439190.125 829392.75 466837.625 362566.8125 817802.5 201851.6094 328466.7813 421531.5938 323969.9375 379375.9688 1082567.75 645304.375 322980.0313 311160.0625 285850.875 536830.125 356851.0625 648663.625 347512.5938 480716 316415.3438 407346.375 610597.125 533199.0625 414679.875 301916.875 333826.7188 565978.125 425755.8438 515694.25 587986.1875 451358.125 475322.2188 520624.4688 269323.75 196481.4688 537585.875 334059.8438 248063.375 811569.375 347442.375 333679.8438 205872.5781 736088.9375 469313.2813 468670.2188 241699.4375 100713.5781 293905.2813 372637.0625 345248.9688 370296.8125 351297.1563 395089.4688 338251.2813 dodecenedioate (C12:1-DC)* 228110.9688 311562.2813 257472.7969 226595.1094 322365.7188 292921.2813 306363.0313 279232.875 265401.0625 1813201.125 157106.2656 1183700.875 311765.0625 202147.3906 304835.9375 409508.1875 614357.75 258884.0469 220715.5938 700866.6875 668119.4375 979335.4375 439898.0938 454046.375 201347.1406 724155.9375 789391.75 455185.875 521226.5313 325756.0938 665964.4375 161891.625 604553 344223.0313 159149.1094 206023.1563 210847.5625 433008.5625 137988.6875 302740.375 385222.5 561046.3125 238130.3594 221103.0156 515197.1875 372880.5938 316964 119482.6953 316964 143966.1719 1934881 20169100 416940.5 569410.4375 1434131.375 775189.4375 107959.1875 371095.1563 379758 303317.3125 782235.3125 404074.1875 208560.4844 101561.3281 74913.6016 227375.5 430283.5313 129652.8906 380836.4688 284303.25 200707.9844 169713.7344 215980.4219 1939238.75 226041.8906 297928.4063 608113.5 111290.1719 415998.75 239746.3594 1552649.5 202354.0625 316964 132704.7344 282373.625 101098.9297 118683.0781 372686.5625 243490.2656 465950.4375 146232.5781 205243.6875 600865.9375 1808794.125 5902018 321126.0313 153952.2969 248189.3906 321719.5938 162326.8438 229484.2188 517771.7188 282973.1875 231351.375 574866.4375 1605816.375 592082.875 214390.8125 213395.9688 489917.0313 1610760.625 407952.1875 425274.4063 161096.5 1478573.75 115597.5859 263257.5625 2068240.5 192379.0781 631493.75 278463.9063 194939.5156 387238.125 1194637 293792 602312.625 322359 311569 275836.75 267809.625 93215.5938 238683.6094 114038.9844 804583.375 1459591 121417.9609 224189.9844 245974.4844 325213.9375 265961.3125 125983.4922 299748.1875 100438.2109 771423.1875 596892 1834493.25 308048.8125 3400661.25 2781309.5 205875.0156 102961.5313 82607.8359 78643.2031 78694.25 378127.1563 182458.5 869487.5625 237209.7813 323858.3438 117938.2813 425358.5 338507.7813 1280512.625 5598884 94737.9844 199460.1094 364311.4688 163135.7813 211893.5313 138464.125 388540.7188 136631.4375 383007.625 45587.8555 145953 1441635.5 164793.2969 255399.2031 465626.5 723224.9375 336990.375 189119.625 164543.0625 236005.6719 601888.5625 527807.5625 73730.6953 1147879.875 91341.8594 1226084.625 315710.8438 755108.1875 108358.4844 53563.1758 67601.6016 132222.375 584563.4375 290094.6563 317763.7188 1130996.625 941559.875 208824.4063 103520.0391 207353.375 1005665.313 167931.1406 161315.1094 151888.4375 135520.4219 461665.875 931875.6875 878548.9375 522909.4063 167489.75 75230.3516 147229.2031 598500.5625 1145906 4519715 610785.75 1059249.5 949835 632411.625 357108.8438 1303081.75 504109.8125 299149.875 531341.8125 1382876.625 1124310 512238.75 344506.2813 2020677.125 701553.125 1228578 326381.6563 217506.6875 189244.7344 57880.1406 690326.8125 71656.8984 153575.5 531470 304015.2813 900013.875 1040022.625 535113.125 27487346 140643.125 309809.4375 259858.5781 1573390.5 179592.5469 1456574.5 183706.8906 785138.8125 431283.125 288700.9688 248491.5625 271960.8125 880230.75 229026.0938 282924.6875 924900.3125 1182549.625 268257 186373.7031 1198520.625 944846 335031.1563 146958.2813 364390.125 1287291.875 240853.9375 185671.6094 339591.125 354905.0938 1189969.625 1091635.25 hexadecenedioate (C16:1-DC)* 460702.5938 770488.875 855165.75 417465.6563 365828.4375 403410.4688 956635.875 808382 986938.0625 29857818 1417826.25 1537222 1008889.625 414678.6875 1418535.375 863398.25 559332.125 2267476 741328.5 531415.9375 1522188.25 1678574.5 473819.125 1261287.875 386378.2188 980622.9375 1573091.625 988386.9375 621507.5 498629.7813 1010708.375 188973.1094 1822395.625 2973563.75 1105960.375 306722.5938 421099.625 1793805 604601.0625 548244.75 573065.5 1467325.25 562066 812951.0625 641841.625 1176137.625 334786.9375 227146.0781 694639.5 513906.8125 14447698 54224840 1818711.25 3930598.25 17833180 2625633.75 625092.625 3154996 1076970.25 4468040 4472294.5 2673351 1432892 729936.125 722650.125 733260.375 5208255.5 1290250.375 2332167.25 2505935.75 2485063.25 1307208.375 2256693.5 1239163.125 7293520 3556317.5 1385443.625 9648625 2405237.5 3766753 3180366.5 9122609 1316518.75 3342806.75 4833527 4267096 478195.25 1260062.5 1961404.25 1689945.375 8513628 776678.3125 1067325.375 4913250.5 774894.1875 7995830.5 11710822 9243082 7063580 951197.375 1759271.5 1843393.375 2095980.125 2273740.75 1335755.75 1167705.5 5505167 2371562.5 1504974.5 3452514.75 2160080 12361728 2561181.75 1137860.75 1523422.375 1899418.125 5258687 1474005.875 8251778 4130229 13564962 1805867.5 1774192.875 4761773.5 2173090.5 10006672 2158703.5 16513355 1591552 4680730 4138852 2616225 2046306 3133420.25 3635815.5 1337242.5 2458507.5 2158703.5 816088.875 3741707.75 502795.75 4397030.5 12015556 2318495 2449597 533579.75 1411980.375 2177408.5 3009001 1205545.875 1809455.75 1452376.75 5682447 5364568 22558056 4588753 54537192 23621960 2697452.75 713458.3125 447160.5938 746787.875 2442827.75 5051777.5 1270887.5 2912031.75 5533310 5923908.5 4989327.5 1130532.75 1787862.375 4951055 4542408 14025174 908474.6875 1575952.25 6448712 1813373.375 1415717.75 1496114.375 3495453.5 1451540 5109250 622940.25 3487167 6065062.5 3113391 1995355 6596725.5 11851877 3390836.75 2482126 1234873.375 3672148 10978437 2851847.5 806522.9375 8871655 3110466.75 937203.5 8719765 1829596.75 4844667 2158703.5 839462.875 3095615.5 2158703.5 951543.0625 2474378.25 4742989 340582.5938 3591848.5 1120823.125 10315615 2374297.25 1618773 2027187 972343.625 7794472 3136322.75 1416481.125 4848972 1949056.875 466767.2813 3128997.75 2770443.5 6625938 435783.9688 2099383 2006065.375 2156097 1714931.75 5425694 12407281 23667900 3448879.5 11434731 10775776 4780532.5 2868507.5 584420.875 10235479 5174254 1468429.375 1086484.5 3928357.75 20208506 15189518 1531113.875 297628.4688 653431.6875 8627969 995841.625 2180683.5 3584195.25 3182266.75 250053.7813 1492962.125 424729.5 3127996.75 1083554.5 3311180.5 487269.375 6307508.5 2136351.75 4903887 14964529 2292349 80321048 1679276.125 726966.875 3811466.5 9864759 1739661.5 6469052 910750.0625 2533149.5 4135815 1628422.625 2762755.25 798319.375 2078882.625 829073.625 1189029.375 6734188.5 3769144 6444813 2238524.25 3001578.75 10257712 2614104 455724.8438 2720826.25 889369.3125 1441044.5 563191.6875 2585513.75 4028997 3034200.5 5758662.5 octadecenedioate (C18:1-DC) 4507547.5 5663886 12983830 5278769 5411752.5 5919506 11947529 7216475.5 8854417 140620784 9918201 7980752.5 15960515 3413476.5 8310270 10967700 6830420 14077783 7137453.5 3443006.5 10175964 9766214 4238082.5 26311194 2940792.25 11075638 9210523 7434237 13263124 4805232.5 8245415 5807695 24683886 39068124 10024826 3462018.75 3113961.25 16927276 5230532 8578643 6303539 7849495 4266327 14521598 6505155.5 17629584 3566313 3164951.5 6514835.5 2216345.5 231302192 1046263680 18914860 51914844 309379648 29382054 13233916 91965136 20375832 50056448 116170472 71648904 26970080 21895746 5541635 17332598 75047744 18949190 42471964 22047630 12095122 13132702 20954770 12856489 43765576 54416476 23578696 99753800 27747690 23850680 62938740 125869080 18753532 47030184 125762472 107403696 9275624 22171524 44990700 24293700 244302240 9783163 8070257.5 97021024 9293900 129035280 85821496 35337640 64461216 17089428 8704807 32039550 25826078 67316928 44271016 8007487.5 65251664 26619564 25147708 62622648 11289720 90072920 25759446 27641356 20181618 18367314 49163752 10010824 130989344 80670584 213268880 14666765 25460852 45826656 20688530 335701312 38521376 149658848 17955576 76559552 36625796 15536570 29346652 50095480 21982302 42003800 37924368 24293700 14483461 34353356 7655678.5 60664376 174058272 19175852 27352098 10840195 32331558 27855828 14493505 26217098 20986480 39695704 48723804 100583968 87737472 39091212 840755200 138069936 15730489 22639628 4489304 14087119 28874654 57253928 21516198 39328556 50415512 90936744 57153976 16693491 38839612 39869940 19329270 58228704 11050203 23895194 79460448 16850690 30573734 21430016 126247408 8104499 109282464 5714006.5 67363208 24590168 23375828 54096352 33700916 73839112 98293912 25118476 16766435 26801584 77986064 38637812 9469038 99213008 25474052 16458110 33067800 26498872 55848456 54168540 9533040 67626544 59426580 9934781 12223326 68370024 4729933 22378214 12282883 86869440 24344922 31284884 28815772 7608388.5 194680416 31773950 5457522 59450816 19576590 4347630 24902198 28857964 39362484 4376508 6377550 36024368 13905553 7462194 100300088 111808832 101243192 47431384 216175072 206759984 13014160 25739548 7964436 62526304 24745768 18089908 7280636.5 37007948 149768976 243398736 29203168 2042506 8198256.5 66973276 4119647 10612836 64939860 17148168 1278010.75 7220087 8526965 20753866 9708602 42295532 5840433 45323240 20356980 104082824 49173372 8960549 411811776 21926384 7409298.5 33844908 95475952 24293700 53316724 14447392 22974260 70820568 18183800 84680200 9356717 14259176 8049673.5 21744342 38036840 26691654 59674532 21717936 41133480 69489800 20879938 3773162.5 32829146 4871584 14517870 10688994 67424656 49585860 13761489 24293700 octadecadienedioate (C18:2-DC)* 416303.3125 752243.5625 2387249 744500.8125 5038597.5 630088.0625 3027000.75 704921 528972.375 23745142 1393476 1502048.625 3801628.5 717112.375 708450.625 1981285.625 740369.4375 1375347.125 2564834.25 1447654.125 2221851.25 2726520 1115723 2146597.5 3907519.25 2686738.75 913924.6875 2264471.25 1776045.125 1086352.5 4858483.5 1439531.25 5773201.5 3447453.25 2487728.25 744487.5 942728.625 5590774 3597708.75 2620825.75 1790859.75 1305943.25 730251.25 1675008.5 862714.375 1146333.5 278647.0313 834906.375 1814150.125 587826.625 8029957.5 28477646 1353501.375 2007890.75 9994998 1492932.5 2888778.25 6467989 2217104.25 2416849 4503052.5 3859022 1338447.625 1458133.375 357415.0938 1135797 4562371.5 1930583.375 2105933 2058090.25 1178585.75 1128791.75 2671807.25 784389.3125 2826006 3467634.5 2486420.5 4646594 1719159.25 1771178.5 2998136.5 7867844 1284133.375 3387103.75 5565254.5 6201056 1349489.75 1405508.75 2974842 1276409.75 11443312 981749.4375 747830.5625 6883935 961084.8125 8327668 6128381 2785649.5 4166478.5 3225137.5 950535.1875 2324610.5 1530802.125 4817506.5 2735444.25 955650.875 2582125 1930958.125 2464997.25 3588415.75 1484613.75 7625770.5 2609984.5 2067904.625 1904159.875 1435087.875 2461401.25 713639.4375 6841087 4938619.5 12974708 722221.3125 2991036.75 2629030.25 1187792.5 18146966 1984336.625 7495037 1709933.375 3822003 2866428 918939.375 2330131.5 3927912 2033125.125 3237252.75 3042000.75 2368933 1921017 2953628.5 705028.625 4006508.25 12709109 2171077 2847589 996120.875 2043948.5 2103256.75 1390712.625 2381355.5 2038967.375 1733990.75 6925857 5880936.5 4874204.5 2684177 46544560 11828147 1314183.375 3012233 395182.4063 879716.4375 2326053.75 5967239 1477881.875 2448006 2171077 5901846.5 4215873 2906455.25 3129372.5 4359795.5 1458161.125 6290054.5 1899401.5 2141391 4857661 2242988.5 1605114.25 1890814 8118504.5 1082904 17424536 171597.5781 4907301.5 2146810.25 3002419.25 2337418.25 3189140.75 5997477 6710718 2077864.5 1865039.625 1974262.375 7675692 1936153.25 1241479.625 7428941.5 2171077 1175052.625 2374374 3240259.75 3533329.25 4616237.5 1158740.125 5444437 4806168.5 632719.75 973637.8125 4635429 303104.25 1630276 1023323.375 5670176.5 2371111.75 2645081.75 3651371.5 556791.8125 14918544 3064470.25 734051.3125 5625041.5 1425817.75 337874.25 1282432.125 2418142.25 3176521 609129.875 1375888.25 2171077 1301683.625 496612.1875 8061525.5 9144410 6585119 3994658.5 11224125 11727300 949383.0625 2291579.25 741928.8125 8364839 1677001.875 1477826.875 813555.5 4291670.5 6681029.5 9401791 2392339.25 310595.75 774550.0625 5595184.5 579892.625 1251933.75 5020436.5 1533195.125 195037.3438 795512.5 1173813.25 1658518.25 989578.1875 2477471.5 974613.0625 2885064.5 1731739 4934932.5 4696411 821022.0625 28396492 1204031.875 636827.625 4684362 5207694.5 1966605 2734664.25 1323719.5 2169911.25 5501740 2613239 4026756.75 877083 1376796.125 496512.4063 778859.25 3029394.25 1869112.625 4234477 2125049.75 1390226 5712163 1576623.25 303892.0938 1808094.875 841098.8125 1617674.25 991732.375 4848058.5 4185656 1800930.625 1499973 glucuronide of C10H18O2 (1)* 16234.7197 65222.3633 73700.4297 29838.0078 72153.3984 144339.5625 38057.6836 261092.2813 156455.4219 110928.7656 61219.7266 144287 50268.5039 826848 155731.3906 92449.0547 3529240.5 222488.1094 79779.9766 799374.4375 54456.7031 84528.1875 98887.9219 776515.125 889988 85454.6563 1969583.375 52968.9023 442950.25 364803.7813 119460.4922 221997.9688 741685.8125 77942.8125 60743.6016 59175.6602 71923.9688 123083.6172 172136.625 25368.5059 514456.5 126278.6406 3425026.25 144234.4375 150823.75 167452.5 100926.4219 53564.1289 211133.75 185386.4063 47978.875 62615.9375 111883.5547 67838.6406 24800.0137 155402.0625 228332.9688 321546.8438 228475.7344 1043969.313 454364.1563 425382.8438 145150.1094 291373.75 144287 1093794 278074.6875 486357.9688 227988.8281 58547.6211 68952.4453 48378.1523 197931.1719 144287 143423.8906 143290.875 169742.3281 glucuronide of C10H18O2 (3)* 36098.793 103537.6563 91609.5313 156791.2969 304444 30142.9023 15009.0068 155773.2969 89241 123722.3672 66548.5156 74944.3516 142874.6406 21339.2109 442383.1875 875549.5625 255125.9375 62545.6797 52754.6523 21736.7598 78660.4609 87256.2578 517638.1563 89241 143653.625 26973392 15927.8213 89241 84521.2578 59354.4219 179823.3281 74705.875 53564.707 35832.8164 30573.8027 1227307.375 111561.25 606763.1875 612160.875 36432.6367 129300 70086.6719 66969.8828 59830.1094 42214.6875 36889.8789 580323 113285.0469 80138.6016 83784.6016 707775.3125 5459903.5 708298.75 93960.75 51279.668 49062.1523 47996.7539 184249.4375 16716.5762 44629.3828 125388.3984 117574.5078 981404.625 611084.375 215459.3125 43549.6094 2650153.25 3-carboxy-4-methyl-5-pentyl-2-furanpropionate (3-CMPFP)** 10588997 10514596 28484620 6735141 19392930 22282372 10630431 11572923 10188975 27226798 25302748 14555315 18297526 11565579 28753028 11515813 14713667 17540936 19366936 25245224 23480226 25560066 27040294 21610092 44840336 20261508 29745288 9365644 26525992 18421872 23417516 19440286 39284880 25710824 42436560 3734969.75 16180153 30996512 31073200 10686163 21460772 42478416 12752520 21533048 21932120 18026744 12462246 19903482 11498014 26634962 46006672 12382721 18855456 53968748 46222076 48655332 8788235 3693811.25 13050245 23733252 14277467 4659832 5790735 5915011 119822120 2572892.5 17256622 10861077 5753130.5 12255789 26967942 6846153 7434013.5 717565.3125 32910264 15649585 9251337 13199673 3264749.5 14995548 18408248 23637874 6443024 11716481 2491818.25 1506025.5 6325647 2626030 4917060 9076014 2128207 4266168 6129018 17581308 7832366 3996464.5 24492240 52026320 23912934 2372371 13700536 1339603 14925611 4487805 1356491.5 21673566 17052654 3009100.5 8659871 2136323.5 9527838 47126056 20359168 9231263 7405420.5 26906982 17821032 10090667 5162881.5 9221154 2028957.375 36053736 13974752 19167144 54814244 466198.5313 21925058 17970178 48591700 14161061 2283702.75 39217560 29477046 9988281 8149216 1988748.25 8250585.5 4994152.5 10057404 194024304 13700536 5484841 6952535 31308182 7829124 5886517.5 22131058 20366412 43942156 9210115 28183544 4547765 22182600 12778929 64094032 27556444 591585.625 6728760.5 11023423 4939715 9866543 6471494.5 12724573 8398120 42609820 12451251 6352866 5351559 2400424.25 8682157 6923888.5 4018213 17339946 26658490 13865009 12823581 20629272 6754303 3983348.25 8946621 2028012.5 79661840 8805241 55581396 7329291.5 9250413 29994904 2326366 40561028 22532978 14187652 17725844 5644483.5 4373968 11114796 26547844 8635950 64736488 73665616 6237205.5 44629856 3704071 2096771 7822258.5 11360379 2207730.75 2026657.625 665833.1875 18693408 2826610.5 2280844.25 12807506 13700536 51735680 34874960 5824556.5 15926085 51762352 2347435.5 7933580.5 60241060 697031.1875 11501006 13700536 14684635 8605883 29663930 25948546 15589935 6055041.5 16822614 1107004.125 13346065 39172032 20978798 43825172 7007593 26323884 41343588 9710039 16808868 37149620 4166360 43149724 35304676 16733552 17141586 10626138 16888300 46478912 27154734 16283890 35482788 142612480 9619684 4045241.75 35271296 41179196 5860509.5 21419654 12219613 14289657 16490742 6428787.5 55314084 3099166.5 23572728 73845520 6871483 5002069 29697950 12890486 43374672 2820014.5 5778135 3635904 28872290 9454306 26456098 6911140 24893246 5150611 12438475 38995300 13123604 37295924 8100451.5 20734460 19453706 26846982 9778524 33195890 890617.5 64960332 13289875 58591024 4068071 10771577 82378248 29913618 methylnaphthyl sulfate (2)* 946932.0625 1790104.125 63522.2852 272007.1563 74346.1563 454911.5313 76399.5703 749776.3125 99425.875 113439.8594 82395.1328 45450.1563 189667.3125 67365.9922 28653.541 34596.3477 119169.8359 104785.6875 26473.3418 92566.8359 1013485.688 226921.7188 29026.3301 61057.7188 79652.0156 690953 41661.6484 200698.4063 28537.5234 105440.9219 128779 641122 30394.5898 363603.375 23582.1758 100871.5781 206670.3906 128779 412034.3125 98583.4688 166338.1719 45204.0156 68178.5625 363410.6875 349501.3438 23381.9902 33361.6445 206450.9844 303618 48296.6328 43625.3086 130190.2031 134145.2969 338591.875 165358.4375 162834.9219 174330.0313 36671.9844 158194.1406 39759.0586 42002.1836 239674.0625 185213.4375 85615.4609 22741.2754 128779 232030.3906 51690.0156 189645.1094 782260.0625 22180.4922 277052.125 27930.8184 63408.1289 189683.0469 57049.8281 565263.375 69317.625 183066.5625 148199.0781 1532675.75 87919.6641 1165477.875 169359.7188 1249020.5 99553.9531 96720.7266 71426.3672 363942.6875 86593.3203 53066.5352 363917.0938 83030.4688 84926.8516 512087.9063 152226.1406 101701.4844 76511.4063 61601.1875 87252.8906 349023.0938 256752.3906 42048.3789 90866.6406 49557.9258 78209.5781 390435.4063 271152.375 342386.375 103962.3125 102242.3906 305433.0938 102412.4688 1003236.313 96099.2813 1307570.875 306240 54798.2383 562243 77040.8047 142746.7813 224041.9844 63830.793 121996.7031 352117.5313 379128.6875 203980.6563 71749.4844 107132.3359 367617.375 78742.8203 2479415.5 1075883.375 204480.9531 79955.0781 175505.0156 347482.9688 47915.3789 243654.125 118759.6328 381909.0625 139897.5469 901619.25 86067.5 123115.4219 30860.0566 1409894 100832.75 146013.3125 28917.5859 128779 52492.3203 224210.9219 475293.0938 189982.7031 128779 1086935.625 186515.7969 206438.7188 528519.9375 201081.8125 80019.0078 225298.5938 356576.7188 49269.2109 85312.8594 172614.375 86324.5234 1544937.5 122383.9766 28903.6738 254833.0625 201156.4375 46111.2578 29458.6582 81570.6406 721779.1875 42479.2148 110149.7578 679642.5625 918545.6875 71702.3359 395384 33515.4063 634831.1875 glucuronide of C10H18O2 (7)* 18276.332 109322.2734 224795.5313 250858.0938 83674.7578 112644.3281 70645.1016 118735.0234 224856.4375 123156.7266 331909.6875 33691.5352 359921.125 121047.0859 170268.6875 137401.6406 174823.0938 319627.0938 85065.0859 58353.3945 813181.0625 15389.6367 83927.8516 371686.0938 121802.7422 106589.7734 4511802 55795.4766 214830.8281 332980.125 25148.5469 322541.25 123531.6484 32542434 24736.8906 103133.7813 312139.9063 18461.8945 1281677.625 125860.6563 3261408.5 321911.1563 126131.5938 218849.0625 28841.9844 67318.1797 7645532 151823.0938 123059.8672 1187177.75 1790038.25 143873.6094 11915330 40745.3398 23199.4492 1250411.375 182668 97147.8438 1541396.375 98800.2734 71828.8984 1438877 814596.4375 548658.5625 2501454.5 59119.0781 1469970.625 84182.5625 140479.5625 97433.6328 66219.7109 113212.3047 4448716.5 37302.6758 144644.3594 154126.4219 130114.125 163974.2813 33385.2891 146275.8594 244241.5313 101107.4141 116852.6094 232253.2969 755081.375 34642.1719 410200.9063 162019.2344 24198.8438 214588.5938 52132.7852 83789.0625 84725.1172 953764.375 724047.625 37219848 3473224 589200.375 457013.625 411906.9063 296857.375 278721 456521.4375 1296664.25 842805.125 81068.9766 201299.75 1333638.75 156949.7813 182668 870501.125 67141.75 138520.125 931705.8125 77727.2734 123067.5859 108200.3438 593533.1875 15517.3379 182668 116754.1875 1368981 660263.1875 116655.7031 3753275.75 860146.25 2816315.75 2390573.5 168269 259163.7031 5547685.5 957690.625 190512.9063 2595141.25 50274.793 78600.2109 1484995 455551.7188 72350.3047 192452.7969 82634.7578 1438147.25 181960.75 7048876 94006.0859 313564.9063 906184.25 1058232 1346937 708651.625 402837.625 48943.2227 2343830.25 glucuronide of C10H18O2 (8)* 33480.1484 154654.2344 203500.3594 64769.2969 36650.6602 43231.6367 18112.8867 61694.9297 63473.5742 29971.2207 410762.625 92821.7422 572602.5625 165459.125 4273980 141416.1875 54897.2188 333011.8438 136244.2344 409564.7188 591792.75 162967.1563 245523.4531 92027.2188 13273925 179711.7188 62685.3828 121803.7969 316975.3438 30015.9453 1070931.25 339301.4375 139508.7344 7161618 53476.3164 292459.8125 579271.6875 166084.7188 191079.9375 5353625.5 97196.4453 876924.1875 73658.8984 562152 72765.9297 91221.2031 7671289.5 56987.6016 179815.2813 79843.2188 214041.0625 114441.2266 129894.2188 111693.9375 248475.9063 80817.2734 2105386.75 91926.5859 921850 455478.7813 77370.4609 1343989 156246.9688 218894.25 116356.8359 115259.7578 149132.0781 3240985.75 128064.5625 101771.9922 224174.1875 124677.8047 73033.3594 219046.4531 94730.6484 91406.6719 176409.1875 255083.8906 77608.5703 653673.0625 185417.5 506940.0938 60848.5039 240684.1875 96985.3438 203059.5781 438740.5625 47949.1406 114166.0078 114825.1563 966864.3125 42212.4844 17099434 1078751.625 1073525.5 237390.5625 192036.6094 201934.4375 102350.7813 235990.3125 237096.5781 35077.3125 62236.6094 163868.6875 639889.625 236667.5938 217390.2188 102193.0859 55898.6367 158677.1406 423678.5313 156781.3125 122034.9453 1349768.875 25339.1133 47905.543 620778.9375 83889.4766 142092.9531 215159.8594 551259.125 119450.6797 42821.4102 440782.8125 173028.7031 612157.4375 181779.6563 81893.0156 240095.1563 622199.5 118367.7344 838616.625 234258.8125 631070.75 359341.2188 583607.5 150998.625 257653.5313 177747.3438 2303175 179763.5 8985051 60784.1719 331787.4375 18377.1094 190462.4688 575424.1875 83770.6641 229662.6875 209638.8906 121312.4766 145197.5156 3272196 179763.5 182497.1875 278605.3125 63495.3047 333695.4688 203280.0313 72264.2031 266585.6875 965859.1875 N-acetyl-2-aminooctanoate* 180289.6406 409516.25 263460.9063 112969.9531 81327.6797 588794.6875 188421.875 157979.9531 130411.8438 919940.25 299204.1875 149516.9688 1374329.375 226746.2188 469170.375 145155.9531 255526.1563 364759.75 266970.75 181765.7813 131009.6172 435068.4063 216602.5 546461 365130.8438 183329.2344 346637.6563 184908.5781 321505.25 163081.5156 231728.7344 136860.9531 173050.6719 718432.0625 461506.7813 236211.8281 408407.6563 430486.8438 237827.4375 210522.6719 481191.6875 271288.8438 66867.25 181681.375 474492.75 196185 682567.4375 118256.3047 144004.7656 125983.9063 121633.625 193408.8281 448813.5625 133690.3594 99776.4297 505017.2188 48960.6523 319488.375 46334.6367 105855.7422 17373.4863 56848.9531 159544.1094 91591.1563 135070.8281 52323.9609 189990.5625 163671.4531 34934.2695 77314.4063 80422.8047 56091.7305 35832.7344 326189 156000.0625 18876.875 98063.3906 492162.7813 25826.4141 48342.4453 85750.2188 115872.4297 62344.7734 43313.9258 70312.3359 265350.4375 356624.5938 944694.25 208578.5313 106326.2109 430671.1875 28049.9395 15659.7822 467586.25 28409.5098 231163.3906 76103.4609 45906.9844 33597.4336 307388.2188 64683.3242 62216.1641 196511.7031 27175.0215 129787.8125 160364.6875 35784.7305 290870.7188 389532.7813 213361.5938 100515.1563 119966.25 227480.75 245028.9531 549429.1875 103356.6797 57891 33699.5508 159751.7344 190979.5781 108468.5938 67223.8438 656425.5625 152543.5 51360.043 142670.1719 32542.8398 61829.25 88821.4531 26803.377 192758.9531 44513.3711 77945.1172 127935.7109 169092.875 60793.5469 27407.1348 83842.5625 41693.4805 62799.5391 95274.7422 58173.1406 70272.6406 76018.75 176644.6406 44344.1758 347041.2813 98930.6484 404791.5625 179172.5938 151293.2656 270101.375 27551.998 73285.1094 344233.5625 148359.4688 432960.625 78314.4766 79083.0313 114020.9375 33092.2578 205994.75 112734.8359 32085.9414 664389.6875 314347.1563 186262.1406 179627.0938 45830.4258 42197.7422 215662 66156.8672 139667.7969 130627.3359 136107.875 24056.877 1440802.375 70213.9531 32269.5117 59599.2383 153149.9688 482881.5625 159232.0938 117453.4609 91382.1797 60422.0781 393304.5 92648.125 260587.2969 287514.1563 334551.4688 813422.875 318965.2813 205588.8125 296956.7188 174095.6875 169368.2188 406181.625 687255.125 303843.875 46000.7266 239691.3125 237992.2188 93570.3203 139414.7344 56899.8828 324729.8438 235356.8438 91402.7734 677680 39619.5195 223074.6563 148225.3281 1790231.5 154747.9063 164523.5313 1111644.375 105886.375 173533.9219 169975.2344 57641.3359 103425.8828 213077.0313 139702.6563 61278.7461 88754.4609 689997.75 500425.625 72086.3828 252372.5469 40000.4375 614703.375 125590.5313 41495.5234 233924.8906 63168.4453 70977.4063 74454.4063 505572.1563 34841.8086 212543.8906 377327.3438 57751.8477 264215.125 219582.4688 80259.4531 435984.6563 208090.3438 140231.5938 326075.8125 178046.0156 463663.9375 352581.1563 154228.25 511627.3438 69726.0938 765028.6875 220193.7188 daidzein 7-O-glucuronide 335314.6875 1584842.5 86451.8359 94411.375 126804.9922 2771353 39752.4219 281075.7188 121196.3359 110252.0703 827147.375 47261.4219 86871.8984 436033.2188 631467.0625 72301.6797 834613.75 43366.5039 1876053.125 1172088.375 467118.7188 45633.8203 222597.5156 535774.9375 80007.6094 43647.2305 3735547.25 143084.2031 364088.6875 367885.9063 108609.6719 92683.375 303758.9375 165400.1094 3183339.75 664610 219412.2656 144125.0156 168645.4219 89801.6797 1109623.5 98396.7422 174612.8906 521507.9063 281379.3438 1879626.875 176373.9063 212204.4219 639447.9375 96788.3125 3770028.25 2758210.75 27235.5254 408173.4063 123620.6094 165914.2188 702106.5625 192801.1094 783114.375 29297.4277 497514.5 137787.6406 159179.5625 305586.9063 52290.7109 292544.1563 305672.3125 1307451.375 264786.3438 68283.2109 36752.5938 1031815.688 146037.7813 74071.5781 503170.9375 156356.0625 3551183.5 129572.9688 179976.4844 64435.0234 209772.8906 410625.4688 66346.3359 201287 39044.2031 918087 139219.8281 813619.5625 183161.75 genistein sulfate* 530907.9375 4663567 445944.9375 823226.875 8158974.5 47124.1328 166354.1094 2452332.75 33802.6602 4282054.5 289261.2188 38942.8008 31000172 1239292.5 6684898.5 4674819 1492277.5 939199 16079339 1509349 5545907.5 931792.0625 1795258.5 12398986 327229.6563 107513.6953 5834324.5 236720.6719 3183781.5 596634.5 3312545.5 1453530.375 63407888 7634286 426921.9375 869140.1875 1498918.375 4632052 134745.9375 201983.0313 1644487.25 10176315 2585911.75 14099468 10367034 7994600 1293471.25 3754755 577269.5 170166.0156 2022724.875 99583.8672 8765871 6423997.5 656034.875 425216.5625 1509349 769148.6875 2258754 840773.5625 15283925 13383034 91594.5 33267820 417517.2813 625701.8125 54459.4922 18080.8477 6174199 1942742 1453841.5 2895804.5 70420.6641 989281.125 1509349 27061.5039 1664068.875 2101694 414778.2813 3270306.75 1767642.375 315432.7188 56581 22214.4551 195672.3906 2060725.25 675878.125 219864.1719 5652410 1398845.625 96668.3672 1576898.5 4426281.5 10534223 1695424.875 37841528 5199076.5 22143.6582 3419306.5 235616.7813 22114584 1880729.375 4760517.5 21927192 20965.5879 14867.8057 7741471.5 40862.3984 752011.25 227335.6719 709726.6875 164291.0781 1321784.75 1509349 544706.5625 4810365 9602489 745062.0625 3114436 216535.7969 1063984.25 1600397.5 8540285 2178731.75 5750133.5 56760.4805 22916918 465755.875 1792195 310153.2188 1729624.25 1538464.25 841301.9375 10401196 1378330.875 37246580 151544.5156 2236828.5 3138478.75 394610.0938 5923915.5 3657956.75 244532.1563 174522.1094 25098.7266 1883801.25 3748369 56140.4688 130766.4219 1887828.25 221914.1406 1765941.5 3591978 1509349 1872873.375 perfluorooctanoate (PFOA) 556592.4375 670980.125 685120 737724.1875 809078.6875 869170.125 578831.125 884206.1875 776031.3125 1466324.5 4516097.5 755162.5 523512.7813 999514.3125 534577.3125 595401.375 489120.7813 672256.875 902841.125 981297.6875 712824 538184.375 61498.6445 1018260.375 677156.75 1133963.25 512766.125 771425.8125 399812.1563 373780.3438 548022.75 644675.6875 545444.3125 727113.8125 806367.4375 603745.125 1864422.875 849165.0625 785436.875 1156683.5 1206403.75 665034.5 3414854.25 798169.8125 1083013.25 1085356 1039705.063 965473.9375 339651.6875 463804 462009.2813 513497.2188 294329.1563 341439.4063 360797.8438 150212.7969 465598.7188 578877.25 367892.5625 291754.4688 582106.375 794209.625 318180.0625 379268.125 390675.2188 1428047.75 287312.1875 490955.3125 357994.7813 499586.75 424342.2813 456082.0313 1427121.75 262777.6563 178970.2813 333780 1023691.5 315441.5938 417576.3125 449233.0938 1165671.875 404610.8438 340031.4688 247789.5938 300855.1875 301334.2813 564067.6875 279273.7813 466518.125 566124.5625 223355.7344 685192.4375 380681.5313 414046.6875 531480.375 513178.4688 680337.3125 379871.5938 467301.5313 346359.2813 515929.125 657936 424520.4063 435806.25 360816.2188 361311.9375 358677.4688 356402.5938 963895.3125 557830.5625 712535.1875 456063.25 428000.2188 634641.875 534318.375 266004.0625 423238.0313 529309.4375 443580.1875 286276.5313 339296.7813 114399.75 552018.375 435511.9375 688212 348897.5 1257608.375 581725.5625 750127.0625 408648.3125 397915.6875 187181.2813 412045.875 353744.125 747435.875 490756.1875 571233.9375 861381.1875 149687.9531 640842.9375 704938.9375 293889.875 601586.6875 710646.9375 291310.8438 693880.625 421437.1563 801286.5625 251959.9375 296261 322352.8125 178966.9531 531145.5625 269506.7813 294673.125 262248.3125 329998.25 363549.625 2403773 496680.8438 364952.7188 470229.5625 202539.2969 945723 497201.2813 441168.0938 555804.8125 910602.5 365589.625 358106 562085.1875 268483.8125 458778.9688 610560.1875 891967.8125 536991.5625 148982.75 310168.5938 624360.625 530997.5 1518122.75 354484 660063.3125 133387.125 495906.9375 810186.3125 865703.25 244826.2813 577143.1875 539988.6875 439514.2813 153352.9219 485228.5 318052 580910.6875 123310.5078 446851.5313 555574 231565.5781 501371.125 132535.3594 338093.9688 421533.6875 445307.1875 442247.6563 463804 382462.1875 665511.125 452135.75 1200973.375 372440.625 447743.5313 256600.0156 864014.75 203975.6719 392664.0625 361559.3125 123757.375 252360 525311.0625 467564.6563 533748 175588.9688 465072.6875 589360.8125 5895383 926258.125 852760.75 463804 392949.9063 638065.25 162717.2656 580543.25 442384.4063 369508.625 535900.125 377587.2188 473083.6563 324435.5938 1265089.125 529494.3125 655600.9375 611177.375 407901.875 384623.9375 490626.7813 323886.0313 420800.5 182898.1875 154364.9219 257661.375 513552.9375 210458.4219 100787.3672 391632.5313 398510.9375 370132.6875 200804.0781 297313.1875 329085.6875 537637 357389.7813 1053148.625 582110.3125 343476.9688 298718.625 623143.5 599164.4375 953169.3125 244053.7188 250643.625 481497.8125 357187.9375 370933.2813 1520692.625 886539.9375 166771.4063 266287.5625 426488.5625 319108.3125 1325176.5 415563.6875 333490.4375 140789.6406 498556.5938 363807.5313 124823.9922 519936.625 429193.0313 443440.7813 1342524.375 491844.9063 222847.875 977072.75 436851.7813 358052.3438 400622.7813 306735.375 206165.5469 glyco-beta-muricholate** 64960.1289 25591.4473 1753090.375 82655.1484 114632.9453 951011.5 132065.5625 430206 158251.5313 62918.0742 183209.1719 121152.8828 281228.4063 89558.7578 70550.0781 742395.625 2392564.75 38961.0195 415164.2813 53149.5859 262625.7813 345560.8438 44310.2344 77131.9609 240389 430206 376975.9063 96217.0703 147531.8125 37531.1211 760632.8125 213795.6563 1745648.375 186730.0469 6430224 449790.4375 994654.9375 891799.375 366492.9375 82845.9688 644494.25 40246.8984 2203344.25 25109.8926 213605.375 5225651.5 23086.7676 13693130 9829954 69948.8359 426715.9688 129657.6406 228008.3281 83554.1094 390456.6875 459726 1903796.25 5429059 71605.1406 2103225.5 131040.0078 274271.7188 44579.8047 358438.0625 315880.1563 577921.125 737220.6875 1100346.875 132070.4375 941150.6875 6697437 445655.7188 322303.5313 498696.4063 466623.2188 1306172.125 2255415.25 419394.7188 1128693.125 481354.5 54599.5156 1178290.625 51682.707 3571680.25 241034.5156 243310.8438 167453.3281 1346342.625 224396.4219 1594587.125 1084303.375 122479.6797 7694374.5 52121.3984 31850.9336 2150050.25 262026.5 403255.9688 430206 266905.8438 7105597 440930.875 72046.2734 2523468.25 323974.5 776060.8125 192314.75 703340.875 22533238 2871210.25 151866.1094 827473.625 1436671 793705.9375 445247.75 914135.3125 89525.0859 1988092.625 225535.2813 2845490.75 6476643.5 663926 396775 720532.8125 1346910.375 222911.7969 123548.3672 1416316.5 883594.75 320753.4063 96772.6094 82570.2578 78728.0469 360611.5938 36714256 2008526.625 1338937.5 68032.7813 309069.75 81980.6094 5714775 341600.9063 201748.2656 127680.1094 238271.1875 238704.9219 79676.9453 697447.3125 1180738 745156.8125 634362.1875 860168.0625 34805.9414 510122.3125 296127.3125 709498.25 115053.6953 638384.3125 51168.9492 7388463.5 1358358.75 243857.7656 7769436.5 479576.7813 4523142.5 173862.1406 1417242.375 927148.8125 1314037.75 588282.25 5675083 1200468.125 221263.7656 37759760 1868998.375 353539.3438 644589.5 44639200 37839.75 340156.5 1337833.5 1562416.75 3697178.5 265756.4063 805658.4375 5010209 1938861.25 826729.25 457537.4375 101210224 300988.6875 269222.625 1726388.75 367937.8125 942029.625 58586.9922 410621.5938 992777.625 509258.1563 212369.5625 1500593.375 34647.8047 2473226 360767.0313 389760.625 663880.25 242472.2031 1016860.625 85894.2813 2021083.75 476576.7813 1063180.25 230095.7031 glycine conjugate of C10H12O2* 31199.4297 108210.4844 148630.7031 106857.125 168114.4063 40404.5898 59188.6289 267702.1875 96154.6953 129720.3672 205580.2344 104259.5 42758.8086 62951.9219 61307.2461 104259.5 104259.5 27275.6504 2283729.75 104259.5 glycine conjugate of C10H14O2 (1)* 177755.5781 261454.2188 328407.4375 134374.4531 74379.6641 79020.5938 182395.2344 221592.9531 127373.4609 88566.4297 109278.3516 150089.875 787711.1875 657795.5625 244874.5156 168954.4219 178592.8438 85497.1797 71035.1094 198320.75 387327.9375 223225.7031 75133.5938 212888.5625 478916.7813 121000.4609 86462.875 103806.3828 165616.0625 226997.5156 85242.3438 172322.6875 719795 220082.5625 77173.6797 112688.9297 57002.5234 202612.2344 124314.2813 513272.1875 174827.6875 187952.0469 360399 132812.375 99341.8828 89110.2109 786873.125 552007.5 380486.5625 63690.8906 173355 50596.293 174387.3281 126245.1641 181093.9531 562340.25 157118.3906 536046.75 734687.8125 73799.4688 99847.1563 168117.1719 106518.8828 192114.3438 74874.5391 967530.9375 289771.7188 glutamine conjugate of C7H12O2* 34175.5586 25429.3457 101574.9922 30728.5703 21668.4824 49063.7695 70367.3125 50061.1133 65769.2891 25745.4238 26128.3496 82444.5859 109821 18181.9746 79031.1406 264662.2813 1983871.25 786583.5625 249791.5 1818913.625 469961.5938 35339.8711 1435041 451157.3125 47230.4414 922740.0625 2617124.25 49361.9023 1121676 880505.0625 31226.293 393616.125 53491.8711 87024.3047 3173313 531293.3125 22784.7168 379195.0313 133022.9219 1044094.625 585651.25 1864378.75 1500617.375 823019.4375 770008.125 1721726.875 64380.082 89521.4922 266883.6875 205081.2969 553736.25 165810.0625 162053.5938 1115702.375 1496887.375 2574488.75 34014.7383 105511.9922 378819.7813 154630.5938 91957.8438 225763.7656 88489.2031 397285.2188 223503.0313 118664.3672 68114.2891 1283409.25 111560.8984 3298603 209984 437257.2188 142840.3125 4666160.5 1300330 1234087.5 32598.6699 41140.4766 553337.875 369835.0938 3021425.5 256422.9375 932292.1875 116753.125 2813936 180445.9844 100251.2891 378949.1563 172869.3906 950897.5625 52490.3945 613752.625 1818986.375 186710.0469 204925.8281 145934.0156 388454.0938 115991.8594 132576.4219 1296511.375 223291.9063 784920.0625 1584503.875 154844.6094 209337.1406 172712.9063 118205.3672 34455.1484 43441.8555 190993.3281 4508263 219017.2813 185059.25 42805.3086 117745.6797 28054.668 313428.4063 72852.2031 7590537.5 240745.5625 111873.2891 2057262.125 85437.0938 25823.0078 71142.7969 406519.9063 16678.6289 1473539.125 792147.25 29882.543 266350.8438 238529.2969 541575.75 706302.25 249791.5 415458.1875 233965.4844 319699.5938 2610050.25 1567415.75 1317917.875 1993096.125 646459.5 627119.625 85057.5938 180769.4219 115556.9297 503229.25 353767.6563 355219.25 35180.9609 266975.0625 261053.7188 396436.3125 113676.1328 61175.8281 975111.625 401528.4688 236905.8594 68822.7031 5306023 331082.2813 185261.9219 65055.3398 107039.6016 198543.2344 88622.8438 2201852.5 227605.3125 3640016.5 2222868 49519.4766 288867.625 3451101.25 3008161.75 31520.2051 382236.0625 394463.9375 203059.3906 231406.5156 47251.1094 634275.125 1023514.063 842169.3125 1269707.625 346968.1875 2515392.5 2953539 257133.0469 1745439.625 406101.9063 559333.9375 183756.9219 533516.8125 113286.6953 1762598.5 172429.5156 504337.5 104459.1563 243160.0625 1183334.375 102129.0781 2429442.75 29785.7695 4309833 300747.1563 388925.5 118705.1719 100401.6563 12399.5938 44154.3828 66250.5859 274742.0938 44595.1055 278040.4688 863275.625 2428045.25 102710.6953 42451.1758 103736.9844 1120957 211301.4531 271977.6875 121683.8672 1665146.5 892420.9375 glutamine conjugate of C6H10O2 (1)* 74873.2422 105733.0859 68917.7422 65673.0391 1563029.75 33871.1758 64887.1289 56116.3203 275013.875 75415.0703 75677.6953 41999.7813 26789.1191 53103.5195 88945.8984 65627.4453 101158.625 54035.1094 130519.5313 135030.7813 239865.2344 113948.3828 48722.4414 86292.6641 57608.793 145545.8594 89723.0234 56397.7461 101704.4297 45993.4805 22858.3203 323825.6875 105097.9141 88058.1094 87975.1563 114288.7031 161625.875 110532.5234 36594.3398 120439.6719 25279.373 121682.3906 68495 899319.625 38610.3711 111238.25 84357.875 4520550.5 2571562.75 185803.4375 1180328.5 12147763 2001023.125 107292.3359 3670065.25 493110.8438 76586.5938 4116963.75 39813.7188 7463361 136501.9375 2473399.25 37271.4727 1180947 93838.7188 860446.9375 83097.7031 38301.1719 200225.1406 5694289 1423302.875 42839.1992 1240131.625 398140.1563 2592014.25 1654059.375 2521446.5 1271797.75 1592518 91869.5 2556147.25 44057.2031 2464258 162952.6875 100520.3906 644050.8125 275933.5625 1651502.375 337116.1563 287162.1875 3093960.25 1993336 3107292.75 29916.877 115206.7813 189540.6094 673082.625 286123.5625 50675.4453 206843.3906 349654.9375 72553.9063 33735.3984 181554.7188 77407.0859 566454.375 291299.8125 229301.6094 117025.3594 1791844.25 359093.7188 4311335.5 780145 624050.375 562825.1875 7004874 29882.1914 3081309.5 2578963.25 120828.0234 129899.1328 1079195.75 841652.625 3436035.75 422052.2188 2339416.25 201066.5156 2924605.75 231964.1094 93692.3828 841314.8125 188525.0625 152730.7344 2005155.5 87889.4922 1138439 1839944.375 346497.9063 157401.2031 206183.6563 80570.4531 593017.4375 120099.5703 218049.6719 1680930 519283.2813 2037254.375 3788961.5 283177.125 303546.75 425028.5313 219853.4844 53092.0313 92481.8047 107997.5313 216323.0156 1039181.063 7338713.5 354245 289412.3125 124372.7188 185582.8906 140125.7344 754898.4375 190425.2188 12160854 317374.4063 59251.0586 202315.9531 2429275 268644.3438 86369.0859 105345.8125 132866.0938 866014.5625 78417.8203 2678081 2104778.75 134288.8906 932766.4375 157058.2656 836716.5625 1886717.625 1020025.875 1935006.875 124350.5313 523009.5625 657045.75 4154375.5 51098.1875 1903906 1874487.375 43979.3789 2688049.5 47705.6602 1102527.875 1179556.625 30832.7344 83569.3047 179685.8906 106414.0547 906635.3125 428418.8438 638045.8125 122730.9531 1065678.875 268066.6875 615151.0625 237448.9063 98660.1172 2177409 271541.0625 219303.875 167439.5781 95524.1797 6823492 868715.5 886624.375 129453.1328 298164.25 798842.1875 544385.6875 81434.7188 116611.1016 6636582.5 440528.75 4387949.5 19737522 295284.9063 695130.375 8293141.5 7235783 300496.6875 180088.4844 412626.1875 876135.25 342357.1875 234327.3594 165944.4375 2465327 3277902.5 1550667.75 2403068.5 68435.0938 742678.5 3698645.25 2262816.5 1218396.5 5436483.5 391994.5625 1866629.625 395327.2813 2354165.75 289049.6875 41134.75 3425829 274277.5313 682865.3125 238646.2344 812607.875 1907662.5 159158.4063 1821765.75 151259.25 4265090.5 447944.3125 65757.7813 487206.5313 408467.2188 275609.0938 99462.1016 77501.5156 280297.75 1126094.5 172202.125 862135.5625 2135132.25 38588.1602 6951618 307938.5938 46454.5547 551270.5 350157.4063 1402370.125 63932.1484 437284.875 393190.5938 216792.7656 2678219 977138.375 glutamine conjugate of C6H10O2 (2)* 184524.3906 217855.2969 95046.3984 222416.0625 225147.5938 117384.1641 59423.2969 124147.4063 286353.0313 154794.0313 158554.4219 210372.1406 120580.0703 74217.2188 100289.3672 219289.0313 117345.1719 98572.4766 454155.8438 392938.6563 88376.6406 114394.2188 41312.6563 475060.1563 432528.3125 219061.6406 310360.6563 100974.5234 23315.541 100528.8594 475866.3125 258635.7344 127249.3672 52879.4102 300817.25 148458.6094 130301.9141 249655.4688 260796.0625 38666.2109 205467.3125 32097.7031 813111.875 165301.2656 12855217 9285734 202240.6406 3486721.5 18035206 8799243 616541.75 106232.5547 7497042 2451299.75 271793.1563 8196776 178046.9531 14836508 614344.875 4515157 44541.6367 2455193.25 237443.6094 3274775.75 267081.1563 160933.3125 1166774.25 15447693 4134368 219541.5313 3236674.5 814847 9006739 5668776 10354244 4642304 5497549 189583.2344 2172673.75 84983.6016 8245601.5 384319.0938 413918.625 1750985.75 73928.625 427334.9375 2433260.75 1403196.125 921716.25 8406567 4862159.5 13046910 45133.4336 217490.25 547636.1875 6712508.5 1091754.625 179904.8906 423933.3438 799319.875 179371.5938 112889.6406 819205.0625 328629.8438 1891343.75 984760.5625 781792.1875 477508.8438 4564962 1511826.25 10708962 769520.5 2011330.875 2190614.75 17972982 55615.1367 8824959 4032018.5 321823.7188 319497.5 3635034 3417845 13797141 1207232.875 3833847 496613.5313 4805423 768819.5625 433670.4688 865232.5 645984.1875 322190.875 3424776.5 287032.625 1659998 6445911 924517.4375 302629.5625 515442.1875 221628.1719 1697725.125 402612.75 686421.0625 8273981 1273498 7611768.5 7636815.5 810404.625 1081689.25 1123067.125 627452.625 157053.2188 318048.8438 307918.5938 313586.1563 820940.1875 34757112 788511.125 1317519.75 432648.2813 861990.4375 446214.7188 3579292.25 882714.6875 32453588 2748486.25 69246.875 433269.4063 10859399 1224409.625 325349.7813 376722.8438 527737.4375 2409667.75 236058.25 13867471 6501463.5 500991.7188 1337535 845540.875 2810211.25 6113737 3973625.25 4900481 210795.7188 1887797.5 2497374.25 16370816 196173.5938 4345366 5962950 188127.5 9040853 134725.7969 2816532.25 4800599.5 54476.5352 313076.75 1081123.625 661567.9375 2552430.75 2262479.5 1638591.25 343268 1447625.625 1475222.5 2396552.5 360202.125 320516.0938 9003232 2030463.625 551829.6875 195375.0469 453528.8125 23026362 1199036.25 1250271.125 473215.5938 1021859.188 1605357.25 547469.4375 133527.4219 336799.9375 6568967.5 1109865 18160372 16642636 570514.875 2147823.75 23716036 35977272 204026.1094 382032.4688 1263008.5 3304478 1237660 717239.1875 763264.3125 6678954 9308297 6434111 3857243.75 149700.8906 1786880.875 12045686 6027929.5 954937.9375 9317048 700518.875 3305116 45443.3242 1944300.625 1414056 475164.4688 111600.8203 7759321.5 774250.9375 3260135.75 1028982.438 2319099.75 6747492 701221.625 4349677 208354.6719 14077749 307798 2181312.25 345954.9375 1636420.125 356287.0625 73410.5078 956146.75 142296.1094 427619.1563 750007.75 5801464 884044.25 2034377.25 3804711 156840.3438 28061722 979596.25 166491.5156 497505.125 1537623.375 4999814 362908.7813 1132736 1068055.25 518512.625 6638034.5 2399779.5 dihydroferulic acid sulfate 473732.0625 134994.9063 100170.6406 59703.4844 25338.7227 612537.625 52753.9063 22852.6406 397661.625 654249.5625 162042.2656 58179.1367 140884.8594 256650 162724.5156 45574.168 56114.7031 404913.6563 182755.5 101125.375 300452.9063 138499.6875 912800 530150.6875 264675.25 63225.8398 199437.375 813492.0625 47546.3359 22293.1426 223544.7813 141966.2188 33476.8086 277242.7813 111327.9922 851750.75 990068.625 50220.8359 1667920.75 647072.375 187260.4219 123669.3516 31293.2637 56978.6563 2640656.75 1510087.375 171920.1094 341972.0938 182755.5 110709.6172 53627.2305 591976 62423.3906 207155.2969 117110.125 950790.375 863069 724832 28823.8047 182755.5 271897.4375 68322.9375 76794.6094 348053.375 60398.0313 154900.9063 2445653.75 43282.0234 42676.7695 1258101 127555.9531 43177.125 88170.9375 111623.5234 189488.4688 367718.5 693559.5 315433.8125 1037017.75 122453.8047 44084.0742 74092.3281 304731.4375 74042.1953 2065433 48373.75 93712.2266 174495.5469 810833.5 1075956.125 205747.6406 847410.5 1196046.875 73659.7344 303279.25 88024.6094 221576.1875 134606.7031 1540109.25 426039.875 1338842.375 36728.2188 44007.0234 2575510 40665.1445 459146.5938 89350.8047 174688.3906 182755.5 125830.1797 1270933.125 352458.0938 397763.125 40201.6719 503397.3125 588598.5625 462386.3438 341160.75 tetradecadienoate (14:2)* 5191050 14237480 6837331.5 3165249.25 1764653.125 4306759.5 2268645 7793311.5 1910522.625 8854834 3304592 12644137 1049442 2856988 1875984.5 6146370.5 2943366.75 5512428 10460797 1034360.625 7984224 14061029 3766996.75 4047508.25 4108684.75 11540034 24362804 11777528 5120960 4568222.5 1476931.375 1530903.625 16943422 4518063.5 4806136 3268527 1342193.375 15722032 1731998.625 4823748 2424296.5 11186630 2189418 1749687.125 14686107 1262384.5 12402182 1131896.875 8315766.5 1040640.375 24953578 56255788 2793132.25 7820203.5 17619794 3340198.25 775971 8405352 3719703 13157828 19634386 15739366 8640778 1348362.75 16232699 4409347 22183904 2172155.5 11057265 6889591 14008463 4210711 8951847 3344434.25 9302538 13980178 9913112 18159726 6685800 10646493 7754880.5 38733276 16547107 18897038 1410482.75 10650388 5297061 15051865 15341312 5620256.5 30263388 4909438.5 10983560 15505748 23470498 14939375 22849850 16774106 7393762.5 3876004.5 8225859 13251405 7385302.5 13844299 10824454 2150947.75 20260370 7318435 4942134 6934239 8430997 13245262 8911555 21740892 8265425 6948562 15393096 6323199.5 34778944 7164959.5 42380844 11858789 5130140 13830899 8016221.5 21206546 5667392 14354114 5123987 16345144 7244995.5 15595306 10333719 14373087 6095703.5 5878496.5 7261436.5 5194481.5 5964712 12824092 6470690 18145284 47965336 14726949 6411862.5 534241.5625 6443136.5 9460240 9782783 14608130 8216176 7473821 16839486 15452627 32027642 6036626.5 56288512 20507156 14239019 5130682 4578872 4941950 11014832 7888275.5 3901959.25 16718844 18624038 11429293 19615604 5794816 12618593 23371738 9942353 52585352 1569571 6264685.5 13812196 21026362 6295074 4413736 33117602 3184774 19324802 3107494.75 18324930 12450969 3383664 7387509 11964394 18433638 12130016 7372618.5 5318813 10880929 24815248 2241228.25 4092013.25 29894932 8019508.5 5907099.5 15375784 8285608 17212316 8477148 3765279.25 5197925.5 4475888 15002115 6437583.5 15571814 2366592.75 12455940 9926619 9717554 3836280.25 3412851.25 14679884 7111463.5 32609162 6576158.5 383816.7188 10198745 9151442 4419381.5 8523064 24081182 15728156 2596716.25 4836138.5 4049140.5 3729003 3198688.5 24032610 38691928 26025042 14818652 22550144 32618690 7041581 21440778 2155361.25 19161436 18802736 6373149 5623438.5 20507196 15434648 41253112 5796494.5 2512203.25 6100163.5 33972356 5273685.5 13691068 17532628 10170698 735921.25 2744332 2022249.375 10094451 13761629 10743491 3962089.5 18159152 14458364 8523064 20454978 4643546 70933504 6809243.5 7397189 9705043 28379464 13031878 16332001 8523064 8250477 4467860 7879143 21434390 6951437.5 3954494 3395483.5 4750654.5 21833030 12988194 15326528 20074982 18202986 22782442 19966726 679200.1875 26828950 4302743 16234733 8304763.5 20378010 11371951 8523064 12335000 N-carbamoylvaline 57590.9531 64933.9141 40243.0234 55884.0586 103939.0781 162535.4375 104279.6875 121016.8203 60029.4531 125396.8438 105394.0469 141217.2031 224310 81522.3281 138373.5 159380.25 148288.3594 141190.4844 213665.7344 139017.9531 208362.1406 117518.5859 132383.9219 183591.4531 224310 86716.7891 93617.3359 697470.25 60770.2227 69341.1094 236397.9844 272059.8438 321410.4063 31818.7129 482503.0625 276228.25 236047.1563 618432.5 173063.3125 515317.0625 122499.5469 270272.5625 126944.3203 66732.375 1889278.875 249144.4688 142081 84071.6719 196588.3125 817153.9375 1038025 441078.5938 288979.3438 300137.1563 55776.418 159153.7031 914048.6875 156079.7656 264826.125 374101.4375 217536.4219 271689.6875 370601.1563 748795.0625 1132351.125 229873.3594 162326.8594 367257.25 99779.3984 444943.0625 147737.7031 120679.5781 339855.1563 369166.375 149592.9844 66842.5469 127939.2578 156650.8281 195505.0938 526652.3125 252273.0469 117603.125 300378.5313 3264470.5 138583.2031 244735.8438 591722.8125 325322.3125 447715.9063 598850.5 687917 151614.4219 278506.9063 194247.4063 5518973 245438.3281 188695.5 106325.0703 160135.9219 114577.0547 147742.7813 1230683.125 165886.0469 348728.8438 1338813 1375320.625 331594.0313 80249.6484 121581.5313 320761.5625 254707.6875 131226.7813 228196.1875 1762737.5 222123.7969 601366.5 214449.0781 157647.7344 55038.3047 112720.625 729061.9375 197082.3125 127243.9688 158735.2656 173741.8281 383242.625 191645.7188 2286885.75 142108.0938 1751637.375 453289.5313 125566.3906 560146.3125 136445.3125 236050.9531 491728.1563 182310.75 567887.125 149473.5313 214989.2656 129236.8984 1665776.125 471642.0938 1107983.875 5311622 153851.0781 315684.25 154571.4219 1279371.625 508363.2188 115590.4531 387976.875 1005112.563 230430.2344 114602.6875 1016830.625 410013.5313 245487.7656 193741.4219 1730008 139192.4531 52489.6484 63202.9023 383035.5938 204731.9063 400731.5 216475.0625 87369.9297 723450.6875 750424.8125 207991.0938 202304.2344 1258340.5 3489317 495982.5625 1149589.375 524828.875 456083.7813 276437.25 387079.9688 280083.9063 170566.3281 1346014.75 261255.0938 3947561 1434082.25 192036.375 583555.9375 631666.25 1742074.5 134734.5313 279994.4375 152309.7969 116820.4453 392405.9063 174269.3438 29199.3555 104631.2422 716644.5 349120.6563 224310 965701.875 1292110.25 115121.9844 193507.4063 142194.0156 937683.25 211323.8438 29416.7676 56658.0703 29797.8633 327640.8125 405698.4063 212572.8438 571208.25 456923.75 99503.5234 886043.5 133264.5938 87043 476682.2813 218746.6563 1452833.375 371559.875 161940.0156 1787455.5 1854272.25 8-methoxykynurenate 82051.0469 159885.7031 39778.793 101038.1797 65243.793 76052.8516 149026.8906 41589.9023 215991.5938 47120.6992 103011.5391 77018.1016 31063.0762 34693.0156 46503.0977 46878.3633 95414.2266 52938.832 65317.4297 92006.1797 153462.6719 95463.1016 86280.2422 48352.7969 128266.6094 125547.8906 78905.8672 68515.8125 103953.2109 97526.4922 86852.1641 75524.5234 205641.5 38576.8438 169511 83144.7031 100986.0938 62671.4063 74467.0156 24535.6484 3849899.25 1385803.25 41772.1641 326448.625 1141479 1105111.125 104412.9141 5767493.5 350086.9375 1537053.25 23533.416 2226001.25 56767.8945 1920651 156946.2969 635582.9375 36566.2695 80056.0078 60453.3125 2732497.5 594809 95375.3672 335924.7813 40581.6953 3603848.5 1502660.875 1988855.875 1477653.125 579176.75 541449.875 136974.4688 74814.5781 35843.3477 85217.6797 38791.2656 1049642.375 627855.75 476175.4063 705863.625 4490225.5 3633501.5 2263864.25 264211.5313 855377.25 2809890 173328.0625 63530.0703 179569.5156 136051.1406 39041.7852 169511 1028445.625 169219.5781 123410.7734 94417.2734 59333.6602 122945.5234 11069251 216580.5781 42672.7461 222038.7656 2740856.75 810192.1875 731380.5625 67075.1406 83758.5469 244084.2656 166609.0938 16245097 121869.8359 2833821 170841.5469 5233990.5 49866.1406 185447.5938 168180.4531 124287.2344 2496997.75 30047.8672 72557.3516 566659.0625 422057.4688 91749.0156 1236626.75 242376.2969 170239.2656 3107086.75 298845.9688 522561.25 15006947 353113.8438 454873.4688 461387.0313 123933.2031 29981.3555 32963.6719 300832.8125 300105.0625 161304.7031 224649.3281 274880.7188 69733.5469 55443.2305 57239.8555 168301.0156 68709.125 7865117.5 314177.25 48171.9531 57817.7109 319459.625 167175.2813 118537.1094 80637.3672 525406.125 2306972.5 326318.4375 67920.3828 592638 62537.6953 120780.3125 1891741.5 472359.0938 556983.5 130164.5469 2986917.5 23355.127 3589966.25 839246.4375 15456722 4375337.5 1699301.75 144175.7656 48462.4297 37559.5547 28010.2227 357834 281653.8438 675971.375 84585.1953 231148.2969 1185379.375 130692.25 263618.4375 181358.0938 3231914.25 199830.9063 572333.75 168592.5313 146479.9531 1740997.375 426257.6875 105164.75 169511 75604.6484 113701.9609 223633.9063 111338.9219 521079.3125 86688.7422 86649.4141 1651955.625 3298358 40437.5625 237740.9844 1191201.375 1589465.625 249963.8438 239083.4688 135676.4063 96606.3125 21152.4414 82612.8281 207177.6406 676647.25 125965.0234 2611706.5 610365.5 4934341 1739769.25 181332.2656 27829024 81954.3438 25913564 92159.3516 99875.1406 1360260.125 72976.8359 47377.0117 4287637 195089.2813 84535.6563 273111.5 476910.625 1399611.375 44394.6914 665371.5 168782.7344 1150218 81393.9453 52071.6133 363621.125 34397.6055 127375.1328 96625.9531 76101.2422 57867.1602 5450602.5 405802.1875 483639.1875 3185521.75 34990.043 821233.25 70167.2344 154141.5313 262705.3438 197692.625 1411277.125 88852.8281 195180.1719 48945.4414 12342621 1115859.875 3-indoleglyoxylic acid 219726.8281 174365.9219 296101.5938 203738.0781 221864.1875 283382.0938 143299.6719 200393.4688 263973.5625 328907.1563 155467.5781 420695.75 88439.3281 257172.4688 315649.7188 203723.7031 109894.8594 297096.2188 343283.0938 220134.4375 298951.4063 332076.4063 181619.9688 346868.25 206595.4375 162369.6719 136598.9375 196656.1563 281117.3125 201134.7188 324679 263060.4063 328887.5313 355785.0938 151444.5625 149653.1406 323048.625 213446.3438 228190.0469 327458.3125 189052 208035.6094 284112.625 224013.4688 65492.6445 167991.5313 155015.8438 155925.875 563936.125 109153.4688 159833.0625 320709.25 49818.1211 119387.3438 425385.4375 90321.6016 56942.6484 113894.5 154573.0938 150454.5469 608966.6875 201947.4688 226451.9844 218719.25 56615.7188 276881.6875 61554.3672 169780.0313 105652.0156 408104.2188 457289.2813 37413.6016 102882.4141 128211.5781 214767.6094 88850.2734 55666.8203 68575.8828 117998.625 73817.5234 170836.875 344348.125 166343.6563 440611.8125 634462.75 141265.7813 89387.3203 170981.125 161130.1406 123304.6797 130276.3047 80588.6563 193866.375 93693.6641 258385.375 191032.3438 174331.3125 211271.375 384720.9375 362948.7813 65491.4922 68613.9844 160377.1875 141051.7031 182980.2969 181644.9375 246724.5625 451398.0938 383361.9688 78808.7813 548686.875 218899.7969 277967.5938 495108.375 190789.25 2289106 126265.6016 195018.3594 118037.1094 283920.4688 165422.7969 79797.1094 529669.1875 60017.7539 59094 81363.8203 189052 65616.7031 230296.8281 129576.1641 348827.2813 549632.25 225880.125 191200.1406 141809.5625 215911.1875 215760.375 52139.1367 93447.1406 113556.2266 332052.8438 48204.7773 263573.0938 167232.2344 84807.9688 93894.0391 273971.0313 57685.6172 611211.1875 161386.7656 128483.4688 147561.6719 107362.6953 157788.2656 140919.875 811781.125 189052 122739.5859 197913.2031 164083.2188 356118.1875 109436.1719 47483.707 168066.9375 278653.875 102089.0078 718268.1875 532388.375 72756.8047 745054.6875 140754 103453.0078 143370.9688 310209.625 609799.6875 342991 155419.3438 109102.5 288860.8438 54284.5234 137727.3438 188104.2031 557584.0625 157109.6875 76820.0234 473277.0313 124483.3203 171410.2656 201203.2813 260288.5156 248063.2344 117848.375 145409.875 69185.5 187314.7656 445002.5 205746.4844 142993.0469 147748.0781 177680.75 183236.8281 430214.3438 753209.9375 183240.9375 308579.6563 957264.5 229163.25 235392.8906 131490.5313 150340.4063 101224 112475.7734 278427.5313 83621.3359 132174.2188 1444625.125 630483 172269.9844 2163816.5 3121053.75 114301.9688 50462.0938 367009.4375 299466.2188 996482.0625 71561.3828 84783.4219 465198 213932.1094 532758.4375 350367.4688 247486.25 68666.2422 38856.8398 218983.0625 716386.5625 436053.0313 290487.375 296567.9063 51752.875 104693.7266 1259425.75 212963.9688 298401.375 167174.625 351360.5625 391871.25 3143407 97883.7969 98318.1094 163734.0625 79972.9453 3588654 "2,2'-Methylenebis(6-tert-butyl-p-cresol)" 1710209.875 226161.6406 849403.5 2697324.25 715293.6875 1677634.5 2532518.75 961424.875 2112957 2348660.5 5854595.5 2793264 1797051.75 475790.0938 3587990.5 1325235.5 1494558 4741972 1230221.875 5602617 873021.25 2749159 503045.625 1672073.25 903708.9375 941746.5625 961286.125 1675711.5 583756.625 629061.125 352222.4688 1420792.625 701360.5625 981039.6875 1803046.75 137885.6094 2425243 706620.0625 508340.9375 513397.8125 418798.125 458491.9688 219233.5313 366110.5625 1050997.75 1209776.625 509880.2813 841350.1875 816000.9375 306216.4375 369939.7813 231803.7969 144559.875 193667.7813 184206.7344 191184.4375 271956 242911.8281 199892.6406 288940.3125 214027.4844 131246.9688 151269.4375 336631.2188 205664.7656 170059.1719 204994.1719 638660.1875 136975.3438 776890.6875 215825.0469 155601.0469 142574.9375 265513.75 135872.875 494951.3125 149313.3281 933768.6875 152993.8906 115262.7344 795870.125 341106.9375 223331.5313 156323.1094 173776.0625 264532.4688 198667.6875 184871.0469 297039.5938 223191 237874.4531 370880.9063 556454.625 556934.375 107959.7734 108592.1797 196760.7813 198154 153485.75 148630.0469 151494.0469 179819.0625 155700.3906 208231.3125 119580.5469 246895.3438 147556.6406 152858.2031 98776.5469 255453.4063 396974.3438 120076.8359 327859.5 273779.625 126100.0781 86693 282691.5938 113251.4688 125798.8281 134914.1094 104518.7891 367565.9688 155652.625 225164.875 287110.75 147824.2969 253767.9219 251074.3906 83427.1641 373250.0938 182798.4531 236606.4531 166483.5938 193263.0313 299222.3125 323048.6563 369621.9063 259982.2188 493701.9375 261028.125 223191 129138.8984 320208.1563 288940.5 237466.5 256693.4531 62734.4766 275610.8125 428699.125 195048.0313 227664.3125 143121.25 124991.5469 298289.9063 82825.1953 187779.7344 244774.3281 273294.7188 238804.7031 97091.75 205216.5938 120642.0781 251159.4219 50291.7109 87873.6172 74874.3906 71218.6172 230888.9375 154756.9219 65296.7227 199957.7031 179881.1406 363363.5938 68166.2891 79005.3203 180144.4531 314900.1563 418573.1875 211719.125 259491.6875 197033.2969 169678.0469 257292.8281 36511.5039 221018.125 281845.1563 169278.3438 214976.0781 376645.5313 223191 150640.9063 180334.6563 180300.2188 78711.4297 276121.0625 246784.5781 81748.8281 87521.5391 813245.4375 157588.1406 110903.7344 163303.8125 130612.5234 103075.3438 221217.1406 270008.4375 202626.125 210837.75 142469.3125 235280.9375 88250.3047 66907.1797 161637.3125 176185.4531 181732.5313 225933.9063 193575.2813 479577.0938 219632.1875 135700.8438 175288.0313 317001.375 116337.9531 145586.5313 247392.5156 176718.4219 124705.1172 47578.7852 301435.4688 190019.9688 151115.3125 223540.1094 147101.1094 135158.0781 221289.6406 49474.9219 540398.3125 115671.3438 192792.8594 190268.0781 253084.8281 239780.5625 199485.125 218906.5156 124746.7578 184578 118414.6406 226296.7188 111033.7031 222841.9063 137267.625 231292.2813 110469.5859 315053.5625 263766.7813 262625.5625 249686.6563 251930.3438 125556.7266 380290.75 92564.7344 ethyl beta-glucopyranoside 68029.1016 249683.3594 217550.4219 113570.9141 554410.9375 197604.5313 499768.3438 536013.6875 104460.0469 111303.0703 135343.4219 94051.8438 118338.8984 148313.9844 173628.4375 82066.1641 375188.5 295142.1563 695253.875 538152.1875 535590.25 119596.3047 246469.625 346686.9375 77738.8906 453373.75 56198.1523 875725.25 2356003.75 157011.9688 704464.3125 308580.75 1685070.875 5084669 101605.0156 640766.375 546198.375 865915.625 111842.4688 128978.6484 371261.7813 666617.625 5080166.5 435859.9375 71882.4609 135402.7656 330422 1583254.25 117183.7656 577254.9375 14349183 70825.2656 106316.9141 1094371.625 105501.4219 330670.8125 1067377.625 98786.3672 10126077 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98664.4609 148448.6875 67222.3672 261221.9219 165524.4375 102518.8984 717936.9375 454857.9375 654626.6875 105964.8516 482701.3438 69552.4922 105844.6016 786188.75 542938.4375 54517.8086 48943.8828 928455.5625 2495649 109980.0625 2020369.75 314959.7188 423208.5 73065176 1510071.5 5682480 412836.3438 203740.0781 9390148 406348.7188 695217.625 1974618.125 930357.25 479227.25 110907.0234 504975.4688 214962.5 2872823 64208.3633 433580.6563 254790.2813 34324840 89621.1875 423208.5 117056.4844 2077534.125 312188.5625 256072.5 104019.6563 686009.25 2262559.25 92163.3906 220311.0469 277610.6875 36578.3242 110585.4922 528634.4375 892880.1875 272368.0938 14284574 303478.5 391559.0625 2762838 1157633 321726.0938 108821.2656 1039288.813 832697.375 1294690.25 48237.1484 467136.6563 681447.75 41570844 97933.7188 178416.5625 12193701 36512124 683664.9375 20998362 2036363.625 159543.7813 71232.0391 931656.25 161986.3125 76164.7656 821316.625 15097330 2141495.5 29054846 1321691.5 7651917 19699916 1574510.5 6-bromotryptophan 226513.0781 319228.4063 452808.9375 388416.0938 390817.75 387269.5313 670829.625 546917.875 750205.6875 567196.1875 310226.9688 356739.9063 710011.875 350698.25 582608.75 576624.6875 723704.3125 608573.375 768198.375 664099.75 740012.1875 456486.0625 414535.3125 784407.6875 443418.9375 971363.125 1090562 441853.7813 424451.5938 532734.0625 1115305.125 460567.3438 603563.4375 558247.4375 406601 460634.0938 702995.375 821679.875 403768.0313 454065.3125 334038.4688 261810.2344 308457.7188 440695.875 603982.1875 357477.5625 438786.6875 748153 155419.7656 430314.75 39569.8906 179792.875 34061.1758 174796.2969 202382.625 133651.5156 169914.2969 58480.6094 53554.9922 459182.5 157181.4375 74311.8359 70022.2734 172713.5 39518.375 215694.4531 164124.7656 70548.3281 55224.3555 53291.918 28395.3965 418352.7188 177990.0781 39444.75 169421.6406 50303.0977 259284.7188 119785.4375 264770.4375 104793.3125 207866.5469 182499.4531 81302.1094 42340.7344 60376.0977 331890.3125 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32447.4922 54193.2109 35996.4063 70835.1875 56088.2734 44523 149519.2813 130696.4141 32337.5273 22207.873 43514.6133 30524.0586 84850.1563 44523 1-carboxyethylphenylalanine 1659716.125 906743.9375 368976.6875 1675702.875 858948.1875 2593086.75 690244.625 549257.3125 767786.5625 1657147.625 538750.5625 904556.4375 735979.5 636843.75 593911.625 2052217.25 427437.25 1643138.625 480757.8438 814424.3125 196102.8594 439948.0313 1476478.25 1029479.5 980985.25 416817.5938 653695.375 348720 2047104.75 989766.625 1185426.875 692889.25 616243.125 748944.375 2025562.5 393752.9063 1087451.375 1252021.625 861503.3125 471860.1875 554889.3125 573111.9375 404631.8125 560947 1729761.125 632840.375 866800.5 571234.6875 523536.375 1125672.125 6971228 60100132 2193579.25 1565614.5 52975336 9429203 485635.0625 652451.1875 577327.375 14429715 10153900 10223370 14672110 1184147.875 21997314 675303.25 10425457 666266.375 3089151.75 2214909 19207704 437163.4375 823898.375 1284887.125 11336082 2338484.5 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266314.8438 1019935.875 1642711.125 658826.1875 409226.4688 7552697.5 391718.6875 6845163 1778420.5 978292.8125 591923.5625 1882093.5 637427.5 211204.1875 773625.75 618838.5 883760.8125 473759.875 1260258.125 283382.5 2332726.75 2536303.75 873103.3125 846862.875 129505 1480404 851448.5 612646.1875 967386.875 2942198.75 7362916 1219658.125 232104.6875 323224.6563 7809884.5 654680.4375 149001.7031 2783295.5 678361.75 589476.3125 307105.7813 324017.7813 3213045.5 363758.0313 2106334.5 498189.5625 2840884.75 367479.9375 879514.4375 302766.5 666013.125 1018553.5 286646.8438 559102.875 475973.125 302237.5 441073.3125 2640801 2319853.25 2028448.5 383391 2996562 874005.125 187219.9375 1330794.75 869276.25 624916 517219.3438 1180645 1346432 274070.0938 1081201.875 1589256.875 1-carboxyethylleucine 532026.9375 378304.6563 125359.6484 546283.125 226931.625 1059404.5 287154 216467.7344 246945.2969 535851.6875 208488.0938 367372.875 219278.625 140033.3906 233702.0938 761458.625 85416.5391 713686.25 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371617.6563 870987.9375 1196033.875 1165597.375 255308.4844 1448611.5 567736 78561.2422 442738.8438 363760.7188 301429.0625 279095.7813 615124.25 984057.5 218457.9219 399513.5 609355.625 1-carboxyethylisoleucine 487675.7813 296137.125 99722.7969 435015.875 172508.5156 745883.625 211869.625 164887.2656 181811.7188 415478.9375 209596.8438 310267.1563 227402.7188 261983.8281 203897.0156 886848.125 143283.7188 592148.0625 83956.4766 256480.5156 25547.1406 154765.4063 460449.1563 335407.6563 333782.5313 115622.3906 131850.0313 93374.5781 460648.125 292460.0625 266411.3125 142428.625 134817.2969 181898.5625 514440.4688 93176.6328 366387.5313 427259.25 182835.9531 197377.125 146486.1875 361612.875 108196.6641 179282.6719 536229 212175.7188 134085.4688 130801.3047 329331.8125 358107.1875 476864.125 2484322.25 196991.375 184129.9688 1672548.125 442948.5 60357.0898 85465.6797 106961.5391 554308.6875 807771.8125 438541.875 935924.75 53228.0898 562647.5625 86384.3594 843301.0625 90145.5 382261 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133828.5156 75036.1641 83781.8906 589135.9375 112448.6172 291224.8125 351670.1875 255692.4375 117019.4219 441733.9375 128758.1016 219545.125 70044.7344 3423781.25 173905.6094 312433.4063 100048.5469 346093.4688 339685.9688 269390 189173.0313 292088.9063 126740.5859 302461.9688 562397.25 106097.2656 236719.6563 123721.4063 2322650.5 616475.125 169266.2813 398445.9688 1068307 186754.875 255335 118111.9219 753056.8125 431804.3438 70721.3594 301360.875 47135.5156 3798755.5 1015910.75 77559.9531 206330.2813 203176.1719 174646.1875 413997.4375 345950.1563 883682.0625 138042.4531 140841.3906 247598.3281 362655.0313 113462.1328 113542.0703 1158445.125 943879 1404165 206354.2188 295595.75 333613.4688 2272971.25 106687.2891 53408.6367 56213.332 335989.25 196693.0781 299047.4688 154902.2344 3698090.5 113089.4453 3043662 437492.125 257716.9844 249249.1719 511809.125 155383.5313 51028.7422 363124.3125 222043.1406 238537.3125 210897.7813 302610.2813 79286.2656 682335.375 1159863.375 327436.2188 162798.5469 42543.7383 216305.8438 289762.4063 382280.1875 962474.375 1424727.875 307145.0313 108972.2188 121450.3281 2875583.5 189999.1406 36052.5352 518933.625 177510.75 214549.5469 89262.4219 111982.0469 904920.1875 159402.375 714117.875 223666.75 996409.375 95503.7188 268611.125 50757.9844 255335 412987.875 111214.1563 190211.9688 189264.9844 72701.6328 194981.4375 280762.2188 679445.375 623037.375 124835.8203 255335 265138.0313 50559.457 465281.3438 125582.3125 233697.1563 169986.5313 413747.375 339651.9063 81445.7813 257802.1094 314492.7813 dodecadienoate (12:2)* 1559963 3157277.75 2413592 1233585.875 390485.0938 1022763.563 764414.1875 3189668.25 645368.3125 4932341 1342652.125 4341094 968800.25 584292.8125 1189700.125 1556517.625 1547804.625 1381065.25 3382020.75 654606.875 2339711.25 4356367.5 2145073.25 2263764.25 804449.625 2962830.75 5944387.5 3678617.75 1184742.875 1530815.375 528086.1875 237205.1719 4990698.5 1539941.125 1430242.875 1836573.75 976596.0625 3847219.25 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2228298 1624350 1407949.125 2614942.25 1956250.75 1320267.875 1176138.5 1568061.75 1400387.25 2203567 4891103 1655627 1268664.125 889521.8125 1497570.25 1592050.625 1278693.875 2128925.5 1849825.125 1605207.625 3755426.25 1686600.25 2108118.25 1424859.875 3663121 1794259.875 2395040.25 2199774.25 895515.5 1065963.125 1318761.25 2387390 970727.1875 2572345.5 1078057.5 2148452 2194363.5 3553893 3792040.25 3113315.5 966062.9375 4494934 532172.875 1514795.375 2553857.25 1958106.625 2600694.25 1089468.75 3787875.5 696525.1875 2326860 457750.8438 3537887.5 1516052.625 1268891.875 1743788.875 934867.0625 3099093.25 2502065.75 1314467.625 1627898.625 866257.375 4364156 416223.5938 1240191.875 3774861.75 1204863 1906456 1198727.375 2121070 2333368.25 5022162 615296.25 1601917.125 2445940.25 1845207.375 795432.125 4674763 721271.375 1523072.625 2615894.25 1643252.25 1072931.75 906461.5 2093325.375 1945599.5 4589754.5 1111330 136994.9531 2108768 2398494.75 1040883.375 1336599.625 3475208 1755763.875 430561.5625 321123.5313 547891.75 668206.625 518716 3291548.75 4341689 1668141.5 1930983.875 3396811 6093414.5 512232.9063 4655901 929991.6875 3492395.25 532259.3125 1740430 1030918.625 3473060.5 2092249.375 3553769.75 1607486.125 527082.9375 1512297.375 3049188 980857.6875 1912462.75 2302796.25 1832452 839359.125 1518180.75 951088.9375 783613.4375 1666334.75 1977719 3112698.25 2323258.75 1768834 4129939.75 815177.875 9156847 1156914.875 925334.6875 2142219.75 2531776 2369434 1565903.75 2926884 3313570.5 1698399 2085162.5 3264817.25 2234590.5 1498384.875 846127.75 677072.5625 1716663.625 1474804.5 1804327.875 2461038.5 1680478.25 2647308 4012061 952407 2262841 2516579 1740430 2383733.5 2192165.5 1217516.25 1193336.25 gamma-CEHC sulfate 20161.2227 80285.5547 22266.1465 32610.6836 29973.1113 20985.4199 33272.75 39469.9844 111235.9453 53283.1836 111734.1563 101291.9922 47542.0781 19206.8438 114642.4297 74182 246611.6875 131556.75 137271.9688 101581.5625 56066.4727 228349.2188 194421.9219 83975.4922 99461.6563 68382.0781 42977.1133 35990.2773 94906.6484 37844.2422 79981.9219 334921.3438 30227.0176 153903.9844 65443.5391 99399.625 1297287.625 69999.8906 15231.9297 381286.625 42838.6875 46813.6328 832206.25 45602.043 144517.625 101415.5469 51914.4531 142731.9375 82131 66233 120449.2109 191704.4531 67053.9609 20993.7109 71887.6641 47900.2227 246479.5938 57487.3867 22485.4004 277867.5313 193793.5156 44500.2695 47264.5156 74182 114724.2891 108046.7031 82115.2656 77733.125 143023.8281 17191.0098 45170.5078 74182 32745.0801 glucuronide of piperine metabolite C17H21NO3 (3)* 2186348.75 1210925.625 188589.0469 229019.1094 98761.8594 148977.9844 129037.6797 629912.5 507311.625 611495.0625 117438.4922 164915.7813 66338.1094 778490.5 281138.6875 105879.5078 47596.9063 1206430.5 329046.25 28783.8672 201432.3438 186203.1406 348758.8438 84157.6328 457612.9063 190381.6563 41527.7266 116993.8906 418081.0313 72990.3281 580102.25 52168.4102 1375687.375 249483.4531 138832.5156 52886.875 331172.5 108978.3984 118917 56803.1328 109339 83417.2734 245284.2813 529240.8125 56966.9922 81419.125 128162.3281 80587.0781 118917 116112.5703 218702.0313 103777.2188 157856.2656 66741.7578 134188.7969 68358.8906 21493.6719 162071.3906 47032.1055 79635.3984 98762.8672 74438.9063 60024.7891 31118.375 51406.1484 77659.9531 37808.2188 71160.2813 103645.2031 92016.2266 99001.4922 205110.6719 280684 89312.7578 94420.3047 120840.1172 100788.2344 107796.2109 204704.5469 1791966.125 177179.2969 92767.0703 144721.8594 282558.4375 193962.5469 168856.9375 glucuronide of piperine metabolite C17H21NO3 (4)* 3009902 2261513.75 344868.0938 449952.0938 128930.2422 240862.8906 196365.9375 957000.0625 784502.9375 963223.5 167311.9688 299372.3125 96296.8516 1080447.75 513691.2188 130990.1016 77203.4375 1746513.625 314144.125 53058.8984 264694.4688 766373.125 1394891 188583.0625 135268.875 2669054 756033 70249.7578 439626.3438 121886.1719 849295.1875 2503780.5 384074.5313 36744.8281 846034.5 88877.9141 1894500 619255.1875 25549.2871 208757.7656 77528.125 317162.4063 144384.25 193118 100570.4531 197499.5313 135551.875 49577.8516 505015.5938 1618473.25 89666.7969 137638.7344 248367.1094 132235.8125 269641.3125 193118 320284.25 199312.5156 42386.3438 184661.1719 116736.0234 159346.9688 69669.2422 38598.8359 412130.4063 219725.5313 151393.0938 177478.2344 429285.3125 304122.5313 81227.7734 80900.1172 53645.5195 147120.6563 193118 152850.5938 200731.2813 375207.5 124135.75 40388.5625 82536.5859 69783.5078 351145.0938 220725.9531 42276.5117 112870.4531 147810.5781 99991.6875 34968.8125 163073.2188 244455 487262.0313 100115.5391 251163.5469 145923.2813 407637.6563 518672.0625 95115.125 110439.3203 27143.5391 121445.625 554214.0625 156871.5469 72971.5781 151392.1875 166778.375 1354040.625 2772426 109554.5234 269051.9688 398289.625 229152.125 226889.0313 glucuronide of piperine metabolite C17H21NO3 (5)* 3907697.25 2485465.5 396449.6563 460541.6563 154738.5938 175328.7344 192081.875 822689.375 748798.5 703543.4375 204889.5 220422.6719 85854.4375 1162284.375 328746.4688 109220.6953 60828.3047 2676450.5 580942.3125 383824.0938 303902.4375 542954.8125 83202.5469 828429.4375 315111.2188 151380.9375 228501.625 595343.0625 114786.2109 148888.1406 1446572.25 122624.4375 3205489 389648.1875 328921.9375 70717.1875 793909.375 192989.9844 204889.5 98696.2109 114748.8047 112876.3594 337953.0313 1385361.75 113189.2422 71971.7734 217276.8125 326607.5 153983.8438 310001.8125 173785.6563 282677.25 141726.7656 111719.75 63180.5352 36355.7383 69856.6172 96455.1094 170868.8906 195935.9844 84941.5078 59218.1211 89521.75 405261.75 182945.4375 114734.8828 251928.0625 105304.0313 168122.6875 238910.0938 283751.375 281432.5625 174622.8438 33764.9531 268052.25 213843.0156 325395.2188 168049.7969 174727.7031 339440.9375 46418.3281 3056310.5 127487.9141 189008.4844 417518.3125 318939.4063 439285.625 55204.7773 sulfate of piperine metabolite C16H19NO3 (2)* 9028490 8306976 1035621.313 2309685.5 46978.6211 936668.4375 454883 574508.875 6032802.5 758808.8125 4858901 357061.6563 442729.3438 240994.5625 835232.5 322946.7813 494376.7813 1351431.125 724367.3125 118296.1797 466615.4688 304571.8125 10651322 1148525.25 142621.3125 1180102.75 986641.625 1404158.5 930301.5 71009.1406 1546258.375 2308883.75 201691.5625 359792.5625 271362.1875 1438345.625 2615171.5 700463.25 118699.0781 912411.4375 1202854.875 2843595.25 565328.9375 503503.3125 2669496 214143.125 535817.5625 46350.6328 562142.1875 134947.0781 1006282.625 376460.6563 323986.3125 292182.3438 114373.1953 299857.4063 168402.2188 81777.8594 104927.7656 681117.375 130325.7031 597248.4375 365266.8438 77017.9063 46479.1289 2636414.25 96424.4844 330785.7188 182827.75 403591.625 518199.7813 43707.7813 38720.5664 272919 246135.4063 1411802.625 650263.25 43647.75 311911.2188 48783.5 593529.875 185561.4531 302729.3125 63075.7773 246705.8906 357496.6875 39555.5234 276168.5313 80808.0703 328334.75 266138.5938 44995.5156 317429 855276.875 231878.8594 83667.6875 209335.25 34258.1641 712254.5 351497.4375 65502.5 737026.125 477134.125 269164.2813 440515.2188 133859.125 239382.5781 347432.875 230390.9219 169508.75 300635.5 880110.875 325857.5 151140.3438 161263.2969 496278.3125 124489.5391 137517.2969 886220.75 817220.5625 74245.4609 204155.1406 72213.2422 1543261.75 167206.8438 332128.7188 607867.1875 39015.5781 317429 168352.4219 35033.5742 88506.1875 79989.6797 154350.2969 1280038.25 165820.5313 58410.9609 86827.2266 59930.0742 140272.5938 3660946 317429 318111.5625 37136.5 87947.3906 574720.5 193529.5781 176788.5469 1022050.875 70560.7656 534943.4375 sulfate of piperine metabolite C16H19NO3 (3)* 3565531.75 3922956.5 463391.4375 879847.875 504126.9063 192323.1719 295473.1563 2943697.25 359656.9063 2334694.25 156286.8125 236002.8125 116024.5156 431663.0625 155573.1875 217220.6094 678808.75 331569.25 34036.4688 218794.6875 101767.7656 4768332 574763 49578.75 518347.2188 450375.375 688892.75 432095.1563 40394.7422 772999.0625 1399252.375 97515.8516 216150.0469 170509.9375 679532.5625 1479140.625 442172.625 42522.2852 321676.5 385125.375 1012891.25 221263.8906 135455.9844 841498.6875 76094.0156 307752.7813 33467.8438 174815 50551.7539 470118.6563 151896.7813 141318.9844 81060.0469 92362.3672 174815 55759.3125 319284 74904.7031 307187.6875 225452.2031 30721.9004 1486959 52158.9063 157306.8281 72418.2891 199546.5156 240274.7656 137346.0156 97522.2656 815019.25 400172.75 202878.6875 29928.9902 347205.25 75406.8828 109397.1328 101566.2266 174815 115081.1797 229394.0469 123439.4297 24109.3418 29960.2949 101604.8438 489055 123894.6797 66724.8594 120479.5234 25525.4648 446606.625 229164.75 65942.8906 486420.125 292987.6563 155288.7344 367287 104998.7734 140830.1875 208232.0313 129891.7813 47716.9258 109987.1016 340481.8125 147983.75 62074.2188 50284.3047 271937.4688 69442.0313 84995.8516 403254.4688 290322.1563 117761.5156 34790.7305 991041.6875 86602.5938 140398.8594 318049.4688 179120.0625 81367.4219 34237.1445 77621.2656 797370.5625 63320.332 93772.4766 1679039 97537.3203 101859.2031 220594.875 96882.0625 119588.6953 521589.8125 31243.5938 238627.9531 sulfate of piperine metabolite C18H21NO3 (1)* 690181.5625 517041.0313 78911.4063 224954.3906 80108.4609 54882.9883 302940.9375 721599.125 122659.7188 838764 68204.375 187142.3281 170890.9531 86127.625 289592.75 408920.625 166647.2813 153076.8594 247742.4063 972252.125 101042.9375 234869.0625 101180.0703 357747.5313 207135.9688 602644.25 709229.5625 53186.4063 269633.3438 40126.8711 324066.8438 461412.6875 146503.3125 150179.3438 416580.5313 1070052.625 167956 114609.3281 1191459 48971.8984 250404.0625 169264.7188 30953.9121 78539.2109 70428.9063 1564715.875 77142.1797 87619.8984 864367.875 289532.2188 828186 155443.2656 32710.7422 54991.1953 100478.8594 35302.8906 425556.6563 197662.3906 263070 86579.1484 278555.5938 117273.3203 30802.2656 189408.6875 109314.7891 39145.7539 110957.625 89225.2969 408847.2188 42619.2461 239779.3594 82989.8906 288931.0938 1218411.5 32181.2715 56431.8281 31607.4316 70178.8828 136599.2188 36706.7344 1227092.25 24007.8691 287297.7188 192853.4688 171480.3125 89183.9063 370614.3125 sulfate of piperine metabolite C18H21NO3 (3)* 548604.5 486634.0625 72072.6875 128492 72707.5469 60533.3789 237567.4063 554916.4375 118596.2266 843541.75 35666.3203 190651.4375 214455.9531 62780.9023 203453.3594 268931.0938 138339.6719 132716.4844 134676.5313 1029972.25 128492 23065.5352 342684.9688 112477.875 240041.6094 196739.2656 385126.4063 509380.9063 21803.7441 195028.1563 55297.4844 169208.4531 309778.4688 123400.0938 96115.6016 200945.3125 520003.3125 128492 71533.6953 509225.0625 21497.0859 102739.375 163352.125 24482.2656 68298.0469 77208.3359 1269060.625 47281.0781 67916.5313 542120 115047.8516 319850.1875 118327.3047 30881.6016 46245.3672 62079.4141 271815.9375 112318.1406 156451.5469 58448.4727 131802.7344 83657.1172 128492 88728.6875 82646.0859 92784.6875 612400.6875 156217.9688 214638.5625 673235 49003.8867 37149.7266 47323.0117 65115.1211 83584.0313 31371.3203 744158.0625 211166.3438 192057.2344 124267.5078 128264.1953 402854.5938 2-naphthol sulfate 1332973.125 2362576.25 737432.625 538800.9375 265206 2371234 253498.3594 1031647.375 558476.1875 2866922.25 920364.9375 277136.3438 295091.0938 440381.75 302699.2813 670494.8125 342072.5625 410632.5313 131954.75 721514.4375 281897 303210.9688 384751.6875 431832.125 1844840.75 649391.125 515449.3438 1300662.625 433902.6563 3772067.75 182917.0781 1907274.125 249886.8594 315617.8125 1447792.875 247382.0938 414608.9375 267280.0313 555697.875 157108.8281 2474940.75 50251.2813 299222.2813 400419.9688 136229.625 1277440.125 148053.3438 1023568.438 206571.5156 530769.5 663099.375 142002.1563 965772.0625 538738.625 410213.2188 106196.8281 151887.2813 72216.1875 27814.4004 2315912 163757.7031 38421.4492 313410.5938 93852.625 282496.375 554706.1875 35491.4961 521734.9688 228886.0625 88402.4531 49869.8711 206350.5625 122207.9922 40064.9453 85670.375 938898.6875 483266.9375 237425.8281 382251.125 240729.5938 111334.2344 112089.5078 43215.0977 229914 17928.4297 62887.6602 30640.8398 31745.1211 61429.8281 147306.5313 168099.7344 436591.75 1135511.625 237085.0156 53246.332 315344.4375 55236.7656 84780.5938 287836.4688 279888.4063 401149.3438 80134.4375 163062.75 22218.3125 1151844.875 203648.4688 470471.8125 64387.3008 99024.4531 282951.2813 21603.0039 241097.6875 44222.1328 122945.0859 70253.1641 273626.25 467584.3125 289573.3438 445403.2813 201545.3438 2541121.25 749183.1875 464360.5313 50313.3984 109864.5859 269221.6875 226351.4063 172044.75 369472.8438 60289 334216.4375 6857049.5 119804.1172 259970.5781 261190.3281 105615.7969 277900.5 138997.8281 75130.5078 1301013 79014.1172 174479.75 197619.4531 26216.2852 32064.1973 1803663.375 166480.4219 193951.1875 111375.8359 180500.1563 259127.0625 491114.75 43355.4531 356743.4688 128665.1172 238393.5313 139470.6875 127562.6484 136632.4531 112911.5156 427913.625 191842.6406 395227.4063 428856.5625 255215.2188 56044.3945 263131.9375 1777318.625 981475.8125 139368.2344 67519.6406 937261 401319.9375 2429376.25 193550.7969 367040.5625 101504.2266 57376.2227 673256.1875 59515.0898 145081.2969 2035464 611602.1875 190311.125 405168.0313 112075.2031 238830.8125 205817.4063 55377.4375 21197.418 53777.1055 1576561.25 39714.7461 134931.6094 338811.9063 74372.8516 277559.875 335279.125 88439.9766 100538.2813 904451.4375 71532.8906 36219.0469 3557054 89007.625 4435960.5 435379.7813 243037.4688 95524.8047 282828.4688 211150.3125 1071436.875 104272.2891 325550.1875 205861.2813 57984.3906 1425747 349132.1875 1257420 160464.2031 301828.125 1664867 322209.0313 1937365.625 736059.8125 106324.5078 725622.875 309021.9688 832495.125 401862.5 256785.75 571426.75 362266.8125 389053.1563 270170.2188 314369.5313 666728.9375 1041630.625 88639.6563 346873.9375 435720.5938 88602.0156 300966.6875 1340168.875 252852.0938 261224.1094 614737.8125 379960.7813 42445.2852 241038.6094 390810 277435.3438 167412.9219 3884259 123809.7031 193894.7813 48253.1836 1039570.188 310696.4375 69276.1016 95788.3125 323202.75 26232.457 80574.4063 1051538.125 120405.4375 1345938.375 148243.2969 137186.8438 75256.4453 1163823 978289.1875 452649.7188 474408.4688 196199.8125 68199.6406 86505.8672 632639.75 1187226.25 "(2,4 or 2,5)-dimethylphenol sulfate" 348388.0313 861385.6875 104872 330253.6875 125965.5703 335209.4688 71789.3906 23379872 84440.3516 137564.3438 20084.0723 205989.7969 18383.1113 241723.3125 28884.5176 360491.9063 70586.2969 211431.4375 52964.875 186228.0469 119524.6172 100761.2109 1021087.813 87665.875 73867.9297 60844.9414 103593.0391 182353.25 191093.0313 61831.9805 283031.375 51682.6328 122214.7656 262005.6094 190948.6094 130932.1953 37960.1367 79317.375 41918.9297 1283658.25 795621.5625 226360.75 111287.9922 56564.4336 249907.7813 194856.9844 698489.4375 171071.5781 103035.2656 197133.6563 126573.8359 73769.3984 84528.4766 645317.625 515362.9063 107839.8203 133438.75 6005870.5 63074.9336 298494.0938 104948.2344 1257899.375 85046.0078 1051388 92339.5156 268471.625 95240.4844 126906.8984 4488974 92731.6406 218633.5625 134539.1563 170216.2344 3665842.5 360977.4375 550128 116858.1953 319582.5938 126164.7188 158578.4531 153815.3438 135062.6875 398641.875 113632.8359 139862.7344 88949.9063 83034.0078 132369.0781 105011 92016.1484 179315.3906 1069039.25 277295.6875 286753.0938 75670.7031 106858.7578 121942.6016 94807.2813 154041.1875 76760.8828 279963.6563 81333.0469 133586.5313 175818 59362.2148 241994.3281 135939.3438 136217.5313 50564.8438 115286.5703 67129.9688 141827.5156 186570.9219 45506.1016 55574.3164 115657.1484 230142.0156 113051.8203 225329.6406 97826.3125 217142.0156 471887.9063 158316.6875 519856.6563 138259.2969 310200.0938 409751.75 238474.6875 69490.6172 189244 148734.4844 152059.5313 221367.7969 392662.0625 345180.75 66597.3203 330865.6563 116980.5078 121573.3125 111247.25 103565.0625 133168.8438 405895.1563 118981.0391 89079.5859 376813.4688 83413.1797 99683.6641 7352766.5 115184.9844 64509.2031 160796.8281 105955.8281 119705.8984 64330.1211 150285.1719 163691.0938 62584.6406 463308.2188 162128.4531 156527.2813 88649.6094 120857.1719 233331.0938 66432.9453 144195.4063 345318.125 124398.4688 83201.0859 85863.4531 110272.0703 86492.3125 116562.3828 236926.0313 160055.7188 281343.6875 173139.7813 431718.8438 244040.8125 131621.3594 540919.625 111672.9688 102604.3516 525858.25 150508.8281 126738.1563 92113.3359 81372.2422 797416.5 113764.6719 46366.9727 313875.5938 1968665.5 199241.0781 384382.125 99722.4531 48384.793 417893.625 138935.8594 149128.7031 100389.7422 97853.1406 628003.1875 164748.1875 96186.9375 162591.8281 151665.2969 456003.5625 180831.6094 103881.0625 100875.375 394009.0625 161251.5469 68810.3984 999362.875 150957.7813 798991.9375 188367.1094 101672.6016 191494.9531 153899.1406 306366 306517.9375 163121.875 574408.5625 900138.875 113283.9063 623379.375 832833.5625 402847.0625 109124.1016 352020.25 359932.25 175778.2188 241768.8125 184170.2969 172878.1563 375860.5 229643.6094 167448.625 269008.1563 388275.9688 1536550.125 218350.25 99502.6328 173114.1563 134182 313237.5625 35404.7148 107799.5156 427915.0625 11573628 108221.2344 119544.1406 1076243 144145.3906 359349.5938 2046437.5 606644.6875 35813.6016 170793.1406 159831.8438 315899.4063 104183.9453 1335536.875 225816.0625 113402.9688 47442.5859 105238.25 99825.8047 456337.1875 90878.0781 84137.1797 102304.9219 140553.3906 63284.7422 146894.8594 116388.2813 247074.0938 726314.9375 22473960 74446.7422 117736.4375 699296.3125 119669.8516 307175.9375 146978.6563 367353.4688 203784.4219 130143.0938 84154.8906 72745.1406 200406.0625 143696.0938 4-ethylcatechol sulfate 6188976 17832170 1041504.188 4564102.5 789283 770651.625 14083716 986592.5625 880488.6875 20566032 8311123.5 692405.125 19224030 1018608.688 801396.8125 93088.4609 1952856.125 596397.8125 3356508 6119771.5 6879950.5 25873756 3144729 732276.1875 3513677 852337.5 2674361.25 6089591 439719.9375 27648.8809 4707499.5 6520736.5 34533048 4597652.5 942007.8125 276615 4608142.5 7257713 8609209 4531447 445689.875 20368368 124015.9609 17689178 1132819 190755.75 784362.8125 344897.3125 2182456 86876.8984 119561.5313 98866.5078 218974.4531 103402.5859 4072876.25 464324.75 99042.8828 544020.0625 137421.5156 421391.9063 1018491.625 21542284 52964.3242 63183.7266 156264 140336.2031 72797.0703 171328.5625 426468.0313 9031503 683733.625 485733.7188 3907568.25 3685460.25 41441.082 804782.5625 174565.2188 35686.832 292636.2813 188113.0313 115918.7266 727426.9375 162801.2031 1436306.875 967005.5 257593.1719 1008677.563 240477.8438 181986.9531 1948587.5 8633150 461026.2813 36862.9063 127070.1563 178596.3281 133710.5469 111198.0547 373408.7188 215588.625 1431882.75 109953.1797 136193.7344 2040164.125 1265414.125 276061.5 1403391.5 50601.7813 279636.5 813330.4375 2205883.75 75808.5234 333998.3125 644347.9375 172776.3281 170442.4531 138474 616233.3125 112997.7109 1232891.75 72073.2266 227671.8281 114630.4844 348855.2188 613118.6875 239885.7813 34881592 910626.5625 4556113 109783.4141 165282.3125 641933.5 31350.832 1440666.75 128782.7031 85781.4531 687590.25 87131.5 26494.2754 180799.75 795020.8125 54220.9492 97320.875 681124.6875 114463.5 383552.2188 62847.7656 252137.5625 590835.8125 196605.625 253457.4375 1178566.375 1123903.375 164982.5 41529.7695 83413.0313 395062.9063 128703.2188 1957069.125 216329 129886.3828 267403.9063 285339.5313 8129042.5 1230495.25 83346.0547 1654069.75 129315.7109 640161.8125 376533.5 96764.1094 1677587.375 2027497.625 86618.4063 128409.4063 565530.4375 275459.4375 4284307 3645790 1039005.188 268104.875 5084934 473380 214693.8594 1701382.375 120485.4375 2314810.25 242315.6563 898098.625 742941.1875 507040.0313 1862731.625 3941903.75 203076.7031 949197.0625 100951.5938 526061.1875 174704.8594 1961535.5 482435.25 141022.5156 60508.8906 5015247 474965.5625 103028.9766 471794.4688 203624.6406 235330.9375 11beta-hydroxyandrosterone glucuronide 665943.1875 717482.875 315166.375 554189.0625 248194.125 896127.3125 142680.6563 354500.8125 363834.75 3525843.75 554409.5 496880.9688 170569.5781 381083.4063 414465.125 601178.375 640356.5 659399.5 729667.375 255840 579040.0625 1005117.313 211861.1406 1180362.125 228768.5469 377659.1875 88713.8984 277262.3438 691713 513543.1875 207684.4375 704316.8125 951031.25 571141.5 241568.8906 382647.9688 661821.1875 414095 232360.0156 840607.0625 180426 452297 1045695.938 158296 261321.1719 169438.1563 339165 553117.6875 3400288.75 1835206.875 402681.3438 2083695.625 7546191.5 5122784 65708.5469 64114.0195 5496558.5 233381.7188 818970.875 5849191.5 225059.125 14103145 114894.2266 6262284.5 323602.8438 1316545.375 2747541.5 263579.9375 275174.9375 336757.75 17832110 932716.1875 587042.125 5546635 1974055.75 9971604 8410180 3937280.5 1501821.25 526551.4375 1463721.5 1701542.375 63978.1133 213141.4063 195839.4844 7356396.5 3169128.75 3170813.25 1041555.875 7195604.5 2724294 3897418.25 52277.6328 507384.875 511781.2188 307106.4688 721802.75 30010.3848 72482.0313 967396.75 260927.8594 138517.6563 254836.2656 253654.6094 2823314 1179124.125 355095.375 247787.8438 152036.9844 715605.6875 2032527.25 667820.3125 500424.875 136640.2188 8593526 196706.7969 3038953 15455611 470913.1875 1309362.75 780342.5 6297475.5 9928798 719040.9375 16375580 691713 7796150.5 1149202.5 528905.1875 2994680 386379.6875 399933.5625 2637168.25 466965.5 2019609.875 327061.6563 10253029 168865.0156 64908.1406 498782.3438 332797.2188 3239219.25 403204.125 1366780.875 1086329 520674.7813 138004.7031 21242874 521504.4688 561314.5 4494828.5 1375547.875 202098.875 433901 305841.9063 2503946.75 266925.3125 11997134 1051683 812233 269256.7813 385829.4688 130643.7578 777022.1875 25390590 627083.125 652931 290372.6875 1205928.25 257706.6563 195742.0469 672757.6875 465235.25 6843677 97782.9219 32342404 732337.625 960959.1875 813004.375 190902 2754039.25 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1062689.5 308464.9688 325817 90967.75 17274420 66251.5938 3818705 752936.625 45816.3555 16941510 2064563.875 11beta-hydroxyetiocholanolone glucuronide* 48496.3906 42446.3516 1277359.25 198458.5781 69273.8203 69350.9297 245335.125 194436.3281 140152.6875 396731.3438 64514.418 42988.7773 295824.9063 306105 250039.5156 34417.375 28651.8652 90466.8125 181756.4063 55659.1055 290864.6563 102326.0391 257760.6563 70954.7969 130196.9766 604170.0625 76475.5938 689375.625 177987.5469 385349.4063 219813.125 330373.75 53090.3633 3495015.25 1154502.75 197090.4688 217622.1094 329908.1875 60019.1523 12586058 93143.6719 75553.4609 3938828 187875.6094 822833.375 773589.9375 230462.5 930505.1875 283190.8438 72736.3906 763970.875 913873.875 190134.2344 87816.7344 632212.8125 503940.9688 193212.4844 51885.0898 132178.4531 59412.207 232668.8906 179502.75 483457.8125 646130.3125 846679.5625 495270.8438 1116822.375 568037.125 5367594 70092.2031 376237.5 1198130.625 54562.8633 192471.2188 60854.9414 4040052.25 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240529.1094 726130.375 498251 215799.7031 1859863.875 314941.2188 324645 308312.625 132395.1719 874043.5625 223133.875 446553.375 499792.7813 1660422.25 593572.375 854657.125 419918.1563 509255.6875 151028.3594 673047.625 1300878.375 533167.5 394622.8125 1178341 139598.0781 1442252.125 496404.4063 583066.125 468048.4688 506171.0313 1139362.625 526305.8125 240912.0156 713928.75 506237.5625 1790769.5 324974.1875 233079.7656 1676224.25 751785.75 927053.875 168554.5313 396420.875 816411.25 633214.375 521893.75 560220.0625 1106795.875 676638.5625 1191215.875 170011.0938 682969.75 248396.9375 233692.4531 810359.25 218268.9531 1009883.688 238044.6406 448813.1875 218051.4063 1280056.875 207154.6875 502211 592548.625 387371.8125 853294.625 325362.9063 574073.25 243101.2656 758438.5625 540493.5 379236.8125 215624.125 493670.5 1138538.375 446609.6875 409830.4375 427605.4375 1376895.25 342605.1563 tauroursodeoxycholic acid sulfate (1) 259762.5 291809.6563 348191.75 481467.4688 191288 85504 1167653 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2987973.25 146385.3281 3238653 1224302.5 523990.4688 1065236.75 2423518.25 4459096.5 274708.9063 1453700.375 27122392 487901.5 2094512.875 1639650.5 620496.5 59566968 2812393 317251 2670104 5830837 2080378.625 2472675.5 1132952.25 457053.6563 tetrahydrocortisol sulfate (1) 184652.25 153963.5 205587.4375 83421.4375 60776.1055 243700.875 35266.6953 56598.0859 494947.1563 82350.8359 146105.0469 27811.7441 94198.8438 45969.1797 76983.1797 97619.5625 76374.1953 96671.2031 73337.7969 79909.8438 81553.4219 88145.2344 156328.0313 39867.1133 30112.0547 36440.0742 65794.1953 57612.3516 28555.6094 128796.9609 27181.166 85475.3672 90908.6094 6064840 1110556.75 336831.3438 1797799.125 110520840 3655411.75 175059.5313 8459513 691088.4375 1285962.75 7797250 217796.1094 9529492 157990.1563 4518627.5 239869.2188 1228337.375 5342125.5 84338.5156 115767.9453 242285.9063 3990765.75 756324.375 96746.8359 1131454.625 2496822.25 1502210 3771451.5 3411971.25 4879985 2503850.25 1319804.75 1350313.875 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696565.4375 1458775.125 1940448.125 167428.5 149468.0313 2380631 94683.9063 1791252 548017 58566.6094 348280.1875 375879.1875 3-ethylcatechol sulfate (1) 326745.1875 465099.625 162962.4844 86688.3281 212542.8438 257699.2656 1957735.75 315086.7813 67544.0469 428999.5625 30202.875 67744.0078 88711.0547 82373.6563 160877.1719 194998.0938 210005.7969 261019.4844 181818.5313 536589.125 178636.3438 126012.4219 154667.875 287496.0625 283315.0625 295861.9063 837566.6875 527538.125 36924.5625 566266.3125 393021.5 143775.5781 97778.9453 411017.625 273411.4688 25996.6152 36514.3008 54821.3008 145977.5156 22757.5059 24663.1426 176886.375 44843.4375 40217.8281 234011.125 374682.2813 361485.7188 47999.6563 76294.5469 116021.7344 148062.8281 292409.6563 96097.2109 76440.3516 95990.9844 54818.2188 51175.125 19703.7305 514873.625 52554.0156 197670.3438 119586.9922 366692.5313 56133.2773 140290.9531 78332.5703 165161.4844 154272.125 634464.6875 320675.0313 121278.9141 45131.7422 41395.8398 167219.5781 330931.5938 32700.0254 129629.3047 473218.0625 128739.1094 23757.4688 85929.6016 406630.7813 120188.4297 321326.6563 35536.0586 73466.4375 1010349.938 766962.875 47795.543 47116.4844 144959.2188 191045.6875 186767.8125 444759.0313 488922.3438 87531.9531 58287.2266 105537.0469 154470 23199.502 438961.2813 81880.8516 637613.8125 80701.6719 180483.4375 1034959.938 307116.7188 218631.3125 68035.625 1278154.375 129640.7344 485446.1875 243082.1094 346194.7188 82514.4766 168649.0469 41952.8164 3-ethylcatechol sulfate (2) 131696.6094 239043.0781 62080.543 36171.1445 57828.3789 736952.9375 200926.5156 42781.0742 90926.0469 80426.5 68342.7656 43114.2344 378465.9688 80426.5 123109.1953 56800.9414 32214.4941 80426.5 47076.1641 42881.7344 93485.6875 121612.2266 69966.9531 80426.5 249538.5938 98772.4609 "2,3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)*" 4191286 3595657 5395117 4606156.5 4594202 6366822.5 2736129.25 3190563.5 3653140.75 9437415 3953309.25 3330311 2936654.75 2673288 2072131.25 3675951.5 2837928.5 3485982 3807448.5 3685896 2760322.5 3508752.75 7590534.5 4085190.25 7026049.5 3690521.25 6465527.5 3022203 5115804.5 4380301 3938505.25 2789925.75 5847959 5231873.5 5135494 2439887 4916029.5 7117500 3884261.5 4110056.5 2689293 5829832.5 2677801.75 4084703 6418455 4012949.5 4585418 2556164.25 3633811.75 3855650.5 72716752 27289934 9722714 17492618 81446208 35668892 3884690.75 5900950 2770449.5 81283424 19068940 10728851 41475568 4253647 69940784 4707533.5 33480612 2559814.25 17988756 5793998 38953376 4033491.75 6663867.5 5534878.5 40726100 18591594 2868941 12306489 18270652 30154888 57213588 29007738 46042668 22625232 5935234 13293217 2353135.75 27991056 5974618.5 2912729.5 11850836 2183757 17822026 26437930 11933309 16105132 109365024 32174774 56442188 2529048.25 5484378.5 10040646 19994466 7022850 4784193.5 18291860 9672540 2858126.5 3770488.75 6758894.5 6729302.5 24962898 9155115 8965735 5325088 11791837 7165612 48444084 11233044 13452900 32021142 84516704 3186544.5 33597876 33339268 12762889 7651906.5 19247554 23252362 71000192 10225782 71195704 8526984 74433040 9214943 4473865.5 24752508 11055075 6402625 105794312 12890210 9272742 64791516 47119644 4313363 3459664.25 6267050 8191430 54083356 9326392 12547137 37820280 3582987 31775038 82415768 12000152 3664485.25 16056408 17798878 4368900.5 5126463 7113514.5 16699838 5725367 104448624 14954260 14807155 12712893 12528652 9409116 8825129 9451328 53778824 6945369.5 5244216 5594348.5 22312732 8730981 5321651.5 10225782 5387637 70985648 6711666.5 113354176 38278840 6210951 22591282 6870498 37672264 46307708 19124406 51698080 4326836.5 36793260 17549612 114368888 6780203.5 62562396 128800808 6454042.5 68368608 4218998.5 14501361 24102470 4508214 10717414 10260753 4741548 31655080 25386184 29430164 6423322.5 3802353.5 32684772 25421728 9373192 5108650 132299848 60071540 13358036 14480893 9318733 111582368 29225104 9242720 6739273 9486541 25172778 16042182 9951598 14784114 28670362 10225782 34071588 51620052 23944608 16803156 80131648 81148776 5512451 14336493 21972942 19462688 16878848 10225782 8018443.5 31952706 39486816 18703612 43547616 2232152.25 25547988 116824424 63966136 10595391 104501744 22504418 84890568 3263444 12021286 34456616 9124629 3127381 146148496 18295520 7625289.5 9500002 20646924 27584494 5621829.5 35268424 5282991 67402056 3378141.75 9222531 4246597.5 21744018 5947583 4142448.5 32565514 7073994 3062959.5 11203679 40419176 33984700 49991704 70103024 7010000 53975324 13595456 4581475 25051336 10177523 78256152 7518913.5 17804124 15781597 4499190 118032680 30130064 Fibrinopeptide B (1-13)** 152096.3281 5658272.5 376385.875 30346.9688 23277.8223 87201.5 170783.875 42733.5273 100389.3125 1135595.875 111131.2891 10923.1621 192394.625 9685.4541 148943.7813 24746.1094 176340.1563 63271.7109 413903.4063 12646.2119 60535.2266 87695.5547 73454.1094 86707.4531 71771.8047 95873.6641 84094.4219 812154.8125 31637.627 51020.957 32201.2871 19456.9902 227801.375 34598.9844 200099.75 60994.9883 90308.5703 87201.5 108259.2734 114249.2422 173538.2031 52687.3867 120327.8125 604201.125 40334.043 1549854 23936.3613 21040.7422 579612.6875 58955.0039 5-hydroxy-2-methylpyridine sulfate 11770401 27908544 10184176 119888.2422 3631183 7105863 90906.6797 176108.0781 7833822.5 1089468.625 2230188.5 287135.4688 1689797.75 1031140.125 2451689.25 2365427.75 5105921 9763130 5123931.5 299618.2813 1049660.5 925361.25 141137.8594 1099796.125 1153873 5444164 545377.1875 65522.0664 904755.5625 1017473.625 3794903.5 1606683.625 4800929 305266.8125 57638.3633 148643.5938 72040.6875 102239.4922 489354.7813 179640.7656 4743923 153154.4688 220817.3281 443662.6875 346076.125 309265.5938 289594.4063 235033.5469 80550.2031 405180 301456.4688 248859.5938 42263.7383 62474.457 270697.4688 402081.375 405180 27415.9473 232980.1875 605556.875 155534.0313 408278.625 768476.75 438007.0625 931828.75 62592.7109 57100.8086 53322.1797 176173.7188 695763.6875 224405.4219 405180 405180 211841.3906 3-hydroxy-2-methylpyridine sulfate 2541785 7791723 2714502.5 168049.2188 255220.5781 2673107.5 93097.3125 344133.5 2732536.25 571117.8125 1173608 161107.7813 96330.2813 1029706.313 307772.3438 358905.1875 1019317.125 1328055.75 1572822.875 98122.1719 1276605.375 38129.1875 958799.375 97435.875 669885.1875 2359035.5 69045.2031 365552.0313 1969960.875 2084088 13532238 1023124.313 910025.5625 3834202 3021711.5 2882172.25 3196341 52762.3477 5191525.5 130859.4141 545955.9375 261891.4375 64379.5703 149567.0313 119873.6328 187303.875 302932.9688 82474.75 93232.2344 141965.0625 140640.2344 72759.9375 324742.25 2091203.25 50290.2734 2005380 666874.25 57735.0078 237111.7969 569112 139895.4531 17783.5645 140869.0469 302317 2163775.25 31813.5332 212939 146320.7813 127015.9297 1028259.875 28858.4785 384657.9063 36458.6094 128996.5 21814.1699 36094.0781 161031.0938 53630.4102 729603.5 47385.5469 134586.2813 200875.1563 928897.8125 3514701.75 58265.8125 39294.8125 67984.5156 159789.9375 131738.1406 23703.125 644909 66049.4609 473026.5625 466752.875 127969.2969 1796966.5 56312.3164 437162.6563 95463.1875 357196.125 80771.7891 46910.1797 126709.1563 564548.25 212939 586310.875 4918478.5 105474.7813 165045.6719 66969.4453 82465.2734 41352.9063 61784.5469 209885.2656 61418.043 152439.0781 625028.875 524284.125 107036.1563 33770.6367 164273.9844 384118.3125 212939 485651.5938 212939 81184.1016 633956.8125 3554758.75 61803.7383 62805.0352 97650.8594 64246.4609 80840.0781 223962.4844 1394661.5 1751068.125 34046.0156 1351987.25 4430957.5 42960.9453 32011.3301 107633.0156 11422623 2924831.75 43708.6445 73598.4609 83156.7891 2778581.75 499585.9063 506785.5625 311488.8125 177763.0156 252367.6094 35707.9414 349637.0625 238574.125 70377.2578 42621.3633 1353620 986428.6875 751399.25 294625.625 cortisol 21-sulfate 6432492.5 1236331.125 117474.6094 1280610.875 24515684 2589983.75 7593138.5 519275.0625 427175.875 11812831 11200166 67187.1563 6364638.5 163977.9531 488438.4063 3310088.5 1412987.125 291136.0313 2685468.5 2791396.5 875719.6875 5781731 8816846 1792155.25 3603649.5 1569940.5 708363.5 5412609.5 2365411.25 1473135.625 1289606.125 6890710 956979.875 2015701.125 815144.9375 4070066.75 931237.9375 639744.8125 1227335.875 448622.8125 1324046.25 2397121 1106515.375 3892150.75 904726.3125 2763006.25 265427.6563 486350.4063 1156779.125 5224887.5 933328.625 1415452.125 28349514 673773.0625 4605098 799816.375 3801234.75 907553.5625 3468102.25 1185413.5 3672328.75 938746.4375 3562583 1258471 4121855 246655.25 3347245.25 1552299.5 2297041.75 1126416.375 2215836.75 3406288 552574.9375 324871.375 222167.75 811903.5 844820.125 216071.2656 151384.1875 1735134.75 1272414.5 905469.6875 2569016 246939.25 6960152.5 592661.625 894618.8125 463942.4688 980183.0625 400566.4688 2071194.25 782764.75 2031356.5 683032.8125 3476529 1763281.375 3701894.75 622235.4375 380577.5938 160988.7813 14352319 379794.7813 1295656.625 1519039.125 317270.875 180474.7031 3928314 19024610 1940939 4008485.75 1176801.25 1668325.75 3366139 4561311.5 3780339.5 5293598.5 1258471 205373.0781 299349.9375 292988.7188 612849.75 12175148 811190.375 4863814.5 5024697.5 408905.9688 310217.2813 1142731.25 901161.4375 13153061 2180102.75 207182.6406 994537.4375 1431642.5 6258953 2164791.25 7087261.5 440494.625 45895364 519723.875 1154917.375 457563.0938 21107746 282776.5938 1221285.375 197517.9688 191073.5938 3951038.25 227350.5 878834.25 481591.7813 481012.3438 642185.25 3135959.25 1462575.875 684571.75 glycitein sulfate (2) 1122731 23413.7559 10848499 124444.6875 2299263 213838.2031 4213652 46291.4609 369954.375 299507 503362.625 9602340 45016.6406 1068730.75 268576.125 278468.2188 43756268 2201157.5 266076.8125 81983.8594 437783.4375 46749.0273 4105075.75 883733.375 466283.8438 267749.8125 100870.4609 6162861 258790.9375 259802.2188 625297.0625 435533.5313 1610024.75 5161388 289878.9375 16658886 194857.7656 7798451 118978.3984 437692.75 801704.0625 435624.2813 446683.3125 49192.2344 186141.9063 98866.2422 1019534.75 369463.25 138600.8281 5489107.5 346634.9063 2776910.25 1316532.25 436658.5 37116.8359 12366669 289092.0625 602196.375 1453671.625 960691.6875 46785.9688 436658.5 33010.3672 976518.25 123976.8828 918391.5625 863985.375 426537.1563 13029044 1161807.625 62399.9063 1451420.875 98393.0156 1403695.25 12678424 1189561.875 239170.3281 382477.25 252772.125 747603.3125 261410.7344 30080.3691 taurochenodeoxycholic acid 3-sulfate 1060369.875 794237.375 1283203.625 260335.4531 692127.8125 9484310 122354.2188 269764 1081263.5 1084833.875 101732.7344 1004018.563 146908.2344 112911.6172 485262.0313 377365.7188 287790.125 888042.25 89304.4063 142781.5313 265976.3438 102409.6953 436410.4063 568824.75 312669.2188 248667.7188 429457.4063 103865.4688 195026.6094 767809.1875 81703.0703 330771.1563 1397037.625 468477.4375 159321.75 148474.75 305105.8125 1047153.563 313568.375 3039032 724591.125 1685172.625 367401.9063 5122491 255189.9063 951897.3125 562831.25 163829984 229866272 7664858 160809.0469 42223460 2277280.5 2351148.5 13166198 10340481 647705856 28600844 6173007.5 974540992 30895924 20569900 34791604 17793110 671690.375 48472888 4615210 9283132 13613638 97790408 1917224.875 1530401.125 65705668 5708643 3106343.25 812607.125 17987826 149272864 9152174 181431920 11797419 87821192 88966992 1772862.375 139191712 3066659 1204426 45767932 13859227 2036145.25 60696072 2357275.25 10638032 30759338 2789135.25 288045184 692662.75 10585984 28769654 19348038 12871839 2548790.5 4189445.25 19319754 403933.8438 1213342.875 246453680 2681238.75 1105774.75 6963349 986702.125 29881680 28068042 724011.125 34339528 8148957.5 58566648 23466758 10230919 4465838.5 154972416 40256380 12466880 542463.4375 120749528 3302705.5 312680288 8537360 11248596 2798392.75 16959490 12592279 2393572.5 14893640 20751856 12315119 92834392 6751138.5 9335016 51422000 100507504 316621.7188 224706.7813 996688 9159322 204168496 11852389 4577019.5 360646176 1431549.875 7535479.5 62256424 6460950.5 4511407 12224093 10613186 930013.1875 3673074.75 2116832.25 5030315.5 72340408 474100288 34937972 5288703 256959280 95940488 488049472 70126144 16443451 17845346 2944417.75 997592.4375 13990597 135656880 10193131 2276183.5 12251713 9103480 707926848 16279936 129694920 194875792 1019737.5 473761024 7827166.5 11811143 48225232 88682352 101091064 2379769.5 31757980 73768816 6056304 825066.3125 22427546 41079628 1603015.5 52332756 5210459.5 4820820 49650620 5885977.5 387008128 236446384 7714741 502596640 61708368 65752464 6756562 498445.3125 85641096 135724336 33095082 1720349.75 54807004 99536320 68655768 5405702.5 104608544 2072293504 60834256 87818584 4758415.5 4160013.5 542565.9375 6874517 53170184 20591644 80212352 228030640 91882120 7708907 32938890 1013148736 3829876.25 5820444 6982417.5 29747508 12267920 10052042 4944762.5 6918932.5 91035456 14464386 33322414 253125.9219 1934902.75 20925368 619739.125 743438.8125 15604877 218449376 1704069.625 2146307.25 1250523.625 1836916.625 99915048 2907595.5 521131.9688 18628888 2117242.5 10555392 181623072 5908057 11066482 275980.625 185843.4531 3650126 2076843 1145104.875 12626693 5214261 4498379 6123123.5 2687588 93894936 834627.625 1197173.875 1195712.875 13603948 191932896 3109997.5 12122262 2018718.25 5114791 52747288 1419801.5 427858.4375 4650540 3269596.25 10632745 36028.6914 2034874.5 6918932.5 2689704 2469205.5 tetradecadienedioate (C14:2-DC)* 229607.625 584749.0625 434980.2813 442757.9688 268755.1563 568836.6875 101249.9688 740820 325457.7188 4676076 352086 1984271.5 174509.5781 91774.2109 124677.5469 791897.375 93242.3203 827048.375 317281.9688 597022.8125 1577263.875 3273639 721036.5625 753916.8125 254003.6563 2444723.25 2708159.25 864402.625 636369.5 421689.5 258933.1875 213342.8594 2660325.75 587955.1875 453719.5313 149219.9219 1032953.063 528948 357112.1563 329203.5313 1229102.875 390508.5625 1101608 935208.5 228433.75 1310586.125 134533.2188 361560.0313 285623.4063 10022826 31926110 810553.375 4125309.75 3606147.25 3639037 124055.4531 1282406.75 737377.75 2598874.25 1056236.625 670072.3125 783092.625 222073.1875 542700.125 221681.5781 714176.75 276362.4063 356233.3125 1036636.188 2494705 948647.3125 1864578.75 624431.75 5873153.5 2228850.75 388555.1563 1675677.125 304672.9688 995960.8125 1177450 4524515.5 1004219 906021.9375 186808.0156 866944.25 198409.375 352720.9688 640136.5 1812542.875 1621274.75 189251.6563 210900.5781 864671.9375 513052.8125 1955490.875 8441588 15977549 2200225.25 312258.7188 1108699.625 726137.875 957983.875 1220732.75 249227.6406 640829.3125 3350053.25 811785.9375 555758.5 595970.1875 2039816.375 13596073 1665282.625 393809.7188 390762.125 1730980.125 3877525.75 569717.75 1456536.625 990946.0625 2593518 972099.5 126195.9766 4033687.75 2002833.125 2100417.75 459272.625 6758055.5 2128351.5 821531.5 639602.1875 3378757 391266 792837.0625 1285467.5 434282.5 972099.5 617881.375 377653 2306264.5 478442.4375 1567174.75 2452140.5 1580094 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2126277.75 5112847 2297322.75 228041.0781 6004420 2994862.75 903275.6875 1002763.25 1867300.375 7199437 4022542.75 1694328.875 802865.9375 385569.6875 7432131.5 3135824 2310079 731290.75 907519.625 1730480.625 199694.8906 3198054 273887.4688 693097.0625 766993.0625 1659256.625 1387886.875 2189323.25 6601229.5 4900776 46874296 1426582.375 347134.875 1610451.75 6657823 574711.8125 3435510 396968.0313 3214749.75 974327 1152241.875 944363.375 920448.8125 1302260.875 999835.6875 615398.0625 6175830.5 3368139 805762.1875 1505410.5 2100641 4408127.5 2179778.75 273180.9688 1908814.625 2981252.25 1553375.25 163082.4531 774904.3125 1925927.75 10480986 4145881.5 pregnenetriol sulfate* 2812273.25 3803273.5 6328988.5 1639347.875 1266620.5 5800644 2492854.5 1355883.625 4218922.5 4303081 5761267 6572312 5885534 4595023.5 3613801.5 2339907.25 1462245.75 3901899.5 2824174.25 1718225.125 2321330.75 1919893.5 3292287.25 2250661 3599311.25 719060.6875 2055519.625 1577998.125 4249069.5 6950043.5 557796.625 3872414.75 3886242 3031573 3245267.75 1816992 5178760 505743.0625 1618653.125 1274830.125 1987197.5 1752377.875 3641202.5 2978241 1188937.375 255438.125 813222.8125 1651784.25 1577819 2145810 10759572 2900078.5 1347804 15968104 5640994.5 912042 1328983.75 9510643 1616562.375 4479993 16685177 2097561.5 753481.4375 2948662 2579921.75 2904329.75 791044.0625 561029.4375 4315378 5447755.5 751514.4375 3997073 1808240.375 3548585.5 2391769.75 2125350.75 4267020 18242928 730859.6875 1247756.125 2856176 5023369 3046236.75 557249.75 1223946.5 1355528.375 1847717.75 10119114 2139986.25 3529021 1399350.375 7526502.5 3876723 7606657 10215595 3970958 7034998 296115.0625 4182464.75 534615 6813217 307630.2188 2037611.5 723956.625 47920.4141 3524507.25 5760845 2929232.75 885404.875 1981082.875 6541908 3982245.5 1415227.75 1990301.25 680262.6875 3118495.5 1066530.875 7151388.5 2557204.25 357952.6563 2217887.25 3165724.25 3687177.5 1701329.25 12523834 6097173.5 2104271.75 3313010.25 1583812.25 3558731.75 1543129.25 1796584.25 4650030 6232455.5 727688.25 12680746 6949531.5 1103808 4276735 7021047.5 24315508 4031642.5 4679814.5 5835604.5 2712642.5 3788624.25 2516320.5 2391616.5 769173.0625 5227720 1246205.5 8518875 289798.875 4831106 875195.75 2354505.25 16037253 15144235 3295621 6774240.5 1862225.125 9781042 2654074.25 455858.4375 6149307 715600.6875 5603051 7507449.5 402201.4688 1422576 700989.875 1603932.375 6573281.5 1894251.375 3975913.75 2212323.25 1675483.625 3474390 1468990 2229761.5 2571087.75 2856176 5768482 1480192.25 10988040 647859.125 1490780.75 5577303.5 3194855.75 7233293 5545250 1016717.063 18436472 4026884 258428.9375 3299436.25 10230371 6036509 10962866 2525280.5 10131345 9692178 874990.0625 1861907.125 3021594.5 1660423.375 9773058 1327559.5 6214099 1903285.625 7425756.5 7940369.5 2479079.75 1993903.875 2634869.75 854892.5625 3354082.25 3590015.75 7936682.5 666186.0625 33150864 411556.0625 2993322.5 654561.4375 7734760.5 7958393 7044287 7860535 1535000.25 828247.375 1268715.5 2856176 5868119.5 1615281.125 11733514 7974497.5 970048.625 1518120.5 7380550 805159.625 782497.875 980284.125 2856176 977058.0625 12249483 13002472 1506410.125 213098.1563 3286807.25 943351.625 444525.5938 808117.9375 3152262.25 6114865 15234090 1847835.75 6880279 1445205.75 934660.375 18660242 9291691 5196899.5 39531796 1278601.625 786683.75 13074849 3814283 4492641 177711.6563 113921.9688 4147105.75 4226003.5 4446263 4907020 1924814.875 6388310.5 12680741 1656236.75 3730960.5 2783470 1241150.75 1657303.875 662592.0625 10134988 802103.375 4944356 5777227 776349.625 4753665.5 3588485.25 1987761.375 9980700 1836167.375 115846.4375 11644791 190904.2031 1800646.625 1985007 pregnenetriol disulfate* 13790531 12862929 13639575 4833344.5 4056879.5 18495352 6301345 2146027 11064253 21360622 23356504 11690125 18084236 192157.2813 8901137 8386207 7617874 6768621.5 11285751 7670365.5 4154031.25 4477544 11799771 12344055 5293065.5 5010041 3106016.75 4274896.5 2983216.5 10139812 13420615 968443.4375 10567148 4597855 5632061.5 3402290 6288764.5 14113320 2897714 3795969.75 3404787.5 7627273.5 4936418.5 13848638 12347506 3618521 1256360.625 1941307.25 3009500 4424549 70368328 28685566 22169380 30187308 63947932 60162180 5432406 4029091 25273712 56241968 22550410 33263596 70371528 11055119 16063601 8491620 23153446 2187944.5 7688217 29389812 13416814 8150954 40620324 20131894 28284246 28583438 5852545.5 29477384 215285552 11042525 94194048 49370800 79043256 55160264 4557035 32191974 1905195.625 21715470 60172496 7547349.5 20813196 5525375 63898592 31859790 25360796 40618724 19270060 63779656 37778784 14568411 31878908 25510878 10305062 27904386 803015.5 1765411.625 28187306 13797173 21836832 5196073.5 5223728 30266354 17279476 6808593 12365393 4040727.25 9442241 36993340 46968664 18967376 492055.25 37280496 13738208 44378568 76304760 10026894 21055184 15347427 44920936 97817712 12033642 21170908 42251436 210667840 63395712 6908031 106220344 17279476 7266643 103729616 27601816 114455712 13419748 102540456 21029848 7198774.5 15005818 11792184 87673944 20800126 28383448 18405392 21171078 1070924.625 82963496 13192294 4855225 23660104 74555224 9697770 54925568 20501472 36418196 13282742 15744807 33000174 22722180 20964324 12850440 5749615.5 23518708 1036388.125 51350764 18988464 7474803.5 17295238 31486628 10037565 15051957 9502090 15491622 69373704 8757341 95612288 27700800 28117612 24680908 7191529.5 21973582 20000724 71531488 72184088 26797154 37865352 14570317 8087978 9909576 36396964 115082472 78266296 12120774 17810712 28857714 12241018 4747140 21374470 20088316 15865377 10537814 43129008 31954866 48669472 104171984 15531376 63599940 23988334 6011322 47123768 14957176 46729848 7982355 43836760 133282912 19344614 6872608 11320960 10430840 46055428 32618126 11513852 58863744 15823274 17848728 43148928 17279476 28736222 17279476 77078608 37238524 10303873 21461780 11981592 14691325 40082396 4197825 18641938 69319416 5570059 8138132 22460810 8950629 9279936 4589342 18959600 25248938 79723568 13779573 18358256 8479784 8827429 66861748 41106544 4810755.5 309059072 13574574 4753015.5 38455604 57247884 15698989 2563389 3733120 19351370 20742572 26524872 16190810 9766698 22409774 60571796 2534558.25 19169596 19563674 2976132 8329943 5573174 31677260 1913237.25 98619968 30081464 5143441 17978344 14140361 641918.4375 2844542.5 107594408 20340764 3924004.5 28068258 1166922.625 15689238 24986040 picolinoylglycine 102383.2656 213823.8281 188345.6719 115954.1328 83653.0938 252889.9531 148965.6719 211565 157696.375 315366.375 145601.5469 111613.1328 248631.2031 106776.4688 116998.8047 137312.5938 89469.5703 165971.6875 154848.5625 218725 70993.7266 236590 248490.375 112176.8984 95987.625 240845.6094 95706.2031 145143.4844 215722.9063 46658.2148 128860.4063 199273.7031 333431.3438 231654.4063 77996.3828 401164.4375 489235.5938 218959.5469 211565 102390.7969 217079.4375 124173.4766 164908.9531 361119.1563 202562.8438 387514.6875 45933.6367 144534.0781 99180.2969 1179642 1323246.75 65407.4141 381980.125 258703.125 530350.125 55662.0586 273108.625 67618.2031 1182856.75 181511.375 592721.875 97175.9141 2586063 826942.4375 49990.0273 147331.3281 255954.8125 142981.875 175641.375 1799246.5 163771.0625 246683.2813 31427.834 294553.5938 1149921.5 662351.5 131316.0781 345620.7188 154084.1094 134716.5625 428926.5313 28769.9883 83771.2031 68085.0078 905603.375 370570.3125 463248.5625 213162.9688 1971897.25 1106334.375 800915.75 696267.1875 283369.5313 234796.5938 41431.1133 428682.9375 99831.8906 63643.75 210902.3594 91219.3438 242511.0781 212134.9375 379950.9063 92957.3047 94297.1328 223829.8125 1293011.5 87254.3984 65645.3125 680980.9375 3068274.75 91517.4844 202903.375 115470.8203 133599.4219 234068.5 502333.625 2212775 256945.6094 3967104.5 648261.4375 1042796.625 83919.3438 229122.0313 129039.9844 695936.4375 129207.4297 270426.8125 211565 62653.5195 52500.4063 110172.3594 184146.2969 135223.4688 247626.6719 250836.8125 618762.5 2462025 100471.4922 277395.4375 191801.7031 70141.2031 95307.7422 293863 291272.4375 217506.3281 781669.8125 127074.7188 379821.5313 96329.8906 42663.3633 147806.375 60258.0313 2073684.625 58034.3633 150171.7031 134490.8906 56120.5039 120811.5938 196349.9219 70627.3125 1795715.5 211565 1059667.5 275510.125 106868.3438 706145.75 120078.5234 147987.7813 204258.0938 350678.5 159414.8906 110281.2969 214942.2813 2472831.5 63382.5742 224728.6406 2907548.5 46922.1602 2409363.25 245696.5 156223.0781 269791.9688 177753.0625 74738.1641 879341.4375 1352835.75 806141.3125 86872.6953 211472.875 225902.5313 418039.8438 145338.1406 341954.0313 1533728.875 318626.9688 842851.4375 160783.5313 1735864.125 573008.1875 106077.5313 73661.8203 57639.1367 383813.1563 234027.5938 151904.375 711863.4375 212942.9688 466596.75 61563.4883 78731.1563 1161836.875 2154111.75 502217.8438 776599 246475.0781 71084.3594 60737.9688 83101.0313 101372.375 106283.7969 174887.8281 1354171.125 47816.6641 365875.0313 3652889 770369.3125 213076.3125 3954723.75 124227.6016 20413756 119541.8047 38328.1367 48148.1875 155745.125 3149154 425483.3125 142178.3438 353606.0625 692312.25 102989.6719 1204958.75 140247.75 383951.5313 108531.9375 395416.375 274508.75 122989.5625 113267 25293.3105 47463.8398 1741297.25 570613.25 508745.5313 958789.3125 79962.75 211565 53761.3633 74486.9219 302358.0313 147468.5781 718396.1875 52830.4688 6230558.5 463056.0938 Urolithin B glucuronide 408116 408116 408116 413334.4375 402897.5938 225133.4219 591098.5625 metabolonic lactone sulfate 454782.4688 1144200.875 343788.6875 131234.9688 318305.625 356021.5 467025.9375 449453.875 218475.5625 436688.375 728796.625 326982.6563 330454.2188 179947.6875 298447.0313 469285.75 318079.875 625235.625 1168613.875 649914.625 171808.9531 152109.4219 82328.9922 177080.2656 1018716.875 117502.3359 333237.4688 591749.25 95394.0859 763929.4375 1078298 83954.875 958429.5625 464523.9063 477816.625 340000.75 95257.5469 1060334.25 460518.4063 338799.3125 263141.7188 710090.125 241238.2031 490524.3438 385821.5938 1280566.875 649955.0625 303109 555497.125 470538.3438 704482.75 162776.0156 558481.125 808967.25 257075.4844 422575.7813 690237.8125 266217.0625 1192027.125 591000.625 1344535.875 126401.1641 202059.1406 374247.375 361403.25 123849.7188 434061.6875 451262.875 70960.5469 553404.9375 566603 1273670.625 549931.3125 712404.9375 99218.2344 354122.5625 958237.6875 339852.2188 436037.5 837402.6875 528306.5 129849.9219 327587.0313 348995.5313 586151.875 37111.9609 183221.1719 347023.7813 367024.4688 282864.875 211843.7031 383159.4375 303608.4063 829142.6875 160931.3594 42806.957 227886.7188 1040228.438 137792.5938 160385.6094 645168.625 446010.5625 878934.25 151745.5781 1294588.125 245938.875 339697.5938 226259.5625 309034.5938 280415.0938 265421.125 211742.6406 349504.9375 1639893.75 279431.7188 1129990 466992.625 86678.125 465669.6563 206423.5938 995590.1875 2350407.75 133800.5469 422669.6875 79600.75 112758.0547 636461.75 343438 517246.75 351962.6563 210950.8125 778719.375 374212.4063 552757.9375 555512 222723.3125 644323.75 267221.7188 374544.8125 1063536.875 164926.9219 347227.625 353838.8438 172667.4375 566781 345145.1563 129416.5547 390627.2813 229055.6875 166763.4531 471050.9063 733376.0625 406917.4375 246969.5781 1023523.75 421957.4688 262910.6563 63072.2422 354019.5313 182565.4375 172466.2969 236276.0156 563771.4375 224963.5469 218144.6563 384447.7813 1155784.75 104670.7109 667812.5625 488818.4375 101191.7734 67708.9141 1326748.25 569596.0625 716280.625 327247.2813 262249.125 118673.1406 770552.875 709458.5 191492.9531 164492.9375 86694.6875 35719.8398 707874.75 227974.7969 1559232.25 253719.7656 407345.8438 134363.9375 168273.5781 901481.1875 491461.7813 1101828 1023948 729630.9375 1390095.375 92973.2891 317152.5938 875120.5625 518577.9063 1133369.25 94323.8281 315962.9688 100158.3047 241342.7656 1299948.25 298163.5313 527098.25 1095132.75 917428.75 852842.3125 156405.25 1664085.125 75439.7266 146491.2344 273120.3438 347382.2188 46865.5195 165600.8125 171462.2656 675447.375 736138.75 124054.6563 1419491.625 146105.7813 1127674.375 157274.1406 280799.0938 41934.5117 177294.7344 360924.2188 1432759.625 277621.5 101305.0625 311099.8125 696899.0625 823000.25 316769.9375 419176.6875 184413.1875 77776.9922 76244.2031 114279.9063 1417923.375 298721.9375 343438 101682.3359 310547.0938 343438 174974.8906 107710.3906 97486.8359 343087.3125 141896.2188 216930.7656 230155.0313 132919.125 103213.7734 250641.9219 78096.5469 825932.125 1146100.75 65822.4141 163415.5313 816846.875 368835.5313 46896.3633 610006.6875 206400.1563 126568.8125 vanillic acid glycine 152135.6406 176112 384438.9375 155443.3438 1728592.25 156079.9219 2603801.5 386032 81466.0313 158076.2188 508530.2813 132064.1875 306091.625 284729.5313 129739.2109 175330.625 266367.6563 868566.875 298277.8125 107891.1406 132438.1875 179647.8438 137917.8281 2248746.75 68824.9844 535189.1875 1630094.625 400177.375 656795.0625 91226.6484 810625 219788.0938 124016.2578 168812.875 624915.5 412977.6563 217572.2188 354196.1563 138843.5781 386924 176112 2422560 4160089.75 75796.8516 98089.4297 259330.4531 298417.7813 143465.9688 131243.25 253716.625 181311.5625 72014.6016 87773.9453 259643.5469 447638.5938 839255.375 176893.375 69923.0234 63457.1016 69109.6719 167052.5469 143813.0781 34203.1484 140027.6406 82746.1641 58272.5977 91808.1719 361938.2188 7810707.5 150426.0625 233865.375 173811.3281 2494369.25 77447.3047 63961.0469 73739.5469 172418.4219 235526.0156 2671999 92459.1094 139667.0781 72871.6563 239553.5313 51057.5273 200022.6719 699069.3125 100858.6563 113075.2266 2484304 36009.5352 130625.3984 20885.9512 247089.0156 118046.25 363318.125 228931.5313 312134.25 67925.4375 191689.2188 226867.5313 287866.7188 244341.7969 1207983.375 27209.0527 57038.7383 42954.6133 54167.6953 121133.9063 1821238 90877.5156 4090305 1140561.375 276536.2188 7052979 62850.1875 23512.6035 103207.5156 73877.2656 249196.375 33461.3477 242383.0469 63741.2539 129701.2656 102882.8203 704773.6875 226402.3125 432730.3125 144497.4063 3605830 1282190.25 172576.1719 22268508 176112 branched chain 14:0 dicarboxylic acid** 105764.6953 3373559 1449113.5 6047829.5 1814673.75 3462803.75 653163.25 1971826.625 2107216 948201.375 2049855.375 1445924.25 883484.6875 652102.5625 110742.6641 1839805.875 687900.0625 1839249.75 2048544.875 3179797 4156027 246859.1875 499431.3125 3278774.5 999005.4375 1770540.125 684117.25 801726.0625 3098026.75 4562806 2218758.5 341016.6875 1871303.375 4202344 443602.7813 697733.875 579549.625 952021.1875 766477.8125 1180985.75 106343.1719 309798.9688 1561803.625 274435.9688 1227804.25 705164.5 404304.5 273766.125 300345.875 110951.3125 200794.6875 232621.2969 357072 91558.3984 1690902.375 71179.9063 112476.0625 132343.4844 724080.5625 640556 156440.8281 70875.6172 75863.8594 296582.1563 180052.1094 560147.1875 117165.8438 85768.4063 177157.9375 95873.2188 357072 111864.5625 401171.9063 296476.1875 207336.2656 284709.9375 553827.125 583394.875 273985.8438 105430.6875 249793.2031 53547.5313 803051.5625 624898.125 837609.625 268603.875 225258.3594 348271.6563 393142.8125 725616.1875 490236.4063 557061.0625 67020.5156 357072 414377.4375 325697.2188 185155.6406 50993.1484 373127.3125 248926.7656 958457.6875 426020.0938 3026639.5 48633.4531 1095470.875 378709.9375 195206.6094 269433.0938 1604356 78545.1797 125960.4453 140558.8906 236977.4063 441604.25 228360.2969 55508.4766 101332.0625 517679.875 2998867.75 100404.1406 2823910 185274.375 599328.8125 727603.1875 339531 1309745.5 210067.1094 282593.2188 207284.5781 1665647.5 439708.0313 174415.8125 232773.4531 448887.9375 210749.9219 129564.9922 238091.1094 194651.9063 115359.1328 111943.2734 84432.0469 2274565 188640.7656 1066391.5 50014.4922 85340.6484 107176.8906 219032.1875 1477122.5 171154.75 406051.25 214578.0156 233029.7344 108830.6484 835986.8125 221462.1406 2345714.25 186004.6406 294144.4375 754833.625 204733.5156 755770.875 180218.2344 563856.0625 590957.5 54745.418 412900.0313 34165.7461 226350.1094 (2 or 3)-decenoate (10:1n7 or n8) 399596.25 815016 647941.4375 264075.4063 58074.5898 277466.1875 227410.0625 977074.5 193627.75 1837023.75 346157.5313 1139100.75 181461.3438 247390.875 265111.8125 631730.75 251278.2969 302493.2188 775061 115140.9219 547500.375 1145832.25 230765.2031 579285.125 184262.1875 1495785.375 1305329.5 958093.375 761451.1875 457486.2813 317595.1875 319366.875 1034753.375 325539.0938 336277.625 322099.0313 222245.625 890751.125 124565.8984 326413.3438 208135.9844 875363 1186761.75 147466.1875 1119268.25 163919.2969 579076 141421.4063 1505083.375 4414293.5 414820.2813 661361.0625 1550819.875 395035.75 119760.7891 632753.9375 460104.5625 849772.4375 857725.125 1326430.875 1623058 167878.1719 453212.375 484156.9688 1950598 177454.2656 594050.375 466153.5 868272.0625 267033.125 590252.625 373495.6563 382987.8438 960900 1095649 1461190.375 507142.5313 606430.375 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817904.0625 133402.2813 2673059 491540 365067.4063 729227.5 839250.8125 790492.875 621334 685873.4375 778102.0625 437996.6875 630955.375 809878.1875 478058.7188 367390.9375 297799.2188 315527.25 1160127.125 430403.25 543564.375 1064301.375 611712.625 783113.5625 1575523.75 953947.4375 434763.875 1307845 647360.4375 1474387.625 744253.375 380909.3438 554053.125 isoursodeoxycholate sulfate (1) 835384.1875 232622.6094 311263.8125 507014.2813 558745.4375 1336955.75 213133.625 1475102.25 142002.3281 1546934.875 477700.9063 210886.2344 167015.4219 2275686 716943 4061084.75 363014.5313 1337397 444956.2813 286425.5938 193844 1017410 155002.75 311126.5625 332494.375 622129.0625 242490.1094 915627 448121.8125 81184.0313 375615.4688 146263.7656 168732.7813 915627 128398.8359 623742.4375 84887.0625 235542.0469 1018187.688 192001.4531 1577072.5 2771276 285700 1256415 15175956 2653515.75 566287.25 1674946.5 961859.5625 2063295.75 358182.0313 2120177 9091717 447580.75 5517848 579416.0625 4368014 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923657.6875 903270.125 471557.5938 1537179.125 1255528.5 834253.875 640828.125 482692.5625 502722.0938 1756602.625 869394.4375 387087.0313 501910.3438 2268751 692913.125 2603550 851910.6875 1101624.375 5645347 1578811.875 562760.125 3136176.75 584383 1188384.875 395676.8125 1532162.125 1592892.25 chenodeoxycholic acid sulfate (1) 260471.0156 160385.9219 72537 54590.3984 97938.9609 251159.625 49997.7148 293535.875 118412.2422 920325.75 189889.4844 253504.8906 15413.8203 269924.0938 186200.0469 2079153.625 177042.25 325411.4375 180066.5156 270486.0313 69898.5313 39745.4375 564165.8125 77681.1875 197111.4375 94155.1875 219522.75 115584.0078 400164.2188 55700.9336 109549.9063 38190.7422 167230.4844 148060.2813 103409.2578 166881.5938 57091.832 248423.7969 51276.6914 114542.1328 37789.7695 153593.7969 126023.1094 440323.0938 1130964.625 2938060.25 1275018.375 1176528.375 398774.4688 309274.4375 308963.8125 2494842.5 136644.7813 28141004 169954 1059192.875 211472.2656 448051.7188 81875.2891 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270704 88657.8906 72467.7344 99900.5625 57901.8008 428525.0938 75738.9531 443761.1875 880194.25 628925.625 146257.1406 88443.9844 174978.2656 422662.5625 2069656.625 2216767.75 1000757.5 302201.0313 111426.2578 1486562.25 47183.7383 468648.2813 2254749.5 307257.5 189502.7344 670894.25 776799.6875 202510.3281 212288.1875 335689.0938 2543503 635378.625 341974.5313 1427262.25 163563.1875 829296.0625 403520.8438 153915.6719 96503.1719 908355.75 764475.5625 1104514.875 821371.8125 97896.6875 439693.0938 589340.1875 825335.9375 274050.8438 890771.625 103411.7031 10422029 257815.9688 522463.125 1587189.875 2406166.5 291247.9375 74844.8906 569923.375 23915.5176 462481.4375 888212.3125 373242.1875 527099.5 184042.5313 340065.3438 40183.4023 120959.3047 284089.8125 1083133.25 130071.8594 49400.0625 448361.5625 235934.1406 148089.6719 71704.4297 552683.1875 287486.25 294918.9063 620155.1875 190345.0781 1663806.75 613913.25 245772.5625 433184.6563 647337.75 1950816.75 127667.6563 439297.625 192669.8281 454321.3438 2720440.75 70218.0625 7314117 66764.1953 961349.9375 123326.7656 1342543.375 5042713.5 69827.6641 847659.4375 1787292.25 145613.6563 313999.6563 448282 278695.3438 809135.5 92801.1953 92132.5547 318559.9375 690555.25 558358 129676.8672 165000.6406 123226.6172 222256.9844 617150.0625 283731.1875 1092150.75 209305.5781 110986.7969 366689.7188 193892.5469 50493.9883 296347.5 45103.7227 144540.7656 140162.8594 "branched-chain, straight-chain, or cyclopropyl 10:1 fatty acid (1)*" 1450507.625 248949.3594 728622.1875 225047.5938 103332.9297 758379.8125 943894.625 670349.5625 2254667 1955556 343075.5 336435.0625 803415.5 1036157.813 568970.25 730985 1485710.5 1372247.25 515346.7188 312911.6563 1804620.25 2711438.75 1304628.75 1113808.375 2150408.25 1720973.75 3481476.75 882955.1875 3163868.5 659276.8125 637412.125 562751.375 1424264.125 298873.0625 867296.625 908375.6875 715024.4375 5007951.5 605474.1875 1549304.5 208602.1563 1449718.125 1081508.125 359898.5938 1474019 711320.125 4920667 145476.3281 755102.625 257235.3906 4087928.5 12132815 238303.4844 2832392.5 4666849.5 801927.4375 744668.875 2253127.5 351975.625 1264073.625 5783373.5 991622.4375 1497530.375 88348.7031 2270268.5 258806.0781 4120223.5 276196 251700.6406 1900914.75 3235627.75 894210.75 1761589.875 245247.4219 2456553.25 2312465 1474019 2693733.25 650346.5625 2529953.75 853992.5625 3274063.25 2140997.75 985897.375 1326910.375 1012439.188 472111.125 1011039.938 883735.1875 1095798.375 1435579.5 1613593.75 2152535.75 903306 1527320.875 1764326.5 2441768.75 2065408.125 911046.875 1109731.5 1827601 1466189.5 824669.3125 264098.1875 1141635.125 1090657.625 1828254.125 810489.125 1158206.375 1867436.75 2186800.5 2769314.5 742309 1392950.375 2064282.875 1837008.875 8614438 3001687.5 2587918.25 2852269.5 12485736 4781461.5 1136652.875 1537658.875 711432.125 6671782.5 1042115 1538716.5 1778598.125 1351118.875 600169.75 6484654.5 3087330.75 1489986.375 802215.875 130115.0547 847751.5625 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1723552.375 8217052.5 6865458.5 9169414 3160284.25 5565520.5 2542750.25 2778545 2320822.75 627446 6019006 6994965 856412.3125 1408656.625 4402408.5 4901700.5 7924107.5 681916.5625 167169.375 1317702.625 6442471.5 1582975 4716845 4869697 1799171.625 322555.4688 470420.125 230831.3438 2041648.625 8002772.5 3124005.25 1201996.875 2234980 1822462.125 1491333.125 3181645.75 1406654.5 5265529.5 880760.125 1962954.75 282606.4375 4459659.5 1367218.5 7182663 1809615 3477738 821058.0625 1151855.625 2640956.75 806697.5625 1296417 561591.5 2362178 2605604.75 3152739 2187104.75 4078265 4132428 6256870.5 3281515.25 251666.7969 6215477 897214.5 5144473 861071.4375 4129729.25 1237120.875 3526669.5 3436583.75 "branched-chain, straight-chain, or cyclopropyl 10:1 fatty acid (2)*" 741900.6875 263522.625 1334271.75 391519.25 273425.0938 944768.625 366543.0625 331834.5938 837181.9375 538447.3125 788628.9375 858737.6875 635406.5 739710.25 248615.5 1287638.875 441832.0938 1450462 113485.5 1453204.875 795394 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3542933.75 784571.6875 461457.125 225066.8594 630938.8125 238441.6094 1617829.875 746117.25 182575.8281 253799.9063 795394 571822.4375 476002.25 1272449.75 1048939.375 1392984.5 501458.1875 3362536.75 825104.5625 579411.3125 628836.875 1130442.125 928239.9375 287631.7188 343335.3125 1910542 1610866.875 477224.2813 532717.4375 2243767.5 323091.1875 795394 428121.2188 2675414.5 1489194.625 1111047.25 548622.9375 1079875.75 612974.625 "3-bromo-5-chloro-2,6-dihydroxybenzoic acid*" 1081578.75 1343322.25 4222749 871769.25 1779176.625 2401791 1010622.813 4502992 3341806.5 825476.6875 5724770.5 3524900.25 6314051 1752408.125 697910.4375 1426798.875 3185810 711853.1875 2727302.5 941670.625 2821441.75 1729698.125 521037.0625 1943857.375 976542.375 1537825.625 2958297 1672542 1710176 1725759 959212 1855774 2884974 6146689 1386854 1589704 4363633 3762359 1191546 2944647.5 4492893 943384.5625 1441215.25 2443185.5 11650517 424397.7813 1281024 660246 215318.9063 1844951 1449765.625 999598.625 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2785076 391341.2813 640455.3125 277105.625 197989.4688 1067202.25 2144907 3716596 1420091 976128.0625 481771.2188 5562687 3247922.5 44693.3867 956357.0625 1027977.375 1015606.625 1532726.25 854298.9375 1522353.25 126682.8594 575240.625 988837 145993.75 717513.4375 876174.8125 272800.75 1363632.375 500965.9375 266291.9375 135681.5156 1163178.75 1895933.5 1154003.625 734083.9375 525766.0625 5924005 "branched-chain, straight-chain, or cyclopropyl 12:1 fatty acid*" 2067366 6868511 2740124.25 1009712.875 321728.9375 1652980.625 757094.125 3905714.75 1235445 4030944.5 1159334.875 8725525 438964.4375 1572787.625 890179.5625 2807187.75 1099651.75 1446541.25 4249025 519252.1563 3086210.75 5493500 1754919.625 1712873.5 898436.4375 5782882 14223790 6579104 1719043.875 2900119 881077.4375 191893.3125 6511402 1582456.25 1608749 2531304.5 1338481.375 8040778 431104.3125 2408316 1155354.625 7120421.5 1088320.25 293227.0625 8082475 550235.1875 4603352 1006038.563 5107713.5 400958.0625 9512091 49760908 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5687168.5 6785715 2803630.25 3600073.5 3172005 3258223.75 5842815 3027748 6022962.5 11928436 9179959 9759381 8291483.5 11516599 9770144 3546348.75 19636804 204549.9844 3376199.5 6737919.5 6219870 4062222.5 1611809.5 7559398.5 2328255 4272528 2144168.25 11500677 4189931.5 1725903.25 3544725.5 1541913.125 8505280 6014525 2968241.25 2569486.75 4810006 10402941 735802.25 3405059.5 10140343 2165288.75 3414530 4479034.5 6277771 4930838.5 7221955 1452743.25 4295903 4204198.5 5394061.5 1950880.875 7618233.5 1727813 7947382.5 5661923.5 3739773 1353753.625 2237083 5396197.5 3015657.5 11265898 2480479.5 103896.7188 6943877.5 6073332.5 2919610.25 7655813 9855940 5625628.5 873610.5 1364986.875 1616430.375 1452554.125 1759388.875 9055100 7776575.5 16797346 3914171 10139427 19985636 2822448.75 5966334.5 1371451.25 5911517 5506326 1659501.125 1884639.875 7635992 8211875.5 16587356 3356507.5 665894.9375 3432017.25 10368308 2167175 4831319 4733020.5 4709801.5 1280138.875 678139.5625 4550998 3630261.75 5084755 2098793.5 9834441 5335784.5 5147649 9749207 1497385.875 34370132 3990524.5 2898898 7337843 10298618 7894673.5 4870325.5 5231805.5 4515016 1836648.625 3770134.5 9778432 2833838.75 3509831.75 1988587.125 2275143.25 6128551 2308044 4608620 7220795 10393978 11933983 12762363 2631121.25 7392257.5 4569096.5 12990674 6125553 3714277.5 5126077 decadienedioic acid (C10:2-DC)** 451742.6875 392376.4688 442515.3438 574412.875 470106.0313 352898.0938 305722.5938 1634932.125 889342.875 1230951.75 376711.2188 1195944.125 263344.6563 200441.2656 224623.1563 1567824.125 495979.25 1619330.875 591009.875 1033367.75 2257735.75 4753780.5 1735103.75 832511.9375 879273.5625 3509574.75 2392942.25 1211406.625 623280.0625 714419.875 168018.0938 819443.875 3302856 1263859.75 1246847.625 246641.0469 1504744.5 1216613.375 610037.4375 784103.1875 1673030.875 887287.0625 3820096.5 2806449 346089.0625 2776043.75 75575.9609 440648.3125 490645.75 45841044 27972046 1358164.625 41851588 18812198 29083228 121457.0156 2378316.5 1394193.25 31554984 4580827 451028.625 15480522 588662.6875 120920480 140525.3438 2806449 438706.2188 1510457.125 2965395 20480202 1132108.375 1507511.75 914024.9375 42696484 9099983 466662.4063 2719076.25 1519138.375 8438528 18059846 23388552 11537395 3007927 296960.875 5254442.5 243925.9219 6652035 873971.5625 1409990.75 1955723.125 131558.7813 2541431.5 3917417.75 8232922.5 10370703 65035708 45057544 16444071 317608 2540467.5 1016395.25 6741415 1567119.875 340410.0938 4165720.75 4114001.5 1156665 1525292.875 1001275 3725470 32630986 3199769.25 524315.875 693545 7461269 11297471 11009611 2317424.25 2153047.5 6583853.5 73695600 158842.3281 19502688 26709080 2689116.5 770008.6875 4741871 12565890 10919165 606873.625 16070556 2548140.25 4789495.5 2276296.5 758850 7009958 472562.2813 1682303.875 52577596 2893053.75 2572582.75 4290434 9154266 453945.8125 567190.0625 1062701.375 3219915.5 13345689 808618.5 4123559 1882893.375 3563442.75 11106219 84335040 6409769.5 638952.9375 3965835 4941198.5 362091.7188 2033792.875 511080.375 4966258 1081245.125 40817236 2494164.25 13030525 3470471.25 2025865.375 180184.9531 819200.3125 4677221 71175880 18908874 88645.9297 781982.1875 2836854.25 1883116.75 433145.9688 3902019.25 503302.4375 28321604 1566782.625 38747016 7277748.5 5323206 6894966 1768346.5 20079190 9559357 1718060.25 13544473 1387016.375 7615526.5 1303556.875 118448176 829267.25 18273502 46962864 230386.0156 190781344 463404.8438 4955797.5 2770590 389362.5313 859671 245126.875 656322.125 11011489 8826421 4741522.5 2677151.5 5341315 25430396 12126413 151614.4531 1242357.625 10035900 3680005 2270756.5 3105484.75 41480840 3999617.25 4240191.5 2377352.25 9221048 35368688 9352880 6820869.5 2606479 9428699 2806449 13680118 45498728 6547256 1883509 33428830 141853232 1374672.625 1256868 62012312 15488923 4318138 6093835 2308669.5 28343416 17234146 13829260 11150552 895047 25618404 84488112 41421388 862506.25 4124613.25 1813010.5 27430610 4587104 4293352.5 1530133.875 575228.125 19281760 6230246.5 3043885.25 7553016.5 16621577 58576920 6084799.5 3477317 599566.25 59347072 1809694.875 2154234.25 1259202.75 10095127 4009860.75 1370730.25 1404845.625 745610.0625 1863343.25 6823587 6676250.5 18247966 19885704 3234581.5 4571803.5 29216212 11146899 1727973.5 4453385.5 16164834 44989444 2479874.25 2697018.75 3775154.5 1587944.625 117670632 19325552 deoxycholic acid 12-sulfate* 397004.3438 3330181.75 829244.25 6079325.5 540005.125 7558044 609766.1875 195480.1875 150185.8438 3522596.5 1888881.375 2937476 192852.5 192883.2188 378374.9375 69187.2734 337382.5625 429175.5313 4370661 276816.7813 129017.3125 474591.1875 5725398.5 337113.5938 295376.8438 886912.75 4055831 815261.0625 1749379.75 406595.7188 39122.2695 4930988.5 842202.9375 1266328.375 846279.25 1461807.5 1018230.063 1610610.625 381100.125 722412.3125 1096865.875 1953548.625 1085842.875 2186199.5 6828045 3833374.75 5539102.5 102953.3359 1386830.5 344063.5 3904090.25 3599826.75 1471761.25 94673040 219766.8906 17703062 204031.9688 2076901.375 1000131.563 251047.7188 2865505.25 570603.8125 5930771 4006268.25 188689.7813 13077474 11014042 9042164 8924943 315909.4688 416434.4375 4211578.5 318166.4375 150512.5 593284.25 486890.5 1345613.375 240192.8906 2631344.75 8788201 2627510.75 2269322.75 8623306 220338.7813 911830.625 1152664.625 5165322 683130.5625 298334.875 817988.5625 11689043 339553.5313 5291982.5 1293949.5 67210.8828 2098046.75 480449.2813 4317454 1279226.875 10451681 20061650 748335.3125 27659026 2596160 7234022.5 39562912 7354268 757987.875 914562.8125 8407802 462617.6563 3029870.75 831784.125 1900962.375 709561.0625 8103225 11473306 1119733.375 10767116 39192912 163300.4844 1261126.375 19497110 6158850 188756.1094 2169852.75 3831437 2040310.875 3493595 4731267.5 100299 8517656 10549274 3319813.5 3734505.5 1250226.375 1113066 67663.3359 5091702.5 424302.6563 1090135.875 23987186 85089.1094 677975.3125 121910.625 211093.4688 435792.1875 173884.9375 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6164057.5 6771636.5 853275.6875 68272.2656 918653.5625 2291987.25 2047694.5 845233.1875 907377.4375 148530.2188 1370689.5 935594.25 1836226.25 347555.375 1411906.625 5284035 79435.0156 218632.6719 2764444.5 47156.4414 458347.7813 431011 GlcNAc sulfate conjugate of C21H34O2 steroid** 430844.0625 1024375 74479.3203 205445.7344 415709.4375 289160.5938 114604.8438 63886.8711 87839.4609 1024375 489749.5625 437842.5625 358075.6563 145634.625 3988337.25 4566567.5 429818.0625 481260.9375 10999340 778977.3125 216006.2344 2783620.5 1290924.875 1873834.875 8144669 1007241.063 2103934 7343144.5 1168846 776067.125 5020795.5 746690.125 1398639.375 444580.25 2344802.25 1677401.375 1511367.75 2006037.25 574514.8125 5661100 1637248.25 284242.75 1373508.75 707713.875 1913051.5 482254.0625 508831.2188 2976448.25 2181076.25 144683.6406 2050953.5 2998361.75 1262234.625 154979.5469 111861.5625 385102.9063 1860142.5 213333.5625 2177815.5 1607626 380451.9688 1640929.75 994362.375 7961283.5 791389.375 280084.6875 3509414.75 1581400.25 386709.375 1689387.375 1104313.625 2840772.75 1167570 655111.25 1236861 1976391 388268.75 1195177.75 1341808.125 360199.6563 275772.125 427837.4063 399597.7813 2103378 1886693.75 2312564 855159.4375 984543.25 78047.625 2895561.5 215985.4844 2607753.75 1438233.875 410821.9063 530127.75 170000.2344 4026746.25 6994664.5 328936.4375 1515043 1816143.375 753252.625 1160013.625 437531.2188 663233.3125 352128.875 13014182 32098580 86906.7188 735973 2294682.25 1423963.125 2822034.5 4763590 323916.7813 1091467.25 12932711 555687.0625 1891389.75 693568.8125 5970272 210361.2656 5022563 21790358 3277038 2859850 777443.3125 6423822 413857 1352829.375 1064206.875 2715201.5 288018.25 3156027.5 2044024.75 269098.1875 944436.375 203031.9844 6965021 872626.8125 9848021 6267207 338380.6563 21915766 1085754 1024375 741246.625 829106.25 448334.875 7854966 587467.5 604759 366766.7188 386370.625 5995955 173873.5156 3159399.5 867813 205776.4844 242493.4688 396560.9688 "cis-3,4-methyleneheptanoate" 403171.5313 202247.2813 154195.8125 159723.6094 248032.9063 260093.3125 163475.6563 317241.4063 128493.5469 152298.2813 146124.5938 76675.3828 1562524.75 393893.0625 526035.3125 124492.3438 487332 839734.25 208163.5625 153361.9688 362375.1563 868070.6875 803930.875 205746.1406 116994.7656 474955.9375 96755.7813 288251.125 106472.1328 288510.3125 136884.4063 124295.3516 889629.25 195018.5938 538312.3125 271784.2188 246705.6719 157890.8594 588439.875 291791.7813 74113.3203 122136.5156 205387.2969 160120.0625 80969.8906 101544.0234 303933.0938 76530.3203 140604.3438 121420.9766 114603.5703 128379.2578 122261.75 245674.0313 221924.6406 81622.8281 109033.7734 644506.4375 607934.375 168134.3438 138208.4375 430277.625 560309.9375 530229 100610.1094 109422.5078 109275.0156 207271.4063 147498.3281 149404.5625 376274.5 475415.875 266880.7188 152294.5313 80994.0859 416722.7813 129226.0313 125217.3359 117489.9219 357350.9688 300221.5938 321822.625 115953.6875 819515.75 68464.2266 293964.1875 157334.4688 496588.125 758218.875 78944.1094 452726.125 180926.3438 74112.5391 286884.4063 103555.6484 165805 44883.0625 294050.1875 84839.2109 141409.6563 202298.6875 597307.8125 110977.8828 42885.5469 132783.3281 109348.9297 127586.0391 161074.8906 175041 139751.6875 98231.0547 326485.4688 154572.3906 375420.6563 427198.875 195446.8438 409072.4063 557822.5625 209692.5 130042.7969 405555.2813 90395.6875 140706.8125 171349.5938 70292.9609 1337331.375 163843.0938 850881.6875 97630.7031 2422785.5 92787.8984 30479.8848 134836.4375 71650.4219 310335.25 167766.9219 126255.2188 215165.3906 93978.6719 107612.0547 109110.8203 133665.4219 319374.5625 159371.5625 115702.875 180601.1719 167568.7344 139073.4375 387041.875 492980.6875 476354.75 212212.3281 126984.6641 378865.0313 242543.1875 77816.6094 40713.7578 931114.3125 32113.9609 465803.5 147993.3281 110450 94933.9219 105386.7578 468231.9063 122866.5859 57652.6875 460979.7188 161460.0938 318831.4063 172238.4531 169867.1406 268593.5 54260.6367 792868.5 81935.3281 80140.3438 133548.3906 213354.4844 629870.6875 32908.0352 184587.4063 294109.3125 244182.125 46806.1016 164041.2813 90607.6406 418664 207808.4844 120464.8906 310221.375 139989.9531 184829.0469 101698.8906 188719.5781 4-chlorobenzoic acid 220899.3438 261818.4531 170254.5 159401.6406 182647.5156 226687.1563 162525.0469 122957.875 145530.5313 128673.5313 191662.9219 270790.875 182524.4844 144055.25 177983.5156 174759 187265.8594 216776.8125 168454.9531 177261.875 179479.0625 188806.1719 209807.4688 137353.7344 168107.7969 153581.4688 160686.6875 171124.0469 165348.2969 161812 163496.7031 192645.7656 201505.625 202712.0625 202217.9219 147877.5156 203751.5938 196506.5156 227289.75 166634.9531 203880.8281 191862.5938 151708.7969 138866.4844 171492.3125 195116.4219 178017.6406 181097.625 160448.9375 205140.1563 181991.0156 159541.8594 172827.2188 202465.2344 163397.1406 149860.6875 193296.0313 199399.0625 157347.375 152124.75 182239.9219 198957.75 119768.3438 216488.6406 222169.9375 1829650.5 130350.2656 243217.8125 175173.6719 184079.7031 159489.2031 147421.5313 146923.7344 176117.0313 258201.9375 163164.625 191901.7031 158430.7188 450791.1875 226632.6406 138924.8125 219764.6719 238613.9531 167416.7188 140529.0781 159747.1719 215490.2031 156026.9844 164957.5469 213987.2031 208572.1719 217000.6563 187516.3594 171204.0469 198432.7969 231448.6094 174496.7813 240192.6406 163248.8281 164103.7344 159253.625 182683.3125 157354.1094 182094.9063 139709.3594 189838.0156 183454 167401.7969 232548.6875 171176.3281 260069.5 173873.2031 162108.25 174695.0469 188960.7188 236114.2969 247989.0156 326780.125 199263.1563 207972.0313 232300.3125 169527.2969 214055.4219 382606.3125 336987.7188 173631.2344 241277.7813 174515.9688 196046.125 210382.1406 260588.6094 179533.2813 171826.0313 222756.0469 239332.1875 246725.1406 301408.4375 299730.6563 188022.625 172128.2344 144104.8281 145566.25 209709.5469 503206.4688 82438.3438 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205903.3906 186321.8281 288144.4688 273662.7188 168879 149282.5313 192265.8281 170597.2813 161687.6875 225081.6719 183491.2813 184311.7344 222035.1563 202905.5313 215798.2656 188070.6563 265218.4375 207913.2813 132201.8594 162783.4844 184361.1406 387931.875 194461.9219 153862.0938 151744.7813 232927.6094 175204.8438 176477.4375 179990 178780.8594 248771.4375 169878 165387.1406 294565.9375 179018 194525.3281 183454 150661.3125 173612.2969 174699.6563 199830.875 183378 189336.5938 155519.1719 135747.0938 196531.7656 190786.3281 143346.8125 110876.2813 247337.4844 1048243.313 184260.5 191813.4844 190586.3438 182101.2969 143375.1719 182365.6563 196867.9844 149268.7813 166938.8906 167401.8594 105730.5469 148605.1563 204313.5156 167626.8906 2-methoxyhydroquinone sulfate (1) 144698.9531 437964.875 24727.8867 31384.334 132251.2656 402186.8125 175629.2188 221703.1563 221335.3281 178175.5313 171644.2813 313670 88395 173005 60192.4531 337762.25 122942.9063 81886.7188 722558.8125 235075.0781 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95022.6719 906147.8125 466679.3438 610888.5625 257133 828123.0625 364974.8125 523929.8438 3220430.5 329184.3125 244855 76150.0313 536257.1875 162333.7969 2971330.5 314758 598425 189163.3906 1416615.5 378401.2813 768553.6875 85701.9922 176602 288583.9375 415618.375 1661614.5 270736.5938 177201.0625 33484.6953 189075.5 262251.0938 354304.4688 244855 487012.9688 314303 333665 244855 2-methoxyhydroquinone sulfate (2) 50155.6367 124254 90747.8047 71016.375 40996.0586 33649.9766 146022.4844 79406.0469 47754.9141 337053.9375 74941.9063 87867.2578 235250.7813 109623.3828 124254 314340.5938 75428.2656 115591.2031 74569.2578 124862.9609 128682.6641 75014.3438 115090.3047 147439.75 147475.4219 99454.2344 107171.0469 1036317.25 225901.1719 81071.5625 50829.293 86518.2813 169248.9688 116413.5625 199483.9219 467326.1563 69464.0859 333169.9063 604612.5625 146035.4375 44987.5508 47711.918 95330.25 299574.5625 69419.6875 155159.8438 793940.75 132829.0156 126793.3828 60332.0703 124254 59418.1641 265091.5 268782.5313 1408560.5 107243.0547 66182.2422 176082.7031 177676.9844 142203.2969 132094.4375 29044.0898 261912.9219 141338.6094 88569.5469 934485.6875 107083.8828 113313.4297 94984.9922 1721468.125 229836.0625 528750.625 1193321.5 251179.6563 297137.25 81362.8438 784427.5625 102738.2344 82153.7266 201257.75 73483.3125 160714.1094 93900.7813 124254 244211.8906 122692.6094 "2,4-di-tert-butylphenol" 45388704 46164500 34611420 59566212 39960600 64982024 54149324 28486626 32492868 55496416 133182472 38538060 52458464 30074650 35745836 53503840 49177076 57930660 98100448 25079866 92794680 22642450 60639684 40856384 55686560 87226544 74170688 44373920 62330592 21053046 44402248 24483584 41756476 44555736 35980180 52660424 59584128 93319920 37912208 20965344 30576756 42845328 38679472 34900172 56874128 47288876 47731908 46415984 69765912 33957244 30329856 44571532 37143208 37831836 47233388 9244077 5682730 39077272 22033618 10802031 37995464 19183106 15135055 4301193 40220100 16525592 36888800 13823892 75471320 17619264 14810356 42347748 35377392 18051670 26558296 72609520 28473358 37316928 21233858 36931012 68992800 17531952 24802342 42784088 13298055 58730592 15031557 72175248 13922449 55152412 48826332 98142512 14976700 70359568 47343344 59117032 16649827 31129530 51057688 15972054 11013136 27317266 26781580 55912728 52154216 15569727 25813584 32235944 37201924 52827780 239699600 36275992 40596776 127049376 9804155 15277373 22686636 49080724 34598356 20597678 9049112 79039632 11213015 49402792 40405564 20267532 21768018 19601808 74597848 90090048 23513084 38149048 28242100 34549988 37998212 29288738 42613464 29775324 32423966 64181480 17743120 36814740 28822774 43058028 25021174 20286232 28183044 32909222 20873912 27463104 23108448 43501820 24359514 21384926 32878618 29628890 20584390 22729848 21113092 14220505 28486048 15492657 36004780 41748440 24110996 35890228 17759102 25006558 22961960 61443296 57414800 24855240 21475320 102518192 40089300 27135672 114533584 35008752 37950704 26266200 32010358 27656472 26359002 17807662 45210364 38801664 21066102 29824696 21194434 30687548 35232400 25234896 26057324 25677996 33930932 42318508 20805938 34361456 14363749 26078232 26378722 26849902 21477470 57379096 34101600 36215948 48136380 7339451 24650264 29734234 35327456 54264876 36130664 11009508 23617378 47378600 22614386 19386538 32235944 52140108 17697096 35536424 76623264 20427072 29570580 55933776 23631216 21906218 7294230.5 16967942 16622562 22825868 33508592 39188124 20772604 38619324 29619050 81004824 36512056 38511176 22448162 33038514 37346044 29493718 34574940 54266252 46406368 11465851 55012404 24211810 10832996 28870864 38775388 28747350 26297724 57495164 40281904 34940532 31185862 24172770 25143992 17296006 25883852 42581540 24187680 19540656 20711838 29890654 40368616 20918484 18055926 56864528 39889552 43029300 28801144 23768700 22486722 32235944 15207354 9863990 46088284 12390828 8223736.5 5394472 30030926 18519480 34142036 20081354 62407836 48604248 25753668 27580862 7268561 37706296 27984612 24445660 25582974 32235944 48083528 10493434 "cis-3,4-methyleneheptanoylglycine" 38604.7695 36885.7305 54061.3984 326046.6563 50296.5156 57893 39917.5352 45629.8516 24869.6777 70606.0391 16452.3105 40319.0117 21131.1172 34907.043 32959.3203 27205.0879 42004.4141 296746.4688 57536.9492 98158.3047 142532.8594 83658.7734 61724.6016 93036.4766 364954.625 55696.4648 58652.8711 74033.0391 64127.0352 246347.3594 139851.5 36752.5703 102893.8672 46667.6914 66250.7578 94947.6016 237898.1719 126764.1797 369523.7813 40824.5195 36935.8281 26837.3086 33186.3789 80211.9453 345848.2188 51114.8008 37323.9844 37746.4766 98918.2188 34939.5234 34206.3281 92573.4141 443599.7188 45179.957 330965.5938 253646.5781 95748.6641 32813.9727 27793.9082 49535.2383 58249.0508 124488.1719 23708.6973 74020.6016 493216.9688 26513.4668 91665.8594 "bilirubin degradation product, C16H18N2O5 (1)**" 309681.3438 206653.3281 197365.2344 144652.2031 319814.0313 450853.0625 117436.6172 380405.9375 619671.75 215068.0469 197022.0625 728448.3125 501986.6563 228613.2813 514463.6563 372871.2813 426309.3125 556597.5 800450.8125 415068.8438 377216.4688 840261.875 156469.7656 187348.2344 303687.875 903244.0625 202620.7969 199769.5156 308226.3438 759891.25 59111.4922 372766 696651.875 777762 180457.7656 186179.1406 176209.7656 298027.625 256544.25 297185.6875 192630.6094 2315113.25 889854.25 1404419.125 103470.2266 112919.1016 1869437.875 253310.8125 2219474.75 1906658 167746.0313 662802.3125 141520 1945149.5 462932.2813 749689.125 239685.0781 211273.4688 54137.9805 208037.5469 1910571.75 485260.0313 422035.5938 261311.125 2147369.5 6478603.5 365992.7188 759215.375 839983.4375 298256.7813 718398.25 194716.6875 3601079.5 302237.3125 162152.9219 3034414 139721.4688 810454.4375 1580055.125 79438.8438 1049648.75 3496247.75 196887.0938 3593580.5 572761 889767.1875 755334.0625 239877.2656 541912.5625 516396.25 270967 462502.3125 728576.1875 171791.8125 6072060.5 735654.9375 220811.3281 161971.4688 66995.7969 761644.0625 344365.7813 234251.9688 1014844.813 4025228.25 2905601.5 4412779 2353657 1435768.5 935250.5 5287464.5 3319089.75 89929.6172 1381249.75 173475.0156 3142538.75 662634.25 139585.5938 861909.9375 329396.9063 516786.75 663748.1875 530888.5625 192559.4063 3316635 315474.1875 247827.2813 3335882.75 887138.25 488761 206866.4531 517137.5625 1614648.75 1707349.375 300198.8125 2080568.875 1362917.25 125136.7891 445499.2813 209738.2656 99446.3516 170240.5781 433284.875 523078.7188 178893.0156 1316135.875 3698117 312098.2188 674318.625 204112.9063 1797229 1103007.125 535970.5625 397546.375 604869.625 88226.6875 305258.25 909860.9375 258535.8594 248816.875 185710.375 587975.25 864670.375 1098275.75 468960.1563 5548524.5 335853.7188 934348.75 336246.0625 2247150 504839.0625 803134.1875 366107.2813 344553.3438 821443.4375 351311.7188 72283.1016 596345.8125 900254.5625 515309.5 556350.75 605110.8125 353397.6563 1537764.875 107873.7031 4262825.5 861649.9375 132687.625 102531.8281 994284.6875 492934.4375 256031.0781 520034.4688 208272.9844 740725.5625 1388535.75 90786.3984 974286.9375 7349376.5 630713.375 821943 407539.9063 249026.3125 138707.7969 983985.8125 457129.0938 4553789 2327416.75 842655.375 570402.1875 682351.5 189390.2344 6520932.5 800381.5 941032.0625 244999.7969 1207171 2745096.75 679423.0625 786915.1875 3135008.75 1181383.25 282304.3125 208556 485275.6563 385161.0938 236184.4063 1383759.5 358635.0313 184801.375 206440.0156 82034.2578 470850.3125 951279.75 638912.375 1623625.75 329491.3438 492261.9688 2006490.5 186625.1406 811619.1875 163842.3438 98059.3047 484587.5313 528721.0625 203671.4219 66591.8438 1544997.875 488761 508047 80512.4453 235780.9531 569982.0625 1414286 1022410.75 332475.1875 463971 437592.9688 196971.4219 117078.5469 1418278.125 155906.125 51706.7422 "bilirubin degradation product, C16H18N2O5 (2)**" 228903.125 338631.0938 530658.0625 388859.6563 472547.125 413284 154641.2656 334505.0313 413284 133873.5313 373708.0625 557935.5625 251806.3594 162752.5313 604703.5 455962.0938 303889.8438 516069.75 369536.4375 388934.2188 554505.0625 676839.5 528651.25 209208.5781 361755.7188 481743.8125 846284.1875 198970.7344 303616.9375 396469.1563 1024324.563 246118.5781 286199.9688 350015.5 855230.9375 106402.8672 158286.3438 474110.625 806898.75 944172.375 424271.6875 305193.5625 413284 346053.4375 407755.9375 528199.25 361711.9688 330651.4063 152084.6875 223344.9219 1588527.75 385843.0313 148588.4219 818214.8125 198262.2969 261055.7031 374807.0313 205809.0781 1027044 290864.5 161954.5313 1452528.125 1215254.75 456378.4063 416822.8125 181269.6094 1034620.125 499034.3125 404919.4688 228840.4844 223925.7344 76740.3516 118887.9844 835418.375 454919.8438 283832.0313 185641.9688 1340750 2411826 149025.25 385229.9063 549500.5625 281391.25 470038.9688 207087 1656371.125 270310.125 179531.4219 1504942.25 193131.0781 361992.8438 884470.25 31942.5742 671936.6875 1235439.125 153166.9688 1616791.875 483286.3125 544482.8125 598873.4375 157645.0156 471442.8125 500676.0938 175412.3125 323004.4688 736821.5625 216689.2031 2663070 723382.0625 141060.875 188834.5 88557.2969 622678.1875 323340.1563 255309.2969 435035.4688 2013887.125 1386733 1977393.375 1138649.625 1181548.25 670747.5625 1629764 1494205.375 106406.3516 752146.125 155600.4063 1443254.625 464642.9688 70982.7656 70507.4375 669629.75 413284 418995.5938 515289.4688 683017.9375 213817.8594 1502970.375 297204.4688 160336.1094 2168438.75 640952.8125 747028.75 224117.2344 257839.75 532941.5625 1181266.875 248079.1406 61041.5039 915936.6875 332887.4063 1204380.75 687300.9375 183229.2188 327671.5313 209644.4219 88023.6094 192689.6563 481372.0938 530524.8125 287466.4688 1895612.125 1650097.5 509898 148833.0313 654993.75 270557.75 1537068.625 878803.5625 570061.875 107355.2266 613958.125 120244.1797 413284 682975.125 303882.3438 321286.6563 277032 573627.625 569264.8125 999657 253854.8281 3447422 455169.9063 760728.5625 72369.8281 256697.4688 1558184.875 415471.2813 436520.7813 369130.4688 341953.375 821743.875 140072.2813 132986.875 483772.375 507687.0938 597766.1875 175967.7969 581040.6875 277402.125 1072409.375 229615.1719 3051195 959753.0625 416297.8125 220550.125 961673.1875 344546.875 134563.0156 92426.1563 174111.1563 340605.7188 610340.0625 240065.8594 452778.625 970586.9375 158611.9375 89114.0938 905899.375 2346853.25 653051.0625 773575.125 793821.3125 976729.75 143338.125 153541.8438 908755.5 369716.5625 1737329.125 1640967.5 945187.875 477517.0313 648794.75 251762.3438 2949282.25 356083.5313 1198279.375 235982.9063 1692876.125 1975107.75 118215.8203 141728 749294.8125 414490 1594256 522621.6563 228949.4844 258972.4375 447897.3125 293109.1875 157873.6563 294055.375 664069.5625 144141.7031 119271.0547 227489.2813 121575.6797 311140.8438 1375974.875 791583.375 1066267.375 265219.2188 476271.8438 1292553 139125.2969 422646.9063 165871.8438 123837.8672 567861.0625 338096.9063 508076.6875 278427.5313 2150763.75 704159.9375 671004.625 283100.25 548614.1875 874505.875 61339.8711 139163.5156 43080.6992 1643692.25 330890.8438 535706.9375 751415.1875 346169.0938 527703.25 50114.668 401913.0625 144974.6406 177330.4219 77840.2891 1584129.125 110067.1563 118558.5234 39745.582 "bilirubin degradation product, C17H18N2O4 (1)**" 1073003.75 1198296.125 1379941.75 729372.5 1320764.5 1011758.75 498385.8125 1027325.75 1297371.25 334752.8438 805958.6875 1330680.5 564598 441356.5 1310009.125 590005.9375 611413.25 964023.875 727910.9375 788461.75 1184585.375 922026.875 2033604.5 687454.6875 1560227.25 1729305 2311952.25 490234.3125 657692.25 1068134.125 2130347 642916.875 651945.8125 743663.8125 1952432.875 332934.6563 289851.1563 835500.9375 1405040.125 2745239 936172.1875 729372.5 992346.8125 762402.9375 945684.3125 1185725.375 927330.375 912594.0625 331594.7813 680844.9375 1826641.25 3210486 100662.8906 115841.0938 643319.4375 435147.9375 475462.5313 410191.9375 692414 276240.625 302053.6563 1927457.375 244516.5156 462512.7188 501259.3125 449746.625 2021575.75 344751.7188 588093.1875 389920.5938 371746.8125 162907.375 162318.5938 2933792.75 994011.6875 403478.5625 223102.9688 977315.4375 2174839.5 149784.6094 809424.1875 876409.1875 556773.4375 932264.9375 478557.6563 1720771.375 546204.1875 348771.5625 3225139 409645.5625 1818210.5 947816.4375 53865.4063 1000342.625 3769224.75 585158.125 3776955 729372.5 1239360.25 962795.125 232925.0469 712890.625 1101036.875 699639.0625 697193.5625 1152848 317219.0313 4041867.75 1482546.625 268710.25 258291.4063 115478.5547 821973.375 317736.625 490445.25 1116134 5752213 1487596.75 7733819 284171.3438 1852407 1048962.625 7523583.5 4662958 147261.5 1638031.875 151346.9531 2105518.75 696300.8125 50065.5313 322832.1563 1491382.875 612771.5625 1447167.75 570726.3125 1149351.875 348667.7813 2810348.25 360222.25 216424.6875 5907485.5 1186362.625 2071507.625 672548.375 729372.5 1175189 1837258.75 406189.8125 202043.9219 3340942 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250534.5 178134.9844 1479819.125 3385102 229117.3438 576357.1875 613898.0625 171241.4219 393585 2268906.25 221692.8594 1665669 62633.8516 378848.5 807454.375 55157.7578 453090.5313 1709271 162826.0781 1566735 301515 421316.9063 351331.375 224231.2813 301826.5625 230209.5781 95623.2422 211296.7344 345183.5 92329.0078 2464551.25 367966.625 164319.2813 177718.3594 366640.2813 182928.8594 120319.8984 771167.0625 1931793.5 1351148.5 1626347.375 1243064.5 718736.6875 646860.75 2821000.25 1447087.875 680205.875 115127.8359 1910408.5 316402.6875 134860.0781 746656 199881 519653.5938 280806.375 148259.4219 2735043.75 236494.6719 1706988.75 743316.75 301515 108151.2578 283723.1563 1203082 191429.1719 1201226.375 121749.8438 1017297.25 1201212.375 71838.5391 215333.2969 183153.7031 82938.3984 83473.3594 171729.2813 350936.9375 165692.4844 626585.125 1610107 219944.8438 354564.4375 305729.0313 1075999.25 693410.75 260591.2813 326847.8438 291462.5 61904.7656 217922.9375 703245.375 174980.0938 101691.9609 143173.1719 280738.3125 609809.125 461235.2813 435286.8438 3294492.75 206773.9844 609254.125 300974.5313 1439045.875 302055.4688 637712.0625 129277.3203 435050.4375 461255.3125 213137.3594 476253.1875 810008.375 302578.375 423109.0625 251030.1719 284852.6875 1005179.563 77279.2734 2674086.75 643298.6875 153033.4063 720737.9375 374833.6875 65059.4102 57186.7617 229117.3281 247767.3281 106171.9688 476407.4375 644109.5 483922.875 3323443.75 579460.8125 413157.25 245650.2969 382293.1875 203825.25 82152.2656 485940.75 387442.625 1973382.75 1263670.375 820901.0625 440930.7188 403914.7188 176383.6094 3970015.5 432604.0625 530627.4375 134752.1094 868488.125 1404488.125 331508.1875 539786.875 1456884.875 571786.375 312483.5313 95444.4375 526550 482230.8438 212593.0938 150171.7031 1084152.875 233936.5781 138127.1563 89844.7578 242885.7031 684946.5625 382406.25 1225527.375 212752.1406 259407.9063 882879 134848.0938 680087.875 95137.2266 117078.4922 270410.8438 291378.6875 219773.0313 945570.8125 311651.3125 316718.5625 289166.25 263958.5313 65682.3672 1035812.688 276328.1563 301515 194116.4219 733690.5 362213.25 330847 180914.9063 307538.1875 88827.875 580391.25 297089.0625 90576.0625 "bilirubin degradation product, C16H18N2O5 (4)**" 145782.4063 271518.625 157654.5 252329.4531 128939.9531 82007.2969 152233.0781 238351.9219 43415 158274.5 326645.75 145625.8125 81926.2734 326466.9375 240725.0938 172108.4531 248203.5625 171701.9844 193784.4844 296002.6563 300311.0625 206814.4531 151173.3125 175515.2344 264883.8125 456302.4375 112977.5781 150000.4063 193494.8281 589239.1875 102924.4609 166393.3125 191796.4531 464333.4688 51816.8867 71887.2422 265023.4063 432694.5313 588135.75 189264.375 127295.3281 244992.5156 226305.5 258248.5781 309938.625 199876.7813 181747.8281 95126.4453 99824.5078 852125.6875 230206.5 49898.793 514591.3125 101039.4922 102451.6797 199171.5313 98220.6484 755685.5 154666.75 101245.7813 948823.4375 488955.875 255938.8281 305204.75 101525.7656 539411 291014.5625 260949.3594 123235.9531 134804.5313 34614.0078 72757.6563 489069.9375 260740.4375 214103.8281 96814.8984 675761 1818131.75 104330.8594 230206.5 321357.625 193067.2969 256225.7656 81379.1797 904454.125 146041.6406 88731.7578 791367.8125 77001.7969 82727.1563 460365.4688 38917.7422 466340.5938 799379.3125 78750.8672 815127.75 278577.4688 266462.4375 355960.9375 103831.9844 216612.9531 283246.8125 101908.1328 209474.6563 429492.6875 123683.2578 1372500.25 399049.1563 82571.7969 96364.9063 34217.5859 361468.6875 160430.7188 165862.125 295564.0625 1065847.75 673614.8125 836037.6875 691413.6875 694676.8125 435225.4063 1198803.375 811063.75 48680.3242 393453.0313 79079.6641 817196.875 295091.9688 43342.0078 217684.6719 230206.5 102799.6406 364401.625 290855.9375 157501.6094 1363024.25 251039.8281 95506.4766 1363311 446348.6563 263486.7813 129494.8984 97222.2578 305087.1563 789525.4375 181766.5156 34815.1016 642531.1875 125348.7109 643190.25 351643.7188 96386.4922 128133.9219 145773.2656 68572.9688 104994.0938 294025.9688 237106.7656 148235.6563 906413.0625 973319.9375 234107.5156 94900.6328 390914.625 161612 662455.375 433504.25 264262.0938 95564.2031 376515.0938 70327.8438 238833.8438 296169.0938 132366.4219 154319 145273.7969 425850.7813 348757.1875 631017.3125 146634.125 2935163.5 251690.0938 597613.625 179113.2656 1336699.875 223913.3281 239794.2031 207631.6094 206349.3125 318111.8125 62574.8164 81533.2422 224022.7344 279398.6875 274334.0313 159378.2813 333547.0313 122475.625 582594.5 108524.4766 1672670.25 432982.7188 270732.6875 150432.9063 545392.875 230361.6406 69999.6484 46785.5547 111867.5859 197983.4688 368571.9688 136937.8906 202726.5625 684101.25 84346.2656 40941.4844 573725.9375 1063987.125 379566.6563 459504.625 354296.5313 509169.5938 101484.25 81837.2109 516867.0938 178244.9844 948287.1875 852930.4375 636731.25 265324.75 425186.3125 123005.5859 1669860.5 278570.125 604110.375 123654.8125 740241.5625 836050.25 78908.3594 111244.2969 447583.6563 257189.6719 814250.5 294889.7188 120869.4688 118346.9531 353815.9688 216719.8125 130222.3672 421446.0938 32874.6016 115745.75 61597.3945 217835.2656 656154.5 476152.1875 722986.375 125370.0625 365786.4688 810994.75 106477.0313 176503.9219 69346.8359 97726.1875 230206.5 66297.4922 187818.5 176533.7031 1454345.375 281394.2188 517373.9063 158648.5781 274204.5625 428327.1875 52292.5977 107855.3828 64412.5195 699759.9375 197159.8594 75928.7969 311073.8125 237516.6719 177799.6563 201166.5313 26158.5508 252360.6563 112095.2734 172227 58405.2383 758705.4375 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name cas hmdb kegg pubchem platform homocarnosine 3650-73-5 HMDB0000745 C00884 "89235,10243361" Neg "12,13-DiHOME" 263399-35-5 HMDB0004705 C14829 10236635 Neg 5-hydroxyindoleacetate 54-16-0 HMDB0000763 C05635 1826 Neg kynurenate 492-27-3 HMDB0000715 C01717 3845 Neg homovanillate (HVA) 306-08-1 HMDB0000118 C05582 1738 Neg cholate 81-25-4 HMDB0000619 C00695 221493 Neg 4-hydroxyphenylacetate 156-38-7 HMDB0000020 C00642 127 Neg "9,10-DiHOME" 263399-34-4 HMDB0004704 C14828 9966640 Neg linoleate (18:2n6) 60-33-3 "HMDB0006270,HMDB0000673" C01595 5280450 Neg laurate (12:0) 143-07-7 HMDB0000638 C02679 3893 Neg N-formylmethionine 4289-98-9 HMDB0001015 C03145 439750 Neg S-adenosylhomocysteine (SAH) 979-92-0 HMDB00939 C00021 439155 Neg N6-methyladenosine 1867-73-8 HMDB0004044 102175 Neg arachidonate (20:4n6) 506-32-1 HMDB0001043 C00219 444899 Neg 3-(4-hydroxyphenyl)lactate (HPLA) 6482-98-0 HMDB0000755 C03672 9378 Neg phenylpyruvate 156-06-9 HMDB0000205 C00166 997 Neg corticosterone 50-22-6 HMDB0001547 C02140 5753 Neg cortisone 53-06-5 HMDB0002802 C00762 222786 Neg deoxycholate 83-44-3 HMDB0000626 C04483 "222528,440355" Neg glycocholate "475-31-0,863-57-0" HMDB0000138 C01921 10140 Neg histidine 5934-29-2 HMDB0000177 C00135 6274 Neg cortisol 50-23-7 HMDB0000063 C00735 5754 Neg inosine 58-63-9 HMDB0000195 C00294 6021 Neg malate 6915-15-7 "HMDB0031518,HMDB0000156,HMDB0000744" "C00149,C00711,C00497" 525 Neg palmitate (16:0) 57-10-3 HMDB0000220 C00249 985 Neg pelargonate (9:0) 112-05-0 HMDB0000847 C01601 8158 Neg stearate (18:0) 57-11-4 HMDB0000827 C01530 5281 Neg palmitoleate (16:1n7) 373-49-9 HMDB0003229 C08362 445638 Neg phytanate 14721-66-5 HMDB0000801 C01607 26840 Neg riboflavin (Vitamin B2) 83-88-5 HMDB0000244 C00255 493570 Neg myristate (14:0) 544-63-8 HMDB0000806 C06424 11005 Neg uridine 58-96-8 HMDB0000296 C00299 6029 Neg 2'-deoxyuridine 951-78-0 HMDB0000012 C00526 13712 Neg malonate "26522-22-85-0,141-82-2" HMDB0000691 C00383 867 Neg pseudouridine 1445-07-4 HMDB0000767 C02067 15047 Neg uracil 66-22-8 HMDB0000300 C00106 1174 Neg caprate (10:0) 334-48-5 HMDB0000511 C01571 2969 Neg margarate (17:0) 506-12-7 HMDB0002259 10465 Neg nonadecanoate (19:0) 646-30-0 HMDB0000772 C16535 12591 Neg arachidate (20:0) 506-30-9 HMDB0002212 C06425 10467 Neg heptanoate (7:0) 111-14-8 HMDB0000666 C17714 8094 Neg caproate (6:0) 142-62-1 HMDB0000535 C01585 8892 Neg caprylate (8:0) 124-07-2 HMDB0000482 C06423 379 Neg pentadecanoate (15:0) "10002-84-2,1002-84-2" HMDB0000826 C16537 13849 Neg 5-oxoproline 98-79-3 HMDB0000267 "C02237,C01879" "439685,7405" Neg pantothenate (Vitamin B5) 137-08-6 HMDB0000210 C00864 6613 Neg N-acetylleucine 1188-21-2 HMDB0011756 C02710 70912 Neg N-acetylmethionine 65-82-7 HMDB0011745 C02712 448580 Neg N-acetylvaline 96-81-1 HMDB0011757 66789 Neg erucate (22:1n9) 112-86-7 HMDB0002068 C08316 "8216,5281116" Neg thyroxine 51-48-9 HMDB0000248 C01829 5819 Neg vanillylmandelate (VMA) 55-10-7 HMDB0000291 C05584 1245 Neg chenodeoxycholate "474-25-9,474-24-9" HMDB0000518 C02528 10133 Neg citrate 77-92-9 HMDB0000094 C00158 311 Neg "5,6-dihydrouracil" 504-07-4 HMDB0000076 C00429 649 Neg urate "120K5305,69-93-2" HMDB0000289 C00366 1175 Neg ursodeoxycholate 128-13-2 HMDB0000946 C07880 31401 Neg valerate (5:0) 109-52-4 HMDB0000892 C00803 7991 Neg 4-hydroxyphenylpyruvate 156-39-8 HMDB0000707 C01179 979 Neg butyrate/isobutyrate (4:0) 109-92-6 HMDB0000039 C00246 264 Neg estrone 3-sulfate 438-67-5 HMDB0001425 C02538 3001028 Neg dihomolinoleate (20:2n6) 2091-39-6 HMDB0005060 C16525 6439848 Neg glycerol 56-81-5 HMDB0000131 C00116 753 Neg beta-hydroxyisovalerate 625-08-1 HMDB0000754 69362 Neg glycochenodeoxycholate 16564-43-5 HMDB0000637 C05466 12544 Neg taurochenodeoxycholate 6009-98-9 HMDB0000951 C05465 387316 Neg taurocholate 145-42-6 HMDB0000036 C05122 "6675,46783527" Neg taurodeoxycholate 207737-97-1 HMDB0000896 C05463 2733768 Neg 2-hydroxyhippurate (salicylurate) 487-54-7 HMDB0000840 C07588 10253 Neg eicosapentaenoate (EPA; 20:5n3) "10-2005-9,10417-94-4" HMDB0001999 C06428 446284 Neg tricarballylate 99-14-9 HMDB0031193 C19806 14925 Neg benzoate 65-85-0 HMDB0001870 C00180 243 Neg 3-phenylpropionate (hydrocinnamate) 501-52-0 HMDB0000764 C05629 107 Neg phenylacetate 103-82-2 HMDB0000209 C07086 999 Neg hippurate 495-69-2 HMDB0000714 C01586 464 Neg 3-methyl-2-oxovalerate "51829-07-3,1460-34-0" HMDB0000491 "C03465,C06008,C00671" "439286,440877" Neg 3-methylhistidine 368-16-1 HMDB0000479 C01152 64969 Neg anserine 10030-52-1 HMDB0000194 C01262 112072 Neg tartarate "87-69-4,6106-24-7" "HMDB0000956,HMDB0062642" "C00552,C02107,C00898" "444305,875" Neg glycodeoxycholate 360-65-6 HMDB00631 C05464 3035026 Neg gentisate 490-79-9 HMDB0000152 C00628 3469 Neg paraxanthine 611-59-6 HMDB0001860 C13747 4687 Neg indolelactate 832-97-3 HMDB0000671 C02043 92904 Neg 3-indoxyl sulfate 2642-37-7 HMDB0000682 10258 Neg 4-methyl-2-oxopentanoate 816-66-0 HMDB0000695 C00233 70 Neg "1,5-anhydroglucitol (1,5-AG)" 154-58-5 HMDB0002712 C07326 64960 Neg 1-stearoyl-GPI (18:0) 796963-93-4 HMDB0240261 "71581135,42607495" Neg docosahexaenoate (DHA; 22:6n3) 6217-54-5 HMDB0002183 C06429 445580 Neg alpha-hydroxyisocaproate 10303-64-7 "HMDB0000665,HMDB00746,HMDB0000624" C03264 "83697,92779,439960" Neg isovalerate (C5) 503-74-2 HMDB0000718 C08262 10430 Neg 4-acetylphenyl sulfate 4684006 Neg 2-hydroxyoctanoate 617-73-2 HMDB0002264 "94180,6995013,5312860" Neg 3-hydroxyoctanoate 88930-08-9 HMDB0001954 C20793 26613 Neg phenyllactate (PLA) 828-01-3 "HMDB0000779,HMDB0000563" C05607 3848 Neg dehydroepiandrosterone sulfate (DHEA-S) 651-48-9 HMDB0001032 C04555 12594 Neg 1-palmitoylglycerol (16:0) 542-44-9 HMDB0011564 14900 Neg tartronate (hydroxymalonate) 80-69-3 HMDB0035227 C02287 45 Neg oxalate (ethanedioate) 144-62-7 HMDB0002329 C00209 971 Neg HEPES 7365-45-9 23831 Neg 4-hydroxybenzoate 99-96-7 HMDB0000500 C00156 135 Neg saccharin 81-07-2 HMDB0029723 C12283 5143 Neg 3-hydroxymyristate 3422-31-9 HMDB0061656 16064 Neg 1-oleoylglycerol (18:1) 111-03-5 HMDB0011567 5283468 Neg 3-methyl-2-oxobutyrate 3715-29-5 HMDB0000019 C00141 49 Neg 2-oleoylglycerol (18:1) 3443-84-3 HMDB0011537 5319879 Neg homocitrulline 1190-49-4 HMDB0000679 C02427 65072 Neg 2-linoleoylglycerol (18:2) 3443-82-1 HMDB0011538 5365676 Neg 3-hydroxydecanoate 5561-87-5 HMDB0002203 26612 Neg EDTA 60-00-4 HMDB0015109 C00284 6049 Neg indoleacetate 6505-45-9 HMDB0000197 C00954 802 Neg 1-linoleoylglycerol (18:2) 2277-28-3 HMDB0011568 5283469 Neg glycolithocholate 474-74-8 HMDB00698 C15557 115245 Neg taurolithocholate 516-90-5 HMDB0000722 C02592 439763 Neg androsterone sulfate 2479-86-9 HMDB0002759 159663 Neg indolepropionate 830-96-6 HMDB0002302 3744 Neg N-(2-furoyl)glycine "5657-19-2,5657-19-2" HMDB0000439 21863 Neg dodecanedioate (C12) 693-23-2 HMDB0000623 C02678 12736 Neg N-acetyltyrosine 537-55-3 HMDB0000866 68310 Neg "1,3-dimethylurate" 944-73-0 HMDB0001857 70346 Neg 3-hydroxylaurate 53941-38-1 HMDB0000387 94216 Neg pyridoxate 82-82-6 HMDB0000017 C00847 6723 Neg 5-hydroxyhexanoate 44843-89-2 "HMDB0000409,HMDB0000525" 170748 Neg propionylglycine (C3) 21709-90-0 HMDB0000783 98681 Neg butyrylglycine (C4) 20208-73-5 HMDB0000808 88412 Neg 2-methylbutyrylglycine (C5) 52320-67-9 HMDB0000339 193872 Neg 3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF) 86879-39-2 HMDB0061112 123979 Neg docosapentaenoate (DPA; 22:5n3) 2234-74-4 "HMDB0006528,HMDB0001976" C16513 6441454 Neg docosadienoate (22:2n6) 7370-49-2 HMDB0061714 C16533 5282807 Neg adrenate (22:4n6) 2091-25-0 HMDB0002226 C16527 "5282844,5497181" Neg 10-undecenoate (11:1n1) 1333-28-4 HMDB0033724 C13910 14891 Neg myristoleate (14:1n5) 544-64-9 HMDB0002000 C08322 5281119 Neg sebacate (C10-DC) 111-20-6 HMDB0000792 C08277 5192 Neg daidzein 486-66-8 HMDB0003312 C10208 5281708 Neg I-urobilinogen 14684-37-8 HMDB0004157 C05789 9548718 Neg stearidonate (18:4n3) 111174-40-4 HMDB0006547 C16300 5312508 Neg 5-dodecenoate (12:1n7) 2430-94-6 HMDB0000529 5312378 Neg tauro-beta-muricholate 25696-60-0 HMDB0000932 "121596216,21124703,168408" Neg N-acetyltryptophan 1218-34-4 HMDB0013713 C03137 "439917,700653" Neg N-acetylphenylalanine 2018-61-3 HMDB0000512 C03519 74839 Neg phenylacetylglycine 500-98-1 HMDB0000821 C05598 68144 Neg N-acetylisoleucine 3077-46-1 HMDB0061684 306109 Neg 10-nonadecenoate (19:1n9) 73033-09-7 HMDB0013622 5312513 Neg 10-heptadecenoate (17:1n7) 29743-97-3 HMDB0060038 5312435 Neg hyocholate 547-75-1 HMDB0000760 C17649 92805 Neg epiandrosterone sulfate 22229-22-7 HMDB0062657 C04555 9929317 Neg p-cresol sulfate 3233-57-7 HMDB0011635 4615423 Neg ADSGEGDFXAEGGGVR* 25422-31-5 25081464 Neg DSGEGDFXAEGGGVR* 132993922 Neg ADpSGEGDFXAEGGGVR* 886023-52-5 132993923 Neg eicosenoate (20:1n9 or 1n11) "HMDB0002231,HMDB0062436" C16526 "5282768,5282769,94159" Neg linolenate (18:3n3 or 3n6) "HMDB0003073,HMDB0001388" "C06426,C06427" "5280933,5280934" Neg aconitate [cis or trans] "HMDB0000958,HMDB000072" "C004174,C02341" "444212,643757" Neg "1,3,7-trimethylurate" 5415-44-1 HMDB0002123 C16361 79437 Neg "3,7-dimethylurate" 13087-49-5 HMDB0001982 C16360 83126 Neg "1,7-dimethylurate" 33868-03-0 HMDB0011103 C16356 91611 Neg indolebutyrate 133-32-4 HMDB0002096 C11284 8617 Neg 1-methylxanthine 6136-37-4 HMDB0010738 C16358 80220 Neg N6-carbamoylthreonyladenosine 24719-82-2 HMDB0041623 161466 Neg phenylacetylglutamine 28047-15-6 HMDB0006344 C04148 92258 Neg 4-hydroxyhippurate 2482-25-9 HMDB0013678 151012 Neg "5,6-dihydrouridine" 5627-05-4 HMDB0000497 94312 Neg 3-(3-amino-3-carboxypropyl)uridine* 52745-94-5 171198 Neg 1-arachidonylglycerol (20:4) 35474-99-8 HMDB11578 C13857 "16019980,5282281" Neg 1-linolenoylglycerol (18:3) 124151-74-2 HMDB0011569 53480978 Neg 1-palmitoyl-GPA (16:0) 17618-08-5 HMDB00327 C04036 6419701 Neg 5-methyluridine (ribothymidine) 1463-10-1 HMDB0000884 445408 Neg isovalerylglycine 16284-60-9 HMDB00678 546304 Neg 3-hydroxydodecanedioate* 34574-69-1 HMDB0000413 16663321 Neg 1-docosahexaenoylglycerol (22:6) HMDB0011587 53480995 Neg phenol sulfate 937-34-8 HMDB0060015 C02180 74426 Neg hexanoylglycine (C6) 24003-67-6 HMDB0000701 99463 Neg 2-hydroxy-3-methylvalerate 488-15-3 HMDB0000317 164623 Neg 2-palmitoyl-GPC* (16:0)* HMDB0061702 15061532 Neg 2-hydroxypalmitate 764-67-0 HMDB0031057 "12575964,92836,11065598" Neg docosapentaenoate (n6 DPA; 22:5n6) 25182-74-5 HMDB0001976 C16513 6441454 Neg isobutyrylglycine (C4) 15926-18-8 HMDB0000730 10855600 Neg catechol sulfate 4918-96-1 HMDB0059724 3083879 Neg 7-HOCA 115538-85-7 HMDB0012458 C17337 3081085 Neg "3beta,7alpha-dihydroxy-5-cholestenoate" 115538-84-6 HMDB0012454 C17335 3081084 Neg tetradecanedioate (C14) 821-38-5 HMDB0000872 13185 Neg hexadecanedioate (C16) 505-54-4 HMDB0000672 C19615 10459 Neg octadecanedioate (C18) 871-70-5 HMDB0000782 70095 Neg 1-myristoylglycerol (14:0) 75685-84-6 HMDB0011561 C01885 10957631 Neg 3-(3-hydroxyphenyl)propionate 621-54-5 HMDB0000375 C11457 91 Neg 1-arachidonoyl-GPI* (20:4)* HMDB0061690 121596217 Neg 1-palmitoyl-GPI* (16:0) HMDB0061695 71296207 Neg glycolithocholate sulfate* 15324-64-8 HMDB0002639 C11301 72222 Neg taurolithocholate 3-sulfate 64936-83-0 HMDB0002580 C03642 440071 Neg N6-succinyladenosine 4542-23-8 HMDB0000912 165243 Neg alpha-hydroxycaproate 6064-63-7 HMDB0001624 99824 Neg indoleacetylglutamine HMDB0013240 25200879 Neg hexanoylglutamine Neg N6-acetyllysine 692-04-6 HMDB0000206 C02727 92832 Neg dihomolinolenate (20:3n3 or 3n6) 17046-59-2 HMDB0002925 C03242 5280581 Neg 4-vinylphenol sulfate 2628-17-3 HMDB0062775 C05627 6426766 Neg 4-ethylphenyl sulfate 123-07-9 HMDB0062551 C13637 20822574 Neg thymol sulfate 89-83-8 HMDB0062720 C09908 12456386 Neg pyrraline 74509-14-1 HMDB0033143 C21013 14274616 Neg 1-oleoyl-GPI (18:1) HMDB0061693 86289645 Neg 1-linoleoyl-GPI* (18:2)* HMDB0240597 11124828 Neg o-cresol sulfate HMDB0011635 11615528 Neg 2-ethylphenylsulfate Neg 4-allylphenol sulfate 66633409 Neg "5alpha-androstan-3beta,17beta-diol disulfate" 571-20-0 HMDB00493 C12525 90186325 Neg "5alpha-pregnan-3beta,20alpha-diol disulfate" HMDB0094650 118703093 Neg glycocholenate sulfate* Neg taurocholenate sulfate* Neg "androstenediol (3beta,17beta) disulfate (1)" HMDB0240313 C04295 87120982 Neg pregnen-diol disulfate* Neg "androstenediol (3beta,17beta) disulfate (2)" HMDB0240313 87120982 Neg 21-hydroxypregnenolone disulfate 1164-98-3 134595 Neg "5alpha-androstan-3alpha,17alpha-diol disulfate" Neg "5alpha-androstan-3alpha,17alpha-diol monosulfate" HMDB0000412 Neg "5alpha-pregnan-3beta,20beta-diol monosulfate (1)" HMDB0240580 Neg "5alpha-pregnan-3beta,20alpha-diol monosulfate (2)" Neg 5alpha-pregnan-diol disulfate "HMDB0240581,HMDB0240582" "3082277,5127902" Neg "5alpha-androstan-3alpha,17beta-diol disulfate" HMDB0094682 56639109 Neg "5alpha-androstan-3alpha,17beta-diol monosulfate (1)" "121596226,121596225" Neg "5alpha-androstan-3beta,17alpha-diol disulfate" HMDB0094682 56639109 Neg "5alpha-androstan-3beta,17beta-diol monosulfate (2)" Neg "androstenediol (3alpha, 17alpha) monosulfate (2)" Neg "androstenediol (3alpha, 17alpha) monosulfate (3)" Neg "androstenediol (3beta,17beta) monosulfate (1)" 521-17-5 HMDB0240429 "129670631,13847309" Neg "androstenediol (3beta,17beta) monosulfate (2)" "HMDB0240429,HMDB0186954" Neg "5alpha-pregnan-3beta-ol,20-one sulfate" 7730-00-9 Neg pregnenediol sulfate (C21H34O5S)* 1247-64-9 HMDB0000774 C18044 105074 Neg gamma-CEHC 178167-75-4 HMDB0001931 133098 Neg N-acetyl-beta-alanine 3025-95-4 HMDB0061880 C01073 76406 Neg 3-hydroxyhippurate 1637-75-8 HMDB0006116 450268 Neg 16a-hydroxy DHEA 3-sulfate HMDB0062544 20848950 Neg 17alpha-hydroxypregnenolone 3-sulfate 28901-70-4 HMDB00416 152971 Neg pregnenolone sulfate 1247-64-9 HMDB0000774 C18044 105074 Neg andro steroid monosulfate C19H28O6S (1)* HMDB0002759 159663 Neg indole-3-carboxylate 771-50-6 HMDB0003320 C19837 69867 Neg 13-HODE + 9-HODE "HMDB0004670,HMDB0004667" "C14767,C14762" "5312830,5282945,1424,5282947,5282944" Neg tridecenedioate (C13:1-DC)* Neg N-acetyl-3-methylhistidine* 37841-04-6 HMDB0240341 193270 Neg homovanillate sulfate 38339-06-9 HMDB11719 29981063 Neg cinnamoylglycine 16534-24-0 HMDB0011621 709625 Neg (16 or 17)-methylstearate (a19:0 or i19:0) 2724-59-6 HMDB0037397 3083779 Neg isoursodeoxycholate 78919-26-3 HMDB0000686 C17662 127601 Neg sulfate* 14808-79-8 HMDB01448 C00059 5152822 Neg pantoate 470-29-1 HMDB0240389 C00522 5289105 Neg S-methylcysteine 1187-84-4 HMDB0002108 "24417,7058174,88180" Neg androsterone glucuronide 1852-43-3 HMDB0002829 C11135 114833 Neg cis-4-decenoate (10:1n6)* 505-90-8 HMDB0004980 5282726 Neg ethyl glucuronide 17685-04-0 HMDB0010325 18392195 Neg glycoursodeoxycholate 64480-66-6 HMDB0000708 12310288 Neg tauroursodeoxycholate 14605-22-2 HMDB0000874 9848818 Neg 3-(4-hydroxyphenyl)propionate 501-97-3 HMDB0002199 C01744 10394 Neg (14 or 15)-methylpalmitate (a17:0 or i17:0) HMDB0061859 C16995 "8181,17903417" Neg eicosanedioate (C20-DC) 2424-92-2 75502 Neg docosadioate (C22-DC) 505-56-6 C14240 7641 Neg 16-hydroxypalmitate 506-13-8 HMDB0006294 C18218 10466 Neg alpha-CEHC glucuronide* 477200-36-5 HMDB0062445 134819285 Neg N-oleoyltaurine 52514-04-2 6437033 Neg isoleucylglycine 868-28-0 HMDB0028907 342532 Neg N-palmitoyltaurine 83982-06-3 14504290 Neg N-stearoyltaurine 63155-80-6 168274 Neg beta-citrylglutamate 73590-26-8 C20775 189741 Neg equol sulfate Neg dihydroferulate 1135-23-5 HMDB0062121 14340 Neg pregnanediol-3-glucuronide 1852-49-9 HMDB0010318 123796 Neg N-palmitoylglycine 2441-41-0 HMDB0013034 151008 Neg succinimide 123-56-8 C07273 11439 Neg 2-stearoyl-GPE (18:0)* HMDB0011129 "90658453,53480667" Neg 5-hydroxymethyl-2-furoic acid 6338-41-6 HMDB0002432 C20448 80642 Neg glycohyocholate HMDB0000138 71361462 Neg taurohyocholate* HMDB0011637 C15516 11954195 Neg 2-hydroxydecanoate 5393-81-7 HMDB0094656 21488 Neg 3-methyl catechol sulfate (2) Neg 4-methylcatechol sulfate HMDB0240459 54104170 Neg 3-methyl catechol sulfate (1) 118431379 Neg 3b-hydroxy-5-cholenoic acid 5255-17-4 HMDB0000308 92997 Neg guaiacol sulfate HMDB0060013 22473 Neg 2-aminooctanoate 644-90-6 HMDB0000991 69522 Neg gamma-CEHC glucuronide* 121596235 Neg 2-aminophenol sulfate HMDB0061116 181670 Neg 3-acetylphenol sulfate Neg 1-stearoyl-GPS (18:0)* HMDB0061698 74819135 Neg 2-hydroxyphytanate* 14721-68-7 HMDB0061666 189026 Neg 1-arachidonoyl-GPA (20:4) 799268-65-8 HMDB0062312 42607498 Neg 3-hydroxycotinine glucuronide 132929-88-5 HMDB0001204 53477725 Neg 6-oxopiperidine-2-carboxylate 34622-39-4 HMDB0061705 3014237 Neg N-delta-acetylornithine HMDB0003357 C00437 9920500 Neg acisoga 106692-36-8 HMDB0061384 129397 Neg S-(3-hydroxypropyl)mercapturic acid (HPMA) 23127-40-4 119083 Neg 1H-indole-7-acetic acid 39689-63-9 18356439 Neg 3-methoxytyramine sulfate 54133459 Neg N-acetylalliin Neg O-sulfo-L-tyrosine HMDB0155722 514186 Neg ferulic acid 4-sulfate 86321-29-1 HMDB0029200 6305574 Neg 3-(3-hydroxyphenyl)propionate sulfate 86321-32-6 HMDB0094710 187488 Neg 11-ketoetiocholanolone glucuronide 17181-16-7 Neg etiocholanolone glucuronide 3602-09-3 HMDB0004484 270605 Neg 17alpha-hydroxypregnanolone glucuronide Neg 1-palmitoyl-GPG (16:0)* HMDB0240601 3300276 Neg 9-hydroxystearate 25498-28-6 HMDB0061661 9570127 Neg methyl glucopyranoside (alpha + beta) HMDB0029965 "445238,3036743,2108" Neg alpha-CEHC sulfate Neg alpha-CMBHC glucuronide Neg "5alpha-androstan-3alpha,17beta-diol monosulfate (2)" 121596225 Neg N-formylphenylalanine 13200-85-6 HMDB0240317 "759256,7064571" Neg 4-hydroxychlorothalonil 28343-61-5 HMDB0240624 34217 Neg isoeugenol sulfate 122198202 Neg tyramine O-sulfate 30223-92-8 HMDB0006409 153005 Neg 3-hydroxypyridine sulfate 1955-23-3 Neg 4-methylguaiacol sulfate 756760-43-7 Neg maltol sulfate Neg methyl-4-hydroxybenzoate sulfate HMDB0041646 10657183 Neg 21-hydroxypregnanolone disulfate Neg 1-dihomo-linolenylglycerol (20:3) HMDB0011577 Neg vanillic alcohol sulfate 754920-02-0 HMDB0041788 Neg 4-vinylguaiacol sulfate HMDB0127980 53803570 Neg vanillactate 2475-56-1 HMDB0000913 160637 Neg eugenol sulfate 95480-60-7 HMDB0135245 180632 Neg pregnanolone/allopregnanolone sulfate "HMDB0240591,HMDB0062782" C05480 "31402,129699967" Neg 2-methoxyresorcinol sulfate 1446269-78-8 Neg p-cresol glucuronide* 17680-99-8 HMDB0011686 154035 Neg acesulfame 55589-62-3 HMDB0033585 36573 Neg ethyl maltol sulfate Neg syringol sulfate 52904-67-3 Neg 6-hydroxyindole sulfate HMDB0000682 122198196 Neg 4-methoxyphenol sulfate 3233-60-1 Neg propyl 4-hydroxybenzoate sulfate 162338-10-5 HMDB0135261 131838881 Neg umbelliferone sulfate 69526-88-1 HMDB0240565 129659 Neg dopamine 4-sulfate HMDB0004148 C13691 68517194 Neg dopamine 3-O-sulfate HMDB0006275 C13690 122136 Neg daidzein sulfate (1) 12114465 Neg daidzein sulfate (2) 12114465 Neg 3-hydroxyhexanoate 10191-24-9 "HMDB0061652,HMDB0010718" 151492 Neg 3beta-hydroxy-5-cholestenoate 6561-58-6 HMDB0012453 C17333 165511 Neg "1,2,3-benzenetriol sulfate (2)" "HMDB0060018,HMDB0060016" "92013662,54110629" Neg 3-methoxycatechol sulfate (1) 129892430 Neg 3-methoxycatechol sulfate (2) Neg C-glycosyltryptophan 180509-18-6 HMDB0240296 10981970 Neg glycocholate sulfate Neg glycochenodeoxycholate 3-sulfate "HMDB0002409,HMDB0002496,HMDB0002497" "21116917,21125002,11954205" Neg glycodeoxycholate 3-sulfate 101602538 Neg taurodeoxycholic acid 3-sulfate Neg "trans-3,4-methyleneheptanoate" Neg phenol glucuronide 17685-05-1 HMDB0060014 87235 Neg linoleoyl ethanolamide 68171-52-8 HMDB0012252 5283446 Neg 2-methylcitrate/homocitrate "HMDB0003518,HMDB0000379" C01251 "439459,515" Neg oleate/vaccenate (18:1) "HMDB0003231,HMDB0000573,HMDB0240219,HMDB0000207" "C21944,C08367,C01712,C00712" "5282761,637517,5281127,445639" Neg indoxyl glucuronide 35804-66-1 HMDB0010319 2733785 Neg phenylacetyltaurine 33953-90-1 2179693 Neg 1-palmitoleoylglycerol (16:1)* HMDB0011565 Neg 5-hydroxyindole sulfate Neg 7-hydroxyindole sulfate Neg phenylacetylhistidine Neg phenylacetylglutamate HMDB0059772 11579826 Neg 1-linoleoyl-GPA (18:2)* HMDB0007856 Neg 1-linoleoyl-GPG (18:2)* HMDB0240600 Neg phenylacetylmethionine Neg glycocholate glucuronide (1) 44263357 Neg glycochenodeoxycholate glucuronide (1) HMDB0002579 44263370 Neg catechol glucuronide HMDB0240490 75124209 Neg furaneol sulfate 59815364 Neg hexadecadienoate (16:2n6) 28290-73-5 HMDB0000477 13932172 Neg 4-acetamidobenzoate 556-08-1 D03836 6918889 Neg 4-hydroxyphenylacetylglutamine Neg 2'-O-methyluridine 2140-76-3 HMDB0240328 102212 Neg phenylacetylthreonine Neg phenylacetylserine Neg perfluorooctanesulfonate (PFOS) 1763-23-1 HMDB0059586 C18142 74483 Neg 2-hydroxybehenate HMDB0061660 193484 Neg 2-hydroxynervonate* 5312783 Neg N-palmitoylserine "58725-46-5,474943-14-1" 6453686 Neg N-oleoylserine 44190514 Neg heneicosapentaenoate (21:5n3) 24257-10-1 11998573 Neg ethyl alpha-glucopyranoside 34625-23-5 HMDB0029968 11127487 Neg cortolone glucuronide (1) Neg 2-butenoylglycine 71428-89-2 6303498 Neg hydroxy-CMPF* Neg 3-hydroxyphenylacetoylglutamine Neg trans-2-hexenoylglycine Neg 2-hydroxyarachidate* 5225199 Neg dodecenedioate (C12:1-DC)* HMDB0000933 5283028 Neg hexadecenedioate (C16:1-DC)* Neg octadecenedioate (C18:1-DC) 9543674 Neg octadecadienedioate (C18:2-DC)* Neg glucuronide of C10H18O2 (1)* Neg glucuronide of C10H18O2 (3)* Neg 3-carboxy-4-methyl-5-pentyl-2-furanpropionate (3-CMPFP)** HMDB0061643 194501 Neg methylnaphthyl sulfate (2)* Neg glucuronide of C10H18O2 (7)* Neg glucuronide of C10H18O2 (8)* Neg N-acetyl-2-aminooctanoate* HMDB0059745 95555 Neg daidzein 7-O-glucuronide HMDB41718 11316354 Neg genistein sulfate* Neg perfluorooctanoate (PFOA) HMDB0059587 9554 Neg glyco-beta-muricholate** Neg glycine conjugate of C10H12O2* Neg glycine conjugate of C10H14O2 (1)* Neg glutamine conjugate of C7H12O2* Neg glutamine conjugate of C6H10O2 (1)* Neg glutamine conjugate of C6H10O2 (2)* Neg dihydroferulic acid sulfate HMDB0041724 187489 Neg tetradecadienoate (14:2)* 39039-37-7 HMDB0000560 5312409 Neg N-carbamoylvaline 26081-00-5 448879 Neg 8-methoxykynurenate 2929-14-8 HMDB0060426 C05830 76230 Neg 3-indoleglyoxylic acid 1477-49-2 73863 Neg "2,2'-Methylenebis(6-tert-butyl-p-cresol)" 119-47-1 8398 Neg ethyl beta-glucopyranoside HMDB0029968 121667 Neg 2-hydroxysebacate 103963-71-9 HMDB0000424 128458 Neg 3-hydroxyhippurate sulfate 186339 Neg 6-bromotryptophan 9856996 Neg delta-CEHC 84599-16-6 35027084 Neg 1-carboxyethylphenylalanine 59100900 Neg 1-carboxyethyltyrosine Neg 1-carboxyethylvaline Neg 1-carboxyethylleucine Neg 1-carboxyethylisoleucine Neg dodecadienoate (12:2)* 25480 Neg gamma-CEHC sulfate Neg glucuronide of piperine metabolite C17H21NO3 (3)* Neg glucuronide of piperine metabolite C17H21NO3 (4)* Neg glucuronide of piperine metabolite C17H21NO3 (5)* Neg sulfate of piperine metabolite C16H19NO3 (2)* Neg sulfate of piperine metabolite C16H19NO3 (3)* Neg sulfate of piperine metabolite C18H21NO3 (1)* Neg sulfate of piperine metabolite C18H21NO3 (3)* Neg 2-naphthol sulfate 74428 Neg "(2,4 or 2,5)-dimethylphenol sulfate" Neg 4-ethylcatechol sulfate Neg 11beta-hydroxyandrosterone glucuronide HMDB0010351 Neg 11beta-hydroxyetiocholanolone glucuronide* 17181-15-6 Neg deoxycholic acid glucuronide Neg 4-allylcatechol sulfate Neg 2-hydroxyfluorene sulfate Neg glycoursodeoxycholic acid sulfate (1) Neg lithocholate sulfate (1) 451489 Neg lithocholic acid sulfate (2) Neg 2-ketocaprylate 328-51-8 HMDB13211 67600 Neg tauroursodeoxycholic acid sulfate (1) Neg tetrahydrocortisol sulfate (1) Neg 3-ethylcatechol sulfate (1) Neg 3-ethylcatechol sulfate (2) Neg "2,3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)*" HMDB0240388 Neg Fibrinopeptide B (1-13)** Neg 5-hydroxy-2-methylpyridine sulfate Neg 3-hydroxy-2-methylpyridine sulfate Neg cortisol 21-sulfate 152957-32-9 HMDB0062779 102172 Neg glycitein sulfate (2) Neg taurochenodeoxycholic acid 3-sulfate HMDB0002486 52931550 Neg tetradecadienedioate (C14:2-DC)* 86018718 Neg pregnenetriol sulfate* 129671303 Neg pregnenetriol disulfate* Neg picolinoylglycine 5616-29-5 HMDB0059766 11788622 Neg Urolithin B glucuronide HMDB41787 Neg metabolonic lactone sulfate Neg vanillic acid glycine HMDB0060026 3083688 Neg branched chain 14:0 dicarboxylic acid** Neg (2 or 3)-decenoate (10:1n7 or n8) Neg isoursodeoxycholate sulfate (1) Neg chenodeoxycholic acid sulfate (1) HMDB0002522 21252308 Neg "branched-chain, straight-chain, or cyclopropyl 10:1 fatty acid (1)*" Neg "branched-chain, straight-chain, or cyclopropyl 10:1 fatty acid (2)*" Neg "3-bromo-5-chloro-2,6-dihydroxybenzoic acid*" 134581543 Neg "branched-chain, straight-chain, or cyclopropyl 12:1 fatty acid*" Neg decadienedioic acid (C10:2-DC)** 17789717 Neg deoxycholic acid 12-sulfate* Neg GlcNAc sulfate conjugate of C21H34O2 steroid** Neg "cis-3,4-methyleneheptanoate" Neg 4-chlorobenzoic acid 74-11-3 C02370 6318 Neg 2-methoxyhydroquinone sulfate (1) Neg 2-methoxyhydroquinone sulfate (2) Neg "2,4-di-tert-butylphenol" 96-76-4 Neg "cis-3,4-methyleneheptanoylglycine" Neg "bilirubin degradation product, C16H18N2O5 (1)**" Neg "bilirubin degradation product, C16H18N2O5 (2)**" Neg "bilirubin degradation product, C17H18N2O4 (1)**" Neg "bilirubin degradation product, C17H18N2O4 (2)**" Neg "bilirubin degradation product, C17H18N2O4 (3)**" Neg "bilirubin degradation product, C17H20N2O5 (1)**" Neg "bilirubin degradation product, C17H20N2O5 (2)**" Neg tetrahydrocortisol glucuronide Neg "bilirubin degradation product, C16H18N2O5 (3)**" Neg "bilirubin degradation product, C16H18N2O5 (4)**" Neg METABOLITES_END #END