#METABOLOMICS WORKBENCH DanielaWeber_22_20210810_072947 DATATRACK_ID:2793 STUDY_ID:ST001903 ANALYSIS_ID:AN003815 PROJECT_ID:PR001499 VERSION 1 CREATED_ON November 8, 2022, 11:35 am #PROJECT PR:PROJECT_TITLE Effect of ketogenic diet on the plasma and tumor metabolome of melanoma-bearing PR:PROJECT_TITLE mice PR:PROJECT_TYPE Metabolomics analysis PR:PROJECT_SUMMARY Growing evidence supports the use of low-carbohydrate/high-fat ketogenic diets PR:PROJECT_SUMMARY (KDs) together with standard therapies to improve cancer treatment outcomes. PR:PROJECT_SUMMARY However, conflicting data exist regarding the efficacy of KDs in melanoma, the PR:PROJECT_SUMMARY deadliest skin cancer. Here, we show that two different KD formulations PR:PROJECT_SUMMARY effectively reduced tumor growth in immunocompromised mice bearing genetically PR:PROJECT_SUMMARY and metabolically heterogeneous human melanoma xenografts. Furthermore, the KDs PR:PROJECT_SUMMARY exerted a metastasis-reducing effect in an immunocompetent syngeneic melanoma PR:PROJECT_SUMMARY mouse model. Ketone bodies did not directly influence melanoma cell PR:PROJECT_SUMMARY proliferation; therefore, we performed an in-depth metabolomics analysis using PR:PROJECT_SUMMARY the MxP® Quant 500 kit combined with a acylcarnitine assay (biocrates life PR:PROJECT_SUMMARY sciences ag)to elucidate potential antitumor mechanisms in vivo. Targeted PR:PROJECT_SUMMARY analysis of plasma and tumor metabolomes revealed distinct changes in amino acid PR:PROJECT_SUMMARY metabolism induced by the KDs. Moreover, the KDs increased sphingomyelin PR:PROJECT_SUMMARY synthesis and hydroxylation of certain lipids. Thus, KDs simultaneously affect PR:PROJECT_SUMMARY multiple metabolic pathways to create an unfavorable environment for melanoma PR:PROJECT_SUMMARY cell proliferation, supporting their potential as a complementary nutritional PR:PROJECT_SUMMARY approach to melanoma therapy. PR:INSTITUTE University Hospital of the Paracelsus Medical University Salzburg PR:LAST_NAME Weber PR:FIRST_NAME Daniela PR:ADDRESS Müllner Hauptstraße 48, Salzburg, Salzburg, 5020, Austria PR:EMAIL d.weber@salk.at PR:PHONE 0043 57255 26274 #STUDY ST:STUDY_TITLE Effect of ketogenic diet on the plasma and tumor metabolome of melanoma-bearing ST:STUDY_TITLE mice ST:STUDY_SUMMARY Growing evidence supports the use of low-carbohydrate/high-fat ketogenic diets ST:STUDY_SUMMARY (KDs) together with standard therapies to improve cancer treatment outcomes. ST:STUDY_SUMMARY However, conflicting data exist regarding the efficacy of KDs in melanoma, the ST:STUDY_SUMMARY deadliest skin cancer. Here, we show that two different KD formulations ST:STUDY_SUMMARY effectively reduced tumor growth in immunocompromised mice bearing genetically ST:STUDY_SUMMARY and metabolically heterogeneous human melanoma xenografts. Furthermore, the KDs ST:STUDY_SUMMARY exerted a metastasis-reducing effect in an immunocompetent syngeneic melanoma ST:STUDY_SUMMARY mouse model. Ketone bodies did not directly influence melanoma cell ST:STUDY_SUMMARY proliferation; therefore, we performed an in-depth metabolomics analysis using ST:STUDY_SUMMARY the MxP® Quant 500 kit combined with a acylcarnitine assay (biocrates life ST:STUDY_SUMMARY sciences ag)to elucidate potential anti-tumor mechanisms in vivo. Targeted ST:STUDY_SUMMARY analysis of plasma and tumor metabolomes revealed distinct changes in amino acid ST:STUDY_SUMMARY metabolism induced by the KDs. Moreover, the KDs increased sphingomyelin ST:STUDY_SUMMARY synthesis and hydroxylation of certain lipids. Thus, KDs simultaneously affect ST:STUDY_SUMMARY multiple metabolic pathways to create an unfavorable environment for melanoma ST:STUDY_SUMMARY cell proliferation, supporting their potential as a complementary nutritional ST:STUDY_SUMMARY approach to melanoma therapy. ST:INSTITUTE University Hospital of the Paracelsus Medical University Salzburg ST:LAST_NAME Weber ST:FIRST_NAME Daniela ST:ADDRESS Müllner Hauptstraße 48, 5020 Salzburg, Austria ST:EMAIL d.weber@salk.at ST:STUDY_TYPE Metabolomics analysis ST:PHONE 0043 57255 26274 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 #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 - plasma # 227 Sample description:A375 CTRL | Tissue:plasma RAW_FILE_NAME=1020494983 SUBJECT_SAMPLE_FACTORS - plasma # 228 Sample description:A375 CTRL | Tissue:plasma RAW_FILE_NAME=1020494998 SUBJECT_SAMPLE_FACTORS - plasma # 229 Sample description:A375 CTRL | Tissue:plasma RAW_FILE_NAME=1020497666 SUBJECT_SAMPLE_FACTORS - plasma # 230 Sample description:A375 CTRL | Tissue:plasma RAW_FILE_NAME=1020497671 SUBJECT_SAMPLE_FACTORS - plasma # 231 Sample description:A375 CTRL | Tissue:plasma RAW_FILE_NAME=1020497685 SUBJECT_SAMPLE_FACTORS - 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tumor # 62 Sample description:WM47 CTRL | Tissue:tumor RAW_FILE_NAME=1020491831 SUBJECT_SAMPLE_FACTORS - tumor # 63 Sample description:WM47 CTRL | Tissue:tumor RAW_FILE_NAME=1020491846 SUBJECT_SAMPLE_FACTORS - tumor # 64 Sample description:WM47 CTRL | Tissue:tumor RAW_FILE_NAME=1020491851 SUBJECT_SAMPLE_FACTORS - tumor # 65 Sample description:WM47 CTRL | Tissue:tumor RAW_FILE_NAME=1020491865 SUBJECT_SAMPLE_FACTORS - tumor # 66 Sample description:WM47 CTRL | Tissue:tumor RAW_FILE_NAME=1020491870 SUBJECT_SAMPLE_FACTORS - tumor # 67 Sample description:WM47 CTRL | Tissue:tumor RAW_FILE_NAME=1020491884 SUBJECT_SAMPLE_FACTORS - tumor # 68 Sample description:WM47 LCT | Tissue:tumor RAW_FILE_NAME=1020491899 SUBJECT_SAMPLE_FACTORS - tumor # 69 Sample description:WM47 LCT | Tissue:tumor RAW_FILE_NAME=1020491900 SUBJECT_SAMPLE_FACTORS - tumor # 71 Sample description:WM47 LCT | Tissue:tumor RAW_FILE_NAME=1020491929 SUBJECT_SAMPLE_FACTORS - tumor # 72 Sample description:WM47 LCT | Tissue:tumor RAW_FILE_NAME=1020491933 SUBJECT_SAMPLE_FACTORS - tumor # 74 Sample description:WM47 LCT | Tissue:tumor RAW_FILE_NAME=1020491952 SUBJECT_SAMPLE_FACTORS - tumor # 75 Sample description:WM47 LCT | Tissue:tumor RAW_FILE_NAME=1020491967 SUBJECT_SAMPLE_FACTORS - tumor # 77 Sample description:WM47 LCT | Tissue:tumor RAW_FILE_NAME=1020491986 SUBJECT_SAMPLE_FACTORS - tumor # 80 Sample description:WM47 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020492002 SUBJECT_SAMPLE_FACTORS - tumor # 81 Sample description:WM47 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020492017 SUBJECT_SAMPLE_FACTORS - tumor # 82 Sample description:WM47 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020492021 SUBJECT_SAMPLE_FACTORS - tumor # 84 Sample description:WM47 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020492041 SUBJECT_SAMPLE_FACTORS - tumor # 85 Sample description:WM47 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020492055 SUBJECT_SAMPLE_FACTORS - tumor # 86 Sample description:WM47 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020492060 SUBJECT_SAMPLE_FACTORS - tumor # 87 Sample description:WM47 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020492074 SUBJECT_SAMPLE_FACTORS - tumor # 14 Sample description:WM3311 CTRL | Tissue:tumor RAW_FILE_NAME=1020488737 SUBJECT_SAMPLE_FACTORS - tumor # 15 Sample description:WM3311 CTRL | Tissue:tumor RAW_FILE_NAME=1020488741 SUBJECT_SAMPLE_FACTORS - tumor # 16 Sample description:WM3311 CTRL | Tissue:tumor RAW_FILE_NAME=1020488756 SUBJECT_SAMPLE_FACTORS - tumor # 17 Sample description:WM3311 CTRL | Tissue:tumor RAW_FILE_NAME=1020488761 SUBJECT_SAMPLE_FACTORS - tumor # 18 Sample description:WM3311 CTRL | Tissue:tumor RAW_FILE_NAME=1020488775 SUBJECT_SAMPLE_FACTORS - tumor # 19 Sample description:WM3311 CTRL | Tissue:tumor RAW_FILE_NAME=1020488780 SUBJECT_SAMPLE_FACTORS - tumor # 21 Sample description:WM3311 CTRL | Tissue:tumor RAW_FILE_NAME=1020488805 SUBJECT_SAMPLE_FACTORS - tumor # 23 Sample description:WM3311 CTRL | Tissue:tumor RAW_FILE_NAME=1020488810 SUBJECT_SAMPLE_FACTORS - tumor # 24 Sample description:WM3311 CTRL | Tissue:tumor RAW_FILE_NAME=1020488824 SUBJECT_SAMPLE_FACTORS - tumor # 25 Sample description:WM3311 LCT | Tissue:tumor RAW_FILE_NAME=1020488839 SUBJECT_SAMPLE_FACTORS - tumor # 26 Sample description:WM3311 LCT | Tissue:tumor RAW_FILE_NAME=1020488843 SUBJECT_SAMPLE_FACTORS - tumor # 27 Sample description:WM3311 LCT | Tissue:tumor RAW_FILE_NAME=1020488858 SUBJECT_SAMPLE_FACTORS - tumor # 28 Sample description:WM3311 LCT | Tissue:tumor RAW_FILE_NAME=1020488862 SUBJECT_SAMPLE_FACTORS - tumor # 29 Sample description:WM3311 LCT | Tissue:tumor RAW_FILE_NAME=1020488877 SUBJECT_SAMPLE_FACTORS - tumor # 30 Sample description:WM3311 LCT | Tissue:tumor RAW_FILE_NAME=1020488896 SUBJECT_SAMPLE_FACTORS - tumor # 31 Sample description:WM3311 LCT | Tissue:tumor RAW_FILE_NAME=1020488881 SUBJECT_SAMPLE_FACTORS - tumor # 33 Sample description:WM3311 LCT | Tissue:tumor RAW_FILE_NAME=1020488907 SUBJECT_SAMPLE_FACTORS - tumor # 34 Sample description:WM3311 LCT | Tissue:tumor RAW_FILE_NAME=1020488911 SUBJECT_SAMPLE_FACTORS - tumor # 35 Sample description:WM3311 LCT | Tissue:tumor RAW_FILE_NAME=1020488926 SUBJECT_SAMPLE_FACTORS - tumor # 47 Sample description:WM3311 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020489033 SUBJECT_SAMPLE_FACTORS - tumor # 48 Sample description:WM3311 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020489048 SUBJECT_SAMPLE_FACTORS - tumor # 49 Sample description:WM3311 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020489052 SUBJECT_SAMPLE_FACTORS - tumor # 50 Sample description:WM3311 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020489067 SUBJECT_SAMPLE_FACTORS - tumor # 52 Sample description:WM3311 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020489071 SUBJECT_SAMPLE_FACTORS - tumor # 53 Sample description:WM3311 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020489086 SUBJECT_SAMPLE_FACTORS - tumor # 54 Sample description:WM3311 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020489091 SUBJECT_SAMPLE_FACTORS - tumor # 55 Sample description:WM3311 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020489101 SUBJECT_SAMPLE_FACTORS - tumor # 56 Sample description:WM3311 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020491778 SUBJECT_SAMPLE_FACTORS - tumor # 277 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020495294 SUBJECT_SAMPLE_FACTORS - tumor # 278 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020495305 SUBJECT_SAMPLE_FACTORS - tumor # 279 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020495310 SUBJECT_SAMPLE_FACTORS - tumor # 280 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020495324 SUBJECT_SAMPLE_FACTORS - tumor # 281 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020495339 SUBJECT_SAMPLE_FACTORS - tumor # 282 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020497995 SUBJECT_SAMPLE_FACTORS - tumor # 283 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020498007 SUBJECT_SAMPLE_FACTORS - tumor # 284 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020498011 SUBJECT_SAMPLE_FACTORS - tumor # 285 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020498026 SUBJECT_SAMPLE_FACTORS - tumor # 286 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020498031 SUBJECT_SAMPLE_FACTORS - tumor # 287 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020498045 SUBJECT_SAMPLE_FACTORS - tumor # 288 Sample description:WM3000 CTRL | Tissue:tumor RAW_FILE_NAME=1020498050 SUBJECT_SAMPLE_FACTORS - tumor # 289 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498064 SUBJECT_SAMPLE_FACTORS - tumor # 290 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498079 SUBJECT_SAMPLE_FACTORS - tumor # 291 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498083 SUBJECT_SAMPLE_FACTORS - tumor # 292 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498098 SUBJECT_SAMPLE_FACTORS - tumor # 293 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498109 SUBJECT_SAMPLE_FACTORS - tumor # 294 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498113 SUBJECT_SAMPLE_FACTORS - tumor # 295 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498128 SUBJECT_SAMPLE_FACTORS - tumor # 296 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498132 SUBJECT_SAMPLE_FACTORS - tumor # 297 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498147 SUBJECT_SAMPLE_FACTORS - tumor # 298 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498151 SUBJECT_SAMPLE_FACTORS - tumor # 299 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498166 SUBJECT_SAMPLE_FACTORS - tumor # 300 Sample description:WM3000 LCT | Tissue:tumor RAW_FILE_NAME=1020498171 SUBJECT_SAMPLE_FACTORS - tumor # 301 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020498185 SUBJECT_SAMPLE_FACTORS - tumor # 302 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020498190 SUBJECT_SAMPLE_FACTORS - tumor # 303 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020498201 SUBJECT_SAMPLE_FACTORS - tumor # 304 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020498215 SUBJECT_SAMPLE_FACTORS - tumor # 305 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020498220 SUBJECT_SAMPLE_FACTORS - tumor # 306 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020503583 SUBJECT_SAMPLE_FACTORS - tumor # 307 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020503598 SUBJECT_SAMPLE_FACTORS - tumor # 308 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020503609 SUBJECT_SAMPLE_FACTORS - tumor # 309 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020503613 SUBJECT_SAMPLE_FACTORS - tumor # 310 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020503628 SUBJECT_SAMPLE_FACTORS - tumor # 311 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020503632 SUBJECT_SAMPLE_FACTORS - tumor # 312 Sample description:WM3000 LCT-MCT | Tissue:tumor RAW_FILE_NAME=1020503647 #COLLECTION CO:COLLECTION_SUMMARY Human melanoma xenografts were established in mice using A375 and WM47 (BRAF CO:COLLECTION_SUMMARY mutant), WM3311 (BRAF/NRAS wild-type) and WM3000 (NRAS mutant) cells. Blood was CO:COLLECTION_SUMMARY taken by cardiac puncture, collected in heparin-coated tubes and centrifuged for CO:COLLECTION_SUMMARY 3 min at 2000 g. Plasma samples were stored at -80 °C until analysis. Tumors CO:COLLECTION_SUMMARY were harvested and snap frozen in liquid nitrogen and stored at -80°C for CO:COLLECTION_SUMMARY metabolomics. CO:SAMPLE_TYPE Blood (plasma) and tumor tissue #TREATMENT TR:TREATMENT_SUMMARY Human melanoma xenografts were established in mice using A375 and WM47 (BRAF TR:TREATMENT_SUMMARY mutant), WM3311 (BRAF/NRAS wild-type) and WM3000 (NRAS mutant) cells. Once the TR:TREATMENT_SUMMARY tumor volume reached 100 mm3, mice were equally assigned to control diet (CTRL) TR:TREATMENT_SUMMARY and two ketogenic diet (KDs) differing in their fat composition (LCT: long-chain TR:TREATMENT_SUMMARY triglyceride-based KD and LCT-MCT: long-chain triglyceride-based KD supplemented TR:TREATMENT_SUMMARY with C8 and C10 medium-chain triglycerides, ratio of fat to the sum of TR:TREATMENT_SUMMARY carbohydrate and protein of 8:1). Both KDs were administered ad libitum as TR:TREATMENT_SUMMARY monotherapy. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY To capture a broad spectrum of metabolites, we used the MxP® Quant 500 kit SP:SAMPLEPREP_SUMMARY combined with the in-house acylcarnitine (AC) assay (biocrates life sciences SP:SAMPLEPREP_SUMMARY ag). Samples were prepared the same way for both assays. Therefore, 50-80 mg of SP:SAMPLEPREP_SUMMARY tumor tissues were transferred to 0.5 ml Precellys® vials followed by the SP:SAMPLEPREP_SUMMARY addition of 85:15 ethanol:0.01 M phosphate as a lysis buffer with a volume [µl] SP:SAMPLEPREP_SUMMARY of 3 times the tissue weight [mg]. Tissue homogenization was carried out at 4 SP:SAMPLEPREP_SUMMARY °C and 5800 rpm using a Precellys® 24 homogenizer coupled to a Cryolys® SP:SAMPLEPREP_SUMMARY cooling unit. The homogenates were centrifuged at 10,000 g for 2 min at 2-4 °C. SP:SAMPLEPREP_SUMMARY Supernatants were collected and stored at -80 °C until analysis. Plasma samples SP:SAMPLEPREP_SUMMARY as well as tissue homogenate supernatant were thawed on ice, then vortexed SP:SAMPLEPREP_SUMMARY before use. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Waters Acquity CH:COLUMN_NAME MxP® Quant 500 Kit Column System #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Waters TQ-S MS MS:INSTRUMENT_TYPE Triple quadrupole MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS MS acquisition data were obtained using MRM transition (Q1 and Q3 pair) in MS:MS_COMMENTS positive ion mode. Raw data of the MxP® Quant 500 assay were exported and MS:MS_COMMENTS quantified using MetIDQTM software (Biocrates Life Sciences). Downstream MS:MS_COMMENTS analysis was performed using MetaboAnalyst 5.0. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS uM MS_METABOLITE_DATA_START Samples plasma # 14 plasma # 15 plasma # 16 plasma # 17 plasma # 18 plasma # 19 plasma # 21 plasma # 22 plasma # 227 plasma # 228 plasma # 229 plasma # 23 plasma # 230 plasma # 231 plasma # 232 plasma # 233 plasma # 234 plasma # 235 plasma # 236 plasma # 237 plasma # 238 plasma # 239 plasma # 24 plasma # 240 plasma # 241 plasma # 243 plasma # 244 plasma # 245 plasma # 246 plasma # 247 plasma # 248 plasma # 249 plasma # 25 plasma # 251 plasma # 252 plasma # 253 plasma # 254 plasma # 255 plasma # 256 plasma # 257 plasma # 258 plasma # 259 plasma # 26 plasma # 261 plasma # 262 plasma # 263 plasma # 27 plasma # 277 plasma # 278 plasma # 279 plasma # 28 plasma # 280 plasma # 281 plasma # 282 plasma # 283 plasma # 284 plasma # 285 plasma # 286 plasma # 287 plasma # 288 plasma # 289 plasma # 29 plasma # 290 plasma # 291 plasma # 292 plasma # 293 plasma # 294 plasma # 295 plasma # 296 plasma # 297 plasma # 298 plasma # 299 plasma # 30 plasma # 300 plasma # 301 plasma # 302 plasma # 303 plasma # 304 plasma # 305 plasma # 306 plasma # 307 plasma # 308 plasma # 309 plasma # 31 plasma # 310 plasma # 311 plasma # 312 plasma # 32 plasma # 33 plasma # 34 plasma # 35 plasma # 47 plasma # 48 plasma # 49 plasma # 50 plasma # 51 plasma # 52 plasma # 53 plasma # 54 plasma # 55 plasma # 56 plasma # 58 plasma # 59 plasma # 60 plasma # 61 plasma # 62 plasma # 63 plasma # 64 plasma # 65 plasma # 66 plasma # 67 plasma # 68 plasma # 69 plasma # 71 plasma # 72 plasma # 74 plasma # 75 plasma # 77 plasma # 80 plasma # 81 plasma # 82 plasma # 84 plasma # 85 plasma # 86 plasma # 87 tumor # 14 tumor # 15 tumor # 16 tumor # 17 tumor # 18 tumor # 19 tumor # 21 tumor # 227 tumor # 228 tumor # 229 tumor # 23 tumor # 230 tumor # 231 tumor # 232 tumor # 233 tumor # 234 tumor # 235 tumor # 236 tumor # 237 tumor # 238 tumor # 239 tumor # 24 tumor # 240 tumor # 241 tumor # 243 tumor # 244 tumor # 245 tumor # 246 tumor # 247 tumor # 248 tumor # 249 tumor # 25 tumor # 250 tumor # 251 tumor # 252 tumor # 253 tumor # 254 tumor # 255 tumor # 256 tumor # 257 tumor # 258 tumor # 259 tumor # 26 tumor # 261 tumor # 262 tumor # 263 tumor # 27 tumor # 277 tumor # 278 tumor # 279 tumor # 28 tumor # 280 tumor # 281 tumor # 282 tumor # 283 tumor # 284 tumor # 285 tumor # 286 tumor # 287 tumor # 288 tumor # 289 tumor # 29 tumor # 290 tumor # 291 tumor # 292 tumor # 293 tumor # 294 tumor # 295 tumor # 296 tumor # 297 tumor # 298 tumor # 299 tumor # 30 tumor # 300 tumor # 301 tumor # 302 tumor # 303 tumor # 304 tumor # 305 tumor # 306 tumor # 307 tumor # 308 tumor # 309 tumor # 31 tumor # 310 tumor # 311 tumor # 312 tumor # 33 tumor # 34 tumor # 35 tumor # 47 tumor # 48 tumor # 49 tumor # 50 tumor # 52 tumor # 53 tumor # 54 tumor # 55 tumor # 56 tumor # 58 tumor # 59 tumor # 60 tumor # 61 tumor # 62 tumor # 63 tumor # 64 tumor # 65 tumor # 66 tumor # 67 tumor # 68 tumor # 69 tumor # 71 tumor # 72 tumor # 74 tumor # 75 tumor # 77 tumor # 80 tumor # 81 tumor # 82 tumor # 84 tumor # 85 tumor # 86 tumor # 87 Factors Sample description:WM3311 CTRL | Tissue:plasma Sample description:WM3311 CTRL | Tissue:plasma Sample description:WM3311 CTRL | Tissue:plasma Sample description:WM3311 CTRL | Tissue:plasma Sample description:WM3311 CTRL | Tissue:plasma Sample description:WM3311 CTRL | Tissue:plasma Sample description:WM3311 CTRL | Tissue:plasma Sample description:WM3311 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:WM3311 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:A375 CTRL | Tissue:plasma Sample description:WM3311 CTRL | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:A375 LCT | Tissue:plasma Sample description:A375 LCT-MCT | Tissue:plasma Sample description:A375 LCT-MCT | Tissue:plasma Sample description:A375 LCT-MCT | Tissue:plasma Sample description:A375 LCT-MCT | Tissue:plasma Sample description:A375 LCT-MCT | Tissue:plasma Sample description:A375 LCT-MCT | Tissue:plasma Sample description:A375 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:A375 LCT-MCT | Tissue:plasma Sample description:A375 LCT-MCT | Tissue:plasma Sample description:A375 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 CTRL | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:WM3000 LCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3000 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:WM3311 LCT | Tissue:plasma Sample description:WM3311 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT-MCT | Tissue:plasma Sample description:WM3311 LCT-MCT | Tissue:plasma Sample description:WM47 CTRL | Tissue:plasma Sample description:WM47 CTRL | Tissue:plasma Sample description:WM47 CTRL | Tissue:plasma Sample description:WM47 CTRL | Tissue:plasma Sample description:WM47 CTRL | Tissue:plasma Sample description:WM47 CTRL | Tissue:plasma Sample description:WM47 CTRL | Tissue:plasma Sample description:WM47 CTRL | Tissue:plasma Sample description:WM47 CTRL | Tissue:plasma Sample description:WM47 CTRL | Tissue:plasma Sample description:WM47 LCT | Tissue:plasma Sample description:WM47 LCT | Tissue:plasma Sample description:WM47 LCT | Tissue:plasma Sample description:WM47 LCT | Tissue:plasma Sample description:WM47 LCT | Tissue:plasma Sample description:WM47 LCT | Tissue:plasma Sample description:WM47 LCT | Tissue:plasma Sample description:WM47 LCT-MCT | Tissue:plasma Sample description:WM47 LCT-MCT | Tissue:plasma Sample description:WM47 LCT-MCT | Tissue:plasma Sample description:WM47 LCT-MCT | Tissue:plasma Sample description:WM47 LCT-MCT | Tissue:plasma Sample description:WM47 LCT-MCT | Tissue:plasma Sample description:WM47 LCT-MCT | Tissue:plasma Sample description:WM3311 CTRL | Tissue:tumor Sample description:WM3311 CTRL | Tissue:tumor Sample description:WM3311 CTRL | Tissue:tumor Sample description:WM3311 CTRL | Tissue:tumor Sample description:WM3311 CTRL | Tissue:tumor Sample description:WM3311 CTRL | Tissue:tumor Sample description:WM3311 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:WM3311 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:A375 CTRL | Tissue:tumor Sample description:WM3311 CTRL | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:WM3311 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT | Tissue:tumor Sample description:A375 LCT-MCT | Tissue:tumor Sample description:A375 LCT-MCT | Tissue:tumor Sample description:A375 LCT-MCT | Tissue:tumor Sample description:A375 LCT-MCT | Tissue:tumor Sample description:A375 LCT-MCT | Tissue:tumor Sample description:A375 LCT-MCT | Tissue:tumor Sample description:A375 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT | Tissue:tumor Sample description:A375 LCT-MCT | Tissue:tumor Sample description:A375 LCT-MCT | Tissue:tumor Sample description:A375 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3311 LCT | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 CTRL | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3311 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3311 LCT | Tissue:tumor Sample description:WM3000 LCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3000 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT | Tissue:tumor Sample description:WM3311 LCT | Tissue:tumor Sample description:WM3311 LCT | Tissue:tumor Sample description:WM3311 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT-MCT | Tissue:tumor Sample description:WM3311 LCT-MCT | Tissue:tumor Sample description:WM47 CTRL | Tissue:tumor Sample description:WM47 CTRL | Tissue:tumor Sample description:WM47 CTRL | Tissue:tumor Sample description:WM47 CTRL | Tissue:tumor Sample description:WM47 CTRL | Tissue:tumor Sample description:WM47 CTRL | Tissue:tumor Sample description:WM47 CTRL | Tissue:tumor Sample description:WM47 CTRL | Tissue:tumor Sample description:WM47 CTRL | Tissue:tumor Sample description:WM47 CTRL | Tissue:tumor Sample description:WM47 LCT | Tissue:tumor Sample description:WM47 LCT | Tissue:tumor Sample description:WM47 LCT | Tissue:tumor Sample description:WM47 LCT | Tissue:tumor Sample description:WM47 LCT | Tissue:tumor Sample description:WM47 LCT | Tissue:tumor Sample description:WM47 LCT | Tissue:tumor Sample description:WM47 LCT-MCT | Tissue:tumor Sample description:WM47 LCT-MCT | Tissue:tumor Sample description:WM47 LCT-MCT | Tissue:tumor Sample description:WM47 LCT-MCT | Tissue:tumor Sample description:WM47 LCT-MCT | Tissue:tumor Sample description:WM47 LCT-MCT | Tissue:tumor Sample description:WM47 LCT-MCT | Tissue:tumor 1-Methylhistidine 2.936 3.754 4.667 4.316 2.795 2.491 3.287 3.064 5.499 3.206 4.504 5.942 4.007 5.057 2.819 5.513 4.449 4.988 2.902 3.33 2.888 2.542 4.012 7.447 9.824 6.453 7.378 10.418 9.257 13.029 10.736 17.962 8.585 7.807 10.307 15.199 10.542 7.516 9.271 8.415 15.613 10.929 6.936 7.171 5.927 12.684 5.041 3.095 3.164 3.454 3.485 2.971 3.109 2.736 4.2 3.288 4.021 2.694 3.855 3.675 6.259 4.105 7.226 6.301 6.936 8.677 9.022 6.149 8.857 4.642 4.864 7.682 3.368 5.541 9.769 8.18 7.337 6.48 7.668 6.508 7.102 7.157 8.373 7.439 5.444 6.784 4.933 3.474 5.86 4.854 4.842 4.246 11.673 3.497 5.404 3.368 3.602 14.035 5.251 5.673 3.298 3.871 3.404 4.105 4.363 3.918 4.129 4.339 4.035 3.766 3.789 7.497 5.52 6.772 5.345 5.205 4.936 6.082 4.538 4.713 4.012 4.222 4.515 5.392 6.211 2.799 2.534 6.13 5.056 1.738 1.967 2.679 4.054 2.136 1.762 3.463 2.425 3.849 2.655 3.934 1.931 1.738 0.647 2.727 1.363 1.155 5.02 4.296 6.878 5.538 6.178 11.922 6.202 13.876 9.786 8.627 9.243 2.775 8.784 9.074 5.309 9.448 10.329 12.308 8.374 6.335 6.299 8.965 4.995 5.14 8.965 5.382 1.351 0.917 1.4 3.173 1.279 1.339 1.279 1.738 1.762 1.677 1.267 1.544 1.11 2.196 3.029 3.065 2.413 3.101 3.077 3.101 2.124 4.682 1.931 2.558 3.499 3.053 2.968 3.56 2.474 2.956 2.558 3.403 2.884 2.389 2.268 3.391 8.531 2.112 1.991 2.353 7.686 6.359 4.139 5.563 23.65 3.33 6.998 3.451 13.635 4.585 7.686 4.175 2.281 1.882 1.81 1.919 2.075 1.412 2.003 1.593 1.991 2.148 4.332 4.923 4.054 4.175 4.561 3.885 4.658 2.848 2.594 3.029 3.137 3.318 3.741 4.766 2-Aminobutyric acid 15.875 9.058 10.35 9.105 9.712 9.432 6.023 8.016 8.099 8.266 6.505 8.623 8.785 7.561 4.17 8.117 8.618 11.768 8.395 5.893 12.639 11.509 15.72 8.192 8.914 8.358 8.562 11.194 8.154 10.304 11.249 11.286 9.494 9.878 16.031 6.357 4.652 5.949 6.598 9.581 8.729 8.581 9.261 7.617 11.212 9.137 7.704 7.172 6.672 13.195 9.401 6.227 8.377 6.32 16.995 9.303 14.863 6.931 12.12 6.19 9.285 13.494 5.708 15.623 8.192 7.895 11.268 12.51 14.048 8.34 7.784 14.752 8.685 8.599 15.419 21.498 15.66 10.453 20.386 13.696 24.278 17.699 10.879 7.767 12.695 13.622 7.876 10.101 8.887 11.72 8.249 5.759 5.089 9.167 9.105 11.875 8.576 8.327 7.3 8.903 8.405 11.051 6.646 12.031 9.198 5.198 10.911 7.3 7.984 9.136 8.156 5.619 4.996 7.502 7.471 6.584 6.226 5.899 6.288 6.257 7.362 8.016 4.202 8.078 11.019 37.363 15.299 40.729 23.562 12.993 13.043 10.065 10.259 9.647 3.859 7.187 9.522 10.212 6.369 8.878 6.212 6.949 2.18 7.765 9.788 8.627 37.7 6.573 13.867 8.91 10.588 18.51 9.161 14.635 14.729 8.925 21.038 9.318 18.824 18.353 6.071 7.373 6.447 14.384 14.384 4.533 8.847 22.553 7.137 16.471 9.255 11.933 10.416 6.651 21.49 16.309 10.149 14.902 10.196 21.176 14.98 17.725 9.286 16 6.275 9.192 18.85 10.463 22.431 13.992 7.843 13.192 15.184 20.863 10.588 17.412 18.98 13.532 16.941 26.196 19.137 28.235 11.435 30.118 20.235 21.333 18.196 16 15.719 16.941 13.694 18.824 17.84 23.226 13.801 15.955 18.682 14.541 19.187 11.226 11.68 10.149 21.879 18.682 10.654 6.867 7.355 7.069 6.396 5.975 7.826 4.628 8.381 6.227 5.251 6.496 6.783 7.893 7.86 7.742 7.035 5.335 4.813 9.745 8.853 4.679 8.432 11.798 3-Aminobutyric acid 0.072 0.054 0.055 0.056 0.072 0.04 0.042 0.046 0.085 0.062 0.105 0.26 0.078 0.173 0.031 0.147 0.12 0.084 0.07 0.097 0.05 0.063 0.05 2.637 6.132 3.245 3.28 4.791 3.379 11.62 5.631 10.011 4.301 2.816 2.699 5.497 3.906 4.04 5.05 4.282 3.906 8.465 1.826 2.217 3.754 8.849 4.16 0.029 0.064 0.05 1.901 0.013 0.038 0.027 0.058 0.031 0.052 0.038 0.061 0.042 3.817 2.494 2.521 3.173 2.476 3.28 2.869 3.075 3.504 2.977 2.244 3.629 1.967 2.994 5.068 2.145 3.325 2.834 1.895 3.048 1.591 2.083 2.807 6.889 2.691 1.913 1.421 0.647 3.115 2.24 1.365 1.581 6.344 1.572 1.864 1.054 1.242 6.88 2.795 3.595 1.308 0.064 0.06 0.113 0.195 0.1 0.101 0.115 0.073 0.056 0.079 5.261 3.614 4.565 3.2 1.967 2.908 3.671 2.814 2.833 2.551 2.391 2.221 2.146 2.786 0.031 0.018 0.024 0.012 0.01 0.02 0.033 0.042 0.028 0.029 0.046 0.024 0.04 0.015 0.034 0.031 0.026 0.013 0.027 0.016 0.005 0.01 0.971 1.651 1.18 1.533 2.332 1.016 3.693 2.123 2.486 2.169 0.953 1.189 1.171 1.461 1.606 1.688 1.996 1.515 0.88 2.287 0.954 0.827 1.18 2.232 2.058 0.011 0.014 0.017 0.776 0.025 0.013 0.019 0.054 0.023 0.02 0.027 0.006 0.023 0.857 0.779 0.572 0.73 0.582 0.812 0.666 0.655 0.899 0.805 0.688 1.416 0.708 1.125 0.998 0.395 0.971 0.789 0.593 0.852 0.537 0.476 0.609 3.183 0.589 0.561 0.444 1.409 1.115 0.569 0.824 3.943 0.587 1.034 0.683 2.423 1.034 1.48 0.486 0.035 0.029 0.015 0.024 0.036 0.027 0.031 0.013 0.023 0.031 1.754 1.622 1.338 1.166 1.186 1.146 1.247 0.972 0.949 0.914 1.216 0.761 0.783 1.064 3-Hydroxyglutaric acid 8.631 7.385 10.422 14.494 3.355 7.849 5.488 12.826 5.706 2.261 7.402 9.521 8.198 8.793 12.298 2.188 2.136 1.937 7.207 6.089 0.965 8.631 2.929 4.694 4.833 5.078 10.579 8.264 3.14 9.124 2.268 6.547 4.311 7.405 4.278 7.802 7.273 1.078 8.727 3.14 1.732 2.843 8.061 2.698 4.45 3.788 6.718 9.058 5.078 5.448 7.084 12.364 12.893 11.702 10.248 11.835 9.322 4.198 7.273 11.57 5.217 5.203 7.537 9.851 7.736 4 4.919 6.579 7.736 9.653 9.851 7.736 5.553 7.868 7.471 5.818 8.066 12.893 8.529 5.64 29.025 8 5.937 5.92 9.256 7.669 7.471 6.986 7.027 3.697 5.529 8.061 7.361 8.387 10.422 7.198 6.49 5.618 7.483 2.948 8.224 2.948 5.968 7.328 14.656 8.55 7.402 12.377 12.458 9.934 9.934 16.041 9.527 8.468 7.483 12.051 7.296 8.142 8.712 9.527 6.196 7.239 13.191 3-Indolepropionic acid 0.217 0.413 0.226 0.19 0.192 0.164 0.125 0.299 0.322 0.396 0.17 0.29 0.284 0.373 0.345 0.392 0.292 0.163 0.278 0.299 0.216 0.229 0.248 0.11 0.227 0.235 0.225 0.235 0.144 0.32 0.244 0.401 0.422 0.237 0.269 0.381 0.087 0.282 0.39 0.184 0.208 0.242 0.516 0.246 0.119 0.242 0.662 0.1 0.193 0.163 0.288 0.239 0.157 0.21 0.176 0.263 0.106 0.167 0.216 0.121 0.214 0.943 0.129 0.093 0.095 0.176 0.108 0.214 0.22 0.165 0.11 0.059 0.438 0.18 0.316 0.136 0.191 0.172 0.089 0.165 0.309 0.206 0.064 0.441 0.176 0.208 0.136 0.299 0.46 0.41 0.401 1.258 0.605 0.84 0.614 0.876 0.628 0.706 0.695 0.809 0.561 0.131 0.189 0.159 0.1 0.148 0.19 0.181 0.223 0.114 0.249 0.46 0.259 0.209 0.187 0.17 0.246 0.338 0.083 0.17 0.288 0.112 0.079 0.187 0.136 3-Methylhistidine 1.277 1.306 1.896 2.177 1.103 1.142 1.403 1.461 1.831 1.352 1.646 1.944 1.461 1.624 1.016 2.038 1.406 1.798 1.308 1.297 1.471 1.504 1.577 1.94 3.106 2.769 2.681 8.524 2.976 2.965 3.477 4.992 2.825 2.703 2.758 2.932 1.897 2.027 3.651 2.551 3.074 3.096 1.944 1.875 2.758 3.488 2.515 1.384 1.232 1.744 1.799 1.57 1.602 1.144 1.58 1.471 1.777 1.45 1.352 1.689 1.907 1.983 2.474 2.551 2.267 1.94 2.06 2.027 2.289 1.668 1.526 2.322 2.002 2.343 2.365 2.856 2.834 2.213 2.278 2.169 3.128 2.878 1.853 2.747 1.973 2.594 1.646 1.587 2.709 2.08 2.215 1.722 2.293 1.77 1.616 1.577 1.422 3.183 2.351 1.596 1.287 2.08 1.819 2.264 1.886 1.867 1.993 2.08 1.925 1.732 1.741 2.805 2.109 2.709 2.38 2.012 2.206 2.225 1.877 1.983 1.983 1.645 1.867 2.07 2.631 1.886 1.313 3.732 3.278 1.086 1.214 1.619 2.447 1.566 0.923 1.679 1.351 2.078 1.874 2.519 1.055 0.948 0.367 1.925 1.239 0.972 2.31 1.495 3.727 3.553 3.143 12.798 3.266 5.058 4.74 3.153 4.315 2.15 5.109 4.392 2.345 2.826 2.949 7.29 4.054 1.73 2.631 3.09 1.884 4.003 4.105 3.861 1.198 0.589 1.116 1.876 1.106 1.198 0.907 1.095 1.382 1.106 1.013 1.024 0.843 1.001 1.738 1.781 1.577 1.628 1.106 1.208 1.044 1.935 1.065 1.259 1.587 2.024 1.925 1.351 1.177 1.802 1.27 1.587 1.556 1.485 1.259 1.218 3.801 1.106 1.044 1.362 4.344 3.1 2.429 2.528 7.425 1.985 2.765 1.787 4.631 3.169 2.794 2.182 1.807 1.708 1.501 1.54 2.182 1.205 1.787 1.471 1.787 1.797 2.755 3.219 2.932 3.258 3.002 3.248 3.387 2.478 2.073 2.646 2.459 2.439 2.518 3.199 5-Aminopentanoic acid 0.4 0.189 0.213 0.19 0.595 0.205 0.263 0.085 0.675 1.392 0.761 0.063 0.561 0.588 1.006 0.63 0.428 1.426 3.22 0.897 1.644 1.291 0.558 1.04 0.746 0.981 0.998 1.778 1.031 1.233 1.434 1.426 0.073 1.333 0.973 0.403 0.605 0.65 0.679 0.792 0.906 1.795 0.093 0.784 0.585 1.795 0.063 0.108 0.031 0.046 0.247 0.158 0.087 0.04 0.062 0.117 0.068 0.037 0.112 0.111 0.176 0.309 0.224 2.138 0.368 0.176 0.247 0.881 0.642 0.321 0.067 0.484 0.527 0.344 1.518 0.304 0.646 0.418 0.322 0.34 0.097 0.718 0.295 0.274 0.125 0.097 0.057 0.057 0.109 0.246 0.371 0.11 0.045 0.115 0.064 0.151 0.059 0.045 0.144 0.086 0.214 1.987 0.484 0.9 1.808 1.461 1.532 1.212 1.808 1.194 1.327 1.621 0.918 2.735 1.514 0.716 0.796 1.497 0.691 1.8 0.745 0.818 0.322 0.461 0.998 0.246 0.201 0.436 0.248 0.397 0.321 0.293 1.943 2.541 0.536 0.101 1.064 1.081 1.556 2.268 0.941 0.785 0.696 1.653 1.477 1.24 0.505 1.538 0.679 1.046 2.022 1.538 1.125 1.029 1.371 0.923 0.106 1.213 2.04 0.888 1.389 1.31 0.876 1.081 1.705 0.629 1.213 0.257 0.967 0.967 1.046 0.156 0.156 0.114 0.13 0.184 0.152 0.155 0.571 0.216 0.172 0.122 0.176 0.14 0.139 0.15 0.382 0.164 0.923 0.198 0.502 0.245 0.437 0.363 0.256 0.202 1.916 0.508 0.483 0.639 0.314 0.384 0.608 0.553 1.099 0.204 0.539 0.303 0.242 0.159 0.206 0.147 0.241 0.28 0.317 0.097 0.125 0.201 0.117 0.403 0.063 0.121 0.102 0.228 1.678 1.139 1.183 1.096 1.957 1.696 3.104 1.322 1.974 1.339 2.052 2.148 2.583 1.443 1.27 1.33 2.017 1.391 1.713 1.757 2.278 1.043 0.948 1.304 Alanine 930.715 986.244 694.113 678.42 771.371 701.356 698.942 597.541 712.944 502.056 567.959 782.235 637.456 584.734 511.642 637.456 524.822 847.145 837.559 535.607 684.186 722.53 711.013 618.284 316.331 458.92 430.163 558.373 730.917 294.763 496.065 577.544 614.441 552.382 729.719 393.018 294.763 476.893 372.648 451.731 925.03 617.086 929.508 795.621 765.666 711.746 366.975 943.003 582.337 782.441 981.416 768.062 897.47 671.006 712.944 824.379 940.607 565.562 724.926 651.834 575.148 911.401 371.45 760.873 703.358 772.855 678.195 869.911 856.731 573.95 436.154 663.817 820.864 609.896 735.71 1296.479 952.589 776.45 927.426 766.864 1283.299 1330.03 630.266 575.812 659.024 1053.24 558.373 659.106 627.72 1173.353 766.542 628.927 206.423 1260.268 1283.204 1422.027 756.885 329.553 648.241 654.277 898.122 735.156 463.547 993.487 824.486 344.039 831.729 563.741 980.209 715.842 966.93 520.283 392.325 916.23 779.821 570.984 496.14 585.469 551.669 580.641 758.092 840.179 473.204 873.979 940.373 1951.364 1141.364 2893.476 2119.211 1150.027 1305.963 1469.479 905.051 648.827 346.11 970.267 935.013 883.355 728.38 842.028 509.349 323.38 236.594 715.982 427.73 432.895 1710.963 387.436 521.747 561.008 596.135 772.806 669.49 392.602 528.98 372.972 1244.238 428.763 937.079 802.768 527.946 451.492 446.327 764.541 619.898 332.679 395.702 2669.318 420.497 994.936 671.556 986.511 1300.753 595.102 1317.283 1493.302 1508.418 1171.607 1241.862 959.809 1389.605 1085.855 1019.732 1253.227 586.837 433.929 1285.388 687.054 854.426 848.227 536.212 577.538 712.883 911.25 552.742 795.536 680.855 1198.757 811.033 578.571 617.832 930.88 493.852 935.013 770.74 814.133 852.36 679.821 921.537 663.291 763.508 991.837 1253.984 - 1199.84 1570.187 1796.511 1394.759 - 1339.532 818.663 833.824 2153.864 1650.321 579.345 577.179 607.5 520.869 663.81 432.072 422.326 568.516 623.743 702.794 433.155 569.599 612.914 688.717 689.799 568.516 641.07 550.107 424.492 821.912 674.639 526.283 604.251 734.198 alpha-Aminoadipic acid 16.425 20.96 14.463 19.366 23.656 16.057 23.288 16.302 15.863 11.898 14.58 16.302 13.881 11.594 15.164 16.68 11.081 17.613 17.613 13.531 15.397 14.93 14.218 6.649 5.809 7.687 10.428 7.943 9.903 3.663 8.865 8.13 12.38 7.372 7.174 5.564 5.634 5.634 5.576 9.926 8.923 8.772 9.61 8.713 9.716 8.398 6.803 11.314 15.747 15.397 9.646 11.478 13.297 11.629 14.464 11.664 8.737 13.297 16.097 14.23 10.16 12.257 7.92 11.128 8.912 9.635 8.83 13.297 6.964 7.139 6.66 10.125 9.99 9.32 9.18 8.818 9.658 8.585 8.293 7.08 10.661 11.069 7.512 6.839 8.457 14.464 7.85 9.622 11.142 11.228 9.977 7.648 5.516 10.835 12.502 13.851 12.625 6.08 9.046 9.217 10.615 11.485 11.583 13.483 16.302 12.502 16.179 13.115 18.018 12.993 18.263 3.42 6.3 6.876 8.972 8.175 8.421 7.023 7.219 7.416 7.121 9.548 6.374 8.592 9.132 9.617 9.363 13.59 14.166 8.58 8.131 10.112 17.525 6.988 6.231 6.91 9.228 7.529 20.662 14.929 7.042 6.815 3.245 12.008 10.039 5.506 8.995 3.202 3.927 6.069 5.701 9.076 6.512 2.618 6.869 3.245 7.394 6.696 6.112 6.75 5.961 4.944 3.202 6.134 7.594 2.921 4.23 4.549 4.955 5.182 3.84 3.95 13.739 6.577 13.306 5.24 10.764 11.9 14.712 13.09 11.683 9.39 9.996 20.662 5.972 4.457 3.363 7.151 7.497 9.271 4.922 5.301 9.325 11.359 5.149 7.724 8.827 3.386 12.116 4.901 4.598 8.936 4.836 7.811 8.07 5.701 7.129 7.042 3.57 7.032 8.914 8.773 6.622 6.15 6.38 4.353 7.094 4.342 6.519 3.858 3.616 4.526 3.939 4.469 8.626 9.386 13.475 10.814 6.968 9.501 5.275 9.939 9.133 16.699 3.616 5.113 4.434 7.336 9.156 7.693 7.129 6.288 6.092 7.336 8.718 5.908 5.977 8.004 Anserine 0.257 0.171 0.319 0.266 0.206 0.302 0.577 0.3 0.342 0.244 0.422 0.549 0.196 0.214 0.22 0.384 0.17 0.272 0.309 0.348 0.303 0.347 0.406 0.375 0.275 0.316 0.368 1.149 0.348 0.427 0.4 0.318 0.327 0.278 0.283 0.247 0.243 0.36 0.29 0.314 0.267 0.221 0.415 0.369 0.324 0.249 0.179 0.202 0.129 0.2 0.225 0.16 0.132 0.14 0.266 0.169 0.249 0.196 0.148 0.178 0.187 0.393 0.278 0.253 0.256 0.181 0.143 0.516 0.222 0.129 0.117 0.169 0.355 0.21 0.291 0.224 0.263 0.162 0.217 0.251 0.175 0.198 0.186 0.912 0.156 0.209 0.148 0.262 0.322 0.435 0.333 0.351 0.276 0.284 0.293 0.263 0.241 0.157 0.309 0.355 0.543 0.059 0.152 0.321 0.035 0.098 0.122 0.119 0.067 0.257 0.046 0.24 0.088 0.17 0.058 0.275 0.115 0.115 0.072 0.077 0.219 0.052 0.117 0.127 0.223 5.224 0.375 0.181 0.421 0.891 1.475 1.077 1.6 0.321 0.284 0.095 0.181 0.561 1.663 0.134 0.31 0.094 0.118 0.435 0.106 0.159 1.786 0.294 0.454 1.021 0.128 0.435 1.938 0.204 4.638 0.508 0.246 0.298 0.311 3.4 0.246 0.311 0.233 0.639 3.075 0.224 0.241 0.356 0.106 3.3 0.708 24.09 0.581 0.386 2.938 1.773 0.796 1.325 1.5 1.014 0.985 1.3 1.438 1.563 0.326 0.644 0.194 0.938 0.918 1.131 0.591 0.453 0.904 0.8 0.799 2.563 0.539 0.2 2.338 0.889 1.35 1.248 0.67 1.838 1.4 0.675 1.925 1.738 0.292 1.763 4.95 0.998 0.303 1.16 0.535 1.462 8.377 0.489 0.605 0.709 15.97 2.517 0.287 0.697 0.513 0.332 0.08 0.039 1.421 0.112 0.299 0.403 1.705 2.26 0.966 0.675 2.287 1.322 1.651 3.627 6.293 6.916 2.49 0.88 6.036 5.251 0.41 2.774 Arachidonic acid 8.291 11.326 10.759 12.797 5.333 9.962 14.268 13.241 8.762 10.503 5.701 9.931 10.857 7.741 5.891 8.898 9.429 5.51 6.748 8.98 10.803 7.415 11.264 11.007 19.864 14.15 13.878 14.286 10.014 11.796 14.558 16.871 15.479 12.68 12.231 14.558 14.422 9.007 10.844 10.367 9.116 15.646 19.77 8.49 12.095 12.503 14.851 9.646 8.122 10.014 8.644 11.565 7.878 9.578 17.823 12.612 10.925 7.878 10.694 12.163 10.721 20.23 10.531 14.286 9.388 9.918 13.279 13.741 10.272 11.361 13.578 11.891 15.111 10.571 17.279 13.483 9.81 9.17 17.959 10.694 16.054 14.422 13.143 13.395 15.646 22.449 9.66 13.18 15.939 17.011 10.697 13.885 10.345 10.421 5.931 5.088 8.092 11.77 9.272 18.391 6.084 6.023 7.065 7.249 9.548 6.682 7.034 7.065 4.414 6.973 5.946 13.333 10.789 8.858 9.517 6.835 8.828 9.946 11.019 6.881 6.452 6.759 5.119 5.64 6.835 4.759 6.926 5.241 8.241 4.037 4.944 7.407 14.529 20.69 16.398 8.241 12.107 9.716 5.686 9.011 7.969 13.839 10.958 5.808 5.471 6.835 5.259 20.23 11.985 27.739 12.567 8.996 32.49 8.95 10.008 22.069 14.667 17.471 8.23 23.295 11.326 10.467 8.843 13.088 7.065 21.762 14.605 6.611 29.425 18.697 8.966 12.315 5.211 19.157 5.946 10.685 6.805 5.011 4.536 12.828 8.475 6.989 11.004 8.414 18.084 12.23 8.648 12.536 9.119 6.452 15.326 14.345 12.429 7.602 10.897 7.985 8.031 7.593 6.238 7.433 7.387 7.908 14.023 10.774 8.368 7.663 7.954 20.383 20.926 8.398 6.207 7.663 16.185 9.963 6.704 12.148 17.278 17.204 12.222 12.889 21.111 17.574 15.889 11 12.833 13.963 7.185 14.148 39.815 22.593 19.444 14.444 27.222 9.685 13.037 11.185 12.259 11.593 14.759 17.241 14.519 65.185 45.185 18.889 8.944 25 7.5 7 Arginine 188.796 181.068 108.199 126.968 161.195 76.512 141.321 130.281 201.135 151.676 139.586 157.882 174.757 143.982 135.189 173.658 145.081 170.36 209.928 174.757 169.261 157.171 145.738 139.586 179.153 132.991 117.604 125.297 150.577 136.288 157.171 112.108 106.543 134.09 149.477 115.405 109.91 138.486 113.207 163.766 182.45 145.081 111.511 139.586 139.586 134.09 85.455 148.378 130.793 90.126 111.511 143.982 137.387 114.306 161.568 127.495 75.398 114.306 97.71 146.18 125.297 121.448 108.701 137.387 124.198 123.099 136.288 132.991 128.595 109.91 87.598 112.108 130.281 111.009 120.901 141.784 131.892 103.425 134.09 109.25 147.279 146.18 107.492 111.511 127.495 89.137 109.141 142.425 111.511 135.801 109.634 93.405 59.068 156.778 133.593 110.297 94.729 70.44 128.072 123.656 104.114 105.77 87.553 160.09 136.905 96.165 139.113 103.562 168.923 112.615 149.05 124.76 91.748 129.176 110.076 80.376 97.49 95.392 95.723 104.776 112.615 121.448 97.821 131.385 132.489 37.845 21.811 41.131 40.434 20.118 36.451 27.587 32.533 18.604 6.983 21.313 12.621 22.624 23.372 26.457 7.395 5.469 3.515 20.848 6.75 8.283 29.38 8.432 17.202 14.21 9.442 30.477 24.774 18.791 11.592 9.536 32.865 7.657 17.762 12.434 18.043 14.023 8.376 15.051 13.088 5.712 7.825 39.239 7.152 24.493 5.534 69.615 32.627 17.108 28.139 20.317 37.769 29.448 31.038 34.684 32.159 21.315 29.635 31.038 8.255 16.547 19.918 20.38 22.437 27.766 10.938 12.808 19.445 29.916 22.53 25.802 21.689 40.136 26.083 24.493 17.389 26.363 11.218 31.318 24.774 24.774 27.018 24.68 27.288 31.318 15.986 26.924 29.18 40.434 29.28 39.14 96.206 39.837 37.646 26.292 15.238 33.662 34.16 30.475 28.981 22.807 42.426 27.089 37.247 14.54 17.03 43.422 30.176 52.883 28.284 54.975 52.286 44.717 38.542 48.7 53.68 30.276 22.109 36.65 54.875 28.782 39.339 55.771 Asparagine 58.463 66.63 44.074 41.481 46.407 41.352 46.278 34.611 44.641 39.485 40.491 53.278 43.383 44.012 32.192 55.832 36.09 59.479 50.425 37.85 46.778 56.084 46.019 45.144 49.168 36.467 40.994 53.946 62.12 44.012 53.192 52.437 49.389 43.383 58.347 39.988 30.683 40.491 45.772 45.647 70.419 57.467 58.722 48.287 64.383 55.581 43.815 66.144 44.263 58.85 54.704 52.186 60.611 47.91 47.407 52.437 58.976 40.994 51.683 54.826 50.928 62.611 39.234 69.665 50.802 54.701 60.359 67.275 63 52.814 42.88 59.856 48.093 51.431 70.419 95.066 80.228 71.928 62.12 60.737 101.479 108.395 53.317 48.093 56.084 96.575 58.222 52.5 42.648 73.37 50.426 47.574 25.667 72.981 73.759 67.537 50.426 36.944 55.481 57.685 53.278 45.63 32.278 56.259 63.259 36.426 51.204 39.407 52.37 43.815 53.019 50.296 41.741 71.685 55.222 35.389 49 45.63 46.019 45.759 50.944 64.944 42 69.741 63.13 103.938 70.904 119.157 102.876 64.298 63.944 90.607 83.388 72.583 41.592 77.157 105 89.709 73.704 78.597 51.99 28.442 27.015 65.752 43.529 40.981 73.854 34.15 62.796 58.413 49.238 87.058 85.121 65.854 78.495 47.913 98.629 38.534 77.985 76.762 63.102 48.32 47.403 87.058 50.359 32.621 41.184 120.337 39.451 95.519 65.039 93.32 102.961 61.981 95.01 88.247 114.175 80.738 95.621 98.782 105 88.689 106.019 103.981 75.437 64.019 79.635 84 111.117 89.403 71.359 74.723 89.097 99.597 67.383 92.461 92.053 91.551 96.947 86.243 72.379 105 62.694 94.194 81.044 93.583 90.932 76.15 95.916 88.587 85.937 92.257 98.865 160.449 93.556 112.433 129.775 112.197 143.933 109.365 78.337 77.865 139.213 98.747 57.573 62.41 68.309 68.899 86.478 51.674 48.489 69.371 84.944 70.669 44.124 72.202 62.174 74.326 70.787 72.438 68.309 57.101 47.309 76.096 79.871 77.275 67.837 78.573 Aspartic acid 20.027 33.796 18.619 29.259 16.898 35.986 36.612 14.645 16.554 24.465 9.639 18.776 14.518 19.777 14.166 32.815 14.503 11.5 36.185 28.567 13.375 41.166 28.633 28.127 11.822 23.732 13.844 12.101 9.185 6.475 12.54 6.036 24.408 8.35 14.108 17.58 5.918 8.702 6.446 7.955 21.975 6.871 31.136 12.496 17.58 14.049 17.211 12.042 5.655 12.364 29.884 9.097 12.994 4.073 41.605 15.089 35.892 7.164 9.991 7.618 6.959 31.918 3.955 11.427 7.09 7.867 5.464 7.164 8.966 5.713 3.369 6.358 26.442 5.289 10.357 12.98 8.453 8.087 18.752 8.775 10.343 12.672 8.116 11.171 6.783 26.809 5.625 14.332 21.435 56.483 15.365 12.658 10.233 15.959 21.435 14.535 10.217 3.99 16.741 33.483 16.585 6.963 11.531 11.907 5.883 7.229 5.773 9.2 9.403 5.351 6.869 14.973 5.727 15.427 7.182 4.694 5.445 11.422 8.23 5.429 5.32 7.933 4.334 6.259 8.277 1339.373 655.271 1491.396 1611.966 833.504 625.128 794.188 204.022 131.791 63.234 469.174 185.014 195.152 143.196 191.35 93.647 34.975 34.468 116.584 57.658 80.215 1134.929 50.182 98.463 97.829 33.455 172.342 136.86 65.135 87.691 71.091 2652.536 60.826 139.394 98.209 136.86 76.92 56.264 94.281 85.537 25.091 51.956 1081.197 56.391 140.661 81.862 1372.137 471.405 326.942 596.86 682.792 601.928 620.937 481.543 541.102 576.584 359.89 375.096 675.427 216.694 228.099 437.721 471.405 547.438 634.876 307.934 349.752 501.818 634.876 345.95 489.146 480.275 507.179 793.278 406.777 291.46 643.747 223.03 655.152 446.061 305.399 413.113 311.736 1018.291 665.289 525.895 557.576 1487.464 1072.023 699.829 639.544 - 559.601 1609.345 533.39 1495.328 1286.952 1608.034 931.795 229.345 237.208 279.145 231.966 228.034 161.197 155.954 237.208 285.698 349.915 205.755 258.177 179.544 338.12 393.162 287.009 360.399 214.929 217.55 368.262 359.088 256.866 233.276 339.43 beta-Alanine 1.526 1.526 1.278 1.704 1.169 1.268 1.179 1.258 1.807 1.309 1.553 1.774 1.746 1.736 1.137 3.806 1.188 2.02 2.324 1.553 1.076 1.482 1.437 2.182 1.411 1.858 1.228 1.868 1.086 1.594 1.847 1.847 1.318 1.279 1.533 1.431 1.167 1.908 1.096 1.634 2.243 1.411 2.2 1.594 1.655 1.847 0.74 1.096 1.096 1.665 1.506 1.391 1.421 0.795 1.665 1.665 2.416 1.066 1.37 1.248 2.142 1.665 1.33 1.888 1.736 1.441 1.259 1.898 1.583 1.594 1.117 1.32 1.496 1.583 2.507 2.04 1.949 1.868 1.949 1.421 2.05 1.685 1.462 0.979 1.888 2.629 1.066 0.877 1.665 2.289 1.694 1.08 0.561 1.357 1.189 1.338 1.357 0.644 1.219 1.674 1.179 1.962 1.248 1.902 1.417 0.902 1.694 1.605 1.357 1.466 1.892 1.744 1.268 1.992 1.774 1.328 1.298 2.14 1.506 1.139 1.139 1.377 1.04 1.189 2.031 7.878 5.901 9.267 9.344 6.306 9.44 12.439 21.292 21.111 8.209 8.447 16.399 24.282 14.225 36.06 9.242 7.085 4.965 17.577 12.232 9.876 7.078 8.988 15.674 13.228 12.956 22.017 16.309 20.295 13.409 6.569 7.955 9.876 20.205 12.503 12.05 11.779 10.057 20.567 20.839 5.744 10.329 9.19 8.906 14.768 16.399 7.975 9.006 9.06 8.707 6.673 9.695 12.05 9.006 9.513 11.597 7.729 9.242 9.604 7.42 9.151 6.634 9.785 11.144 9.151 7.04 8.97 8.97 7.529 10.238 9.604 9.513 8.765 15.221 7.946 6.188 11.688 7.91 8.064 12.685 8.462 9.006 6.478 8.534 8.372 10.238 11.326 7.55 9.103 8.409 7.521 12.439 8.206 10.993 12.15 6.692 7.184 11.186 7.329 41.175 32.111 31.918 25.843 41.368 19.093 26.229 24.686 37.607 43.875 39.729 44.936 41.85 51.107 47.829 43.104 45.707 37.511 33.75 43.296 43.779 39.054 41.175 52.361 Betaine 30.402 34.98 37.327 26.763 25.707 27.819 22.889 28.758 24.713 35.396 29.604 49.418 22.911 46.465 26.257 42.604 33.465 32.822 41.574 27.03 33.208 35.396 28.641 60.366 42.861 50.069 33.851 41.574 39.901 65.644 59.723 101.168 77.824 61.01 87.782 51.485 41.059 43.634 37.327 46.208 53.931 58.436 76.767 45.178 51.485 47.238 62.447 32.822 32.95 32.307 42.257 30.119 32.436 28.446 31.149 29.218 39.257 29.218 33.723 29.347 59.723 42.962 56.376 110.693 84.822 75.812 72.208 95.762 88.168 61.911 80.188 117.257 38.149 96.277 83.02 63.069 98.98 72.851 48.01 69.248 83.535 61.267 68.733 73.481 58.436 54.96 51.228 25.354 77.12 66.438 46.6 37.093 30.871 44.253 49.3 37.797 42.609 46.6 55.639 56.226 46.718 34.041 33.219 27.115 33.336 30.05 28.641 39.792 30.167 29.932 25.941 67.847 58.573 70.546 54.465 40.262 48.244 67.26 46.248 44.84 41.084 54.465 50.474 52.939 59.512 17.416 13.435 13.435 14.555 12.813 14.431 11.656 14.182 16.485 4.921 14.555 4.376 12.485 13.576 12.727 7.018 10.667 7.539 10.836 15.394 14.303 11.271 28.97 27.879 38.182 21.939 50.061 23.879 63.394 71.636 41.212 58.469 41.455 63.03 78.424 28.727 38.424 33.091 52.848 39.758 18.788 29.212 52.249 30.061 26.182 15.515 49.263 4.206 21.333 4.715 26.871 4.073 5.2 8.448 7.164 6.315 3.479 19.758 2.133 5.406 33.091 34.459 29.576 47.394 31.758 36.242 40.727 29.455 33.697 37.333 49.939 53.818 34.459 48 25.091 18.545 28.97 28.485 13.939 29.091 21.333 8.739 25.333 84.842 8.752 12.727 13.212 71.407 88.201 47.646 38.565 47.646 41.675 37.569 36.947 17.665 36.699 71.407 31.971 1.368 0.769 - - - - - 0.78 5.909 5.897 27.493 26 30.23 25.254 18.536 22.517 20.651 14.057 14.679 10.363 14.057 19.656 6.382 15.55 Carnosine 0.36 0.197 0.345 0.266 0.208 0.297 0.442 0.28 0.375 0.233 0.38 0.463 0.325 0.352 0.302 0.455 0.218 0.296 0.392 0.367 0.337 0.315 0.355 0.393 0.371 0.343 0.286 0.748 0.389 0.506 0.454 0.35 0.379 0.243 0.276 0.261 0.266 0.38 0.29 0.336 0.262 0.349 0.379 0.308 0.385 0.282 0.225 0.156 0.094 0.141 0.24 0.137 0.09 0.093 0.19 0.149 0.26 0.172 0.164 0.153 0.122 0.324 0.196 0.205 0.186 0.164 0.115 0.333 0.172 0.082 0.085 0.146 0.391 0.134 0.215 0.142 0.194 0.124 0.157 0.201 0.157 0.128 0.15 0.616 0.094 0.16 0.12 0.37 0.401 0.506 0.351 0.346 0.335 0.298 0.342 0.294 0.287 0.222 0.438 0.578 0.46 0.064 0.082 0.128 0.066 0.075 0.104 0.084 0.071 0.177 0.068 0.206 0.08 0.154 0.071 0.16 0.123 0.096 0.079 0.076 0.158 0.073 0.121 0.104 0.159 2.432 0.26 0.199 0.325 0.462 0.926 0.673 0.99 0.742 0.196 0.182 0.516 0.971 0.968 1.66 0.322 0.087 0.183 0.3 0.084 0.219 1.072 0.233 0.544 0.837 0.287 0.857 1.34 0.214 3.068 0.441 0.21 0.219 0.251 3.262 0.202 0.222 0.143 0.523 2.981 0.163 0.35 0.319 0.09 1.738 0.64 8.645 0.435 0.466 1.544 0.821 0.617 0.702 0.827 0.637 0.775 0.943 0.97 1.01 0.441 0.613 0.315 0.675 0.753 0.83 0.553 0.453 0.695 0.524 0.644 1.476 0.473 0.254 1.583 0.661 0.808 1 0.657 1.194 1 0.668 1.078 0.931 0.204 0.817 2.097 0.866 0.216 0.44 0.514 0.651 3.782 0.288 0.428 0.528 6.263 1.002 0.219 0.504 0.333 0.228 0.195 0.136 0.541 0.171 0.175 0.208 0.793 0.935 0.6 0.335 0.883 0.578 0.526 1.3 1.697 2.253 0.701 0.338 1.797 1.4 0.221 0.832 Cholic acid 0.061 0.092 0.038 0.033 0.171 0.051 0.101 0.068 0.015 0.007 0.008 0.012 0.006 0.007 0.019 0.012 0.011 0.016 0.022 0.017 0.029 0.015 0.112 0.007 0.004 0.008 0.013 0.013 0.001 0.015 0.012 0.021 0.031 0.016 0.008 0.008 0.005 0.019 0.015 0.033 0.007 0.022 0.078 0.011 0.007 0.007 0.099 0.137 0.116 0.043 0.327 0.046 0.078 0.106 0.198 0.107 0.012 0.212 0.026 0.047 0.617 0.164 0.122 0.247 0.267 0.168 0.019 0.543 0.094 0.13 0.121 0.019 0.08 0.337 1.262 0.218 1.146 0.063 0.227 0.011 0.091 0.313 0.424 0.082 0.157 0.144 0.127 0.012 0.045 0.814 0.708 0.015 0.019 0.021 0.078 0.034 0.033 0.023 0.034 0.059 0.078 0.055 0.024 0.018 0.033 0.073 0.065 0.251 0.147 0.038 0.062 1.031 0.33 0.872 0.118 0.026 0.249 0.39 0.046 0.086 0.143 0.104 0.07 0.017 0.125 Choline 38.622 32.751 47.273 32.597 32.442 21.474 29.043 35.995 44.259 36.394 31.305 40.012 30.996 19.893 20.664 52.278 34.698 35.16 27.295 37.473 20.664 20.356 40.63 74.176 25.136 38.09 34.081 61.684 30.842 13.493 26.679 15.884 18.384 40.712 37.473 24.211 48.114 46.572 13.941 23.903 39.478 22.823 28.889 80.807 38.707 23.132 12.544 21.281 15.421 25.136 35.686 16.809 21.59 12.491 25.907 21.127 24.982 14.187 15.73 21.127 57.212 39.394 40.249 45.492 45.801 67.082 48.114 58.754 55.979 49.81 23.44 51.815 57.16 34.698 58.6 43.95 41.637 29.3 44.567 42.254 27.141 45.492 36.548 18.538 57.521 42.871 26.679 29.507 27.962 47.427 28.116 33.214 9.887 28.734 25.336 31.052 25.49 8.852 24.1 26.726 36.459 43.256 20.547 25.336 32.442 13.487 45.264 40.63 38.467 43.72 42.175 18.384 12.482 23.018 27.19 25.645 24.563 25.49 20.701 18.075 21.937 34.45 12.606 27.035 23.482 58.134 48.023 58.471 51.899 41.789 50.045 55.1 99.55 118.79 56.885 72.962 97.207 98.88 112.265 110.927 82.651 34.968 38.816 83.822 41.828 38.147 47.349 44.672 73.449 78.97 75.624 69.601 58.057 59.395 62.407 64.247 53.752 39.151 50.695 98.546 50.026 63.745 73.115 66.088 49.022 41.66 49.858 67.064 44.337 103.732 116.281 73.467 80.978 87.169 75.624 41.789 82.484 75.457 93.192 104.234 93.359 93.359 154.427 89.344 96.873 75.792 43.979 73.449 74.955 42.664 80.309 76.628 68.764 62.239 67.928 61.57 51.532 84.42 64.08 59.562 64.916 58.559 56.885 60.901 75.29 56.718 45.006 78.803 52.741 59.228 46.178 46.178 55.774 60.493 67.57 80.713 139.52 86.779 64.874 61.841 73.299 56.111 80.376 66.39 51.899 52.91 41.452 53.752 150.81 51.73 82.735 96.215 60.493 42.294 33.869 52.573 38.756 67.233 52.573 60.998 42.126 47.012 49.371 58.639 49.034 55.943 48.697 45.327 cis-Aconitic acid 3.852 5.519 3.137 2.087 3.796 3.137 4.258 4.958 17.97 5.963 9.113 6.513 7.795 4.142 8.262 2.147 1.26 8.518 6.675 5.181 4.329 5.764 6.779 8.028 5.578 6.721 6.009 0.84 8.448 1.389 7.748 4.282 5.603 8.448 4.936 1.377 3.501 5.566 6.686 4.714 6.395 6.371 10.813 7.503 6.78 3.862 1.751 3.384 2.917 5.193 7.564 3.431 4.831 2.555 4.341 4.329 13.186 1.925 6.546 2.859 4.773 3.011 3.466 6.115 7.631 6.675 5.181 4.341 2.182 3.839 4.131 1.82 7.564 6.243 7.118 5.624 4.948 4.049 5.309 4.971 4.808 5.683 2.38 4.482 4.913 3.547 4.551 2.591 9.216 8.586 4.076 5.028 3.081 4.65 7.227 7.984 5.435 2.115 5.505 7.409 3.011 6.989 5.995 6.121 2.563 1.975 3.474 4.356 4.23 4.202 5.084 5.967 4.468 8.068 6.723 5.042 2.143 7.886 5.869 3.32 7.676 5.336 2.829 7.255 5.799 0.833 0.479 0.497 0.757 0.015 0.514 0.169 0.767 0.076 0.295 0.824 1.196 1.28 0.57 1.317 - 0.411 0.089 0.573 0.846 0.005 0.784 0.413 - 0.214 0.342 0.389 0.37 0.205 0.716 0.033 1.084 0.55 0.75 0.268 0.598 0.364 0.263 0.245 0.03 0.045 0.424 0.691 0.313 0.51 0.651 1.191 0.841 0.557 0.255 1.429 0.28 0.87 1.462 1.679 1.389 0.797 0.495 0.307 0.384 0.513 1.026 0.477 0.155 0.759 0.019 0.167 0.511 1.126 0.715 0.87 1.425 1.239 1.679 0.897 0.502 1.401 0.657 1.377 0.391 1.643 0.53 - 1.566 0.138 0.969 1.244 0.636 1.415 0.071 0.971 0.723 1.099 0.823 0.912 1.323 0.822 0.022 0.768 0.207 1.028 0.496 1.03 0.981 1.511 2.006 1.221 1.019 1.786 1.594 1.352 2.734 2.542 0.445 1.297 2.871 1.8 1.497 1.965 1.158 0.804 1.704 2.074 Citrulline 97.386 105.737 73.93 80.807 99.351 64.105 79.333 84.123 153.874 104.937 102.036 109.912 155.135 109.351 95.982 132.432 105.694 128.649 145.045 114.649 136.216 103.045 76.386 127.387 147.568 162.703 119.694 184.144 160.18 123.856 182.883 142.523 106.965 114.27 174.054 129.91 124.234 170.27 152.613 186.667 189.189 157.658 125.263 161.441 120.198 163.964 108.684 138.739 93.333 103.297 91.614 99.766 98.883 78.072 83.748 97.874 103.423 89.045 117.045 90.559 140 126.491 94.468 147.568 128.649 129.91 166.486 153.874 143.784 145.045 94.595 128.649 115.07 120.45 150.09 186.667 171.532 143.784 142.523 140 206.847 211.892 131.171 124.035 174.054 177.838 133.694 127.719 109.053 109.667 108.193 97.263 50.228 116.298 126.491 125.263 86.579 79.333 128.947 117.281 107.088 89.281 86.211 99.719 95.421 81.298 99.842 80.561 98.246 83.386 90.018 128.947 93.088 148.596 118.754 63.123 108.193 127.719 95.298 96.035 105 121.211 93.333 132.632 143.684 128.219 75.726 102.685 117.26 73.973 56.11 80.438 81.241 63.255 56.818 64.438 80.934 74.905 98.307 82.569 44.35 41.796 32.905 101.781 55.387 38.832 107.616 61.62 85.022 112.409 95.854 155.328 86.453 107.299 153.285 56.511 127.123 86.555 118.54 123.65 106.277 98.613 89.314 165.547 170.657 62.131 75.007 181.918 89.109 88.701 103.212 124.932 64.993 40.672 53.241 93.699 62.131 56.307 61.825 47.825 69.796 47.62 61.518 53.752 38.526 49.46 94.575 67.547 75.825 80.015 64.482 63.664 64.788 71.533 69.693 68.978 66.934 117.26 85.022 71.635 63.358 89.007 62.949 77.869 66.526 76.642 83.08 61.109 163.288 73.985 61.007 82.569 153.425 168.767 103.233 130.411 128.219 112.877 150.137 81.315 70.466 107.068 154.521 131.507 41.973 39.562 35.616 39.89 42.521 30.027 35.616 41.644 27.068 48.438 59.616 68.164 74.411 73.753 59.178 70.137 81.425 58.082 40 69.479 82.74 55.562 78.137 89.644 Creatinine 12.179 13.58 16.49 12.179 12.825 8.751 11.963 12.286 20.047 12.294 17.611 14.226 14.731 13.18 13.513 15.839 13.07 15.617 14.731 14.842 13.845 12.848 14.442 16.503 17.389 16.503 15.174 14.399 13.734 8.517 18.497 12.073 10.012 13.18 9.282 14.731 12.848 15.617 13.845 15.949 16.835 15.949 9.484 16.06 13.513 15.506 8.428 15.728 9.215 10.699 9.915 8.85 9.337 8.894 12.737 12.516 10.943 9.547 10.6 9.326 15.285 10.778 12.848 10.666 11.741 12.294 10.688 14.288 17.057 12.516 10.245 9.293 10.993 11.63 16.725 15.285 16.503 10.489 13.18 12.737 15.063 13.07 12.184 9.592 14.842 12.184 10.511 11.64 12.61 15.196 12.933 10.293 9.991 11.532 12.286 9.56 10.885 9.57 11.209 12.286 10.476 12.071 12.179 13.903 11.532 10.271 12.071 12.825 11.101 12.286 11.424 12.071 13.472 10.713 12.179 12.179 12.502 13.472 9.441 7.296 12.286 11.855 9.732 12.933 13.903 22.028 27.706 29.958 37.497 22.126 30.839 27.51 27.541 16.616 15.607 22.42 17.075 16.8 20.38 18.452 11.2 7.546 4.553 28.734 20.564 8.079 20.168 17.443 11.843 22.216 18.82 16.8 19.187 15.056 19.279 8.831 33.287 8.951 17.993 34.334 18.452 17.902 18.452 18.452 27.816 7.142 7.996 25.063 8.951 28.275 26.072 56.392 9.456 7.014 13.128 22.811 11.934 11.292 10.649 13.495 16.066 10.098 12.393 8.758 7.51 6.564 22.811 9.006 8.125 8.63 7.207 5.37 7.298 9.639 10.557 8.942 18.085 30.154 13.862 7.51 7.353 10.007 12.302 17.075 9.364 16.8 8.538 8.758 26.825 11.475 9.456 9.915 27.413 29.077 26.629 31.035 42.783 38.28 32.797 25.259 45.916 24.084 28.685 32.21 59.72 55.413 53.455 53.063 68.434 46.014 71.664 56.196 59.035 74.406 57.762 74.895 77.832 74.993 61.58 66.476 64.028 59.622 50.322 76.364 74.308 55.315 75.189 81.846 Cysteine 36.48 30.48 40.08 36.16 43.84 22.56 33.2 28.16 47.422 28.627 41.253 50 42.506 37.012 37.205 43.952 46.169 50.024 39.518 34.892 42.699 30.072 32.88 34.41 37.687 37.205 17.639 54.361 31.422 24.578 30.169 25.06 40.56 33.157 52.819 27.084 35.952 45.59 32.193 45.783 47.036 35.855 30.88 47.325 28.434 36.048 44.08 46.265 51.084 37.205 40.32 47.422 34.024 51.373 33.06 39.229 52.723 42.41 56.193 41.349 28.916 25.28 38.843 41.446 42.602 46.554 43.277 51.663 54.843 35.566 40.771 39.229 26.16 37.88 35.084 44.916 41.928 40.289 41.446 37.976 50.12 46.651 40.771 22.8 35.759 34.12 34.988 52.32 31.12 32.32 34.64 23.28 19.68 41.44 52.48 39.44 34.56 24.64 32.8 36.64 39.2 48.16 32.08 49.36 47.12 38.64 55.36 47.84 56.72 36.64 41.92 21.36 25.36 28.24 24.08 30.96 31.92 30.8 24.64 28.32 28.32 27.36 31.44 44.56 33.76 120.822 70.479 185.068 160.137 53.507 10.26 118.904 156.38 144.636 20.521 74.603 82.826 123.62 130.419 153.289 59.709 22.19 14.525 152.053 52.477 50.375 112.192 32.327 39.373 50.19 18.605 218.808 80.353 41.784 84.062 34.861 128.493 40.053 99.514 117.439 129.801 6.799 51.611 67.991 94.57 35.417 46.605 258.904 37.148 142.781 142.163 174.521 193.466 72.318 166.887 65.11 202.119 199.647 186.667 189.757 189.139 128.565 179.868 193.466 127.947 127.947 45.836 116.203 155.762 152.053 66.755 110.64 118.057 157.616 101.987 170.596 153.289 3.625 165.033 131.038 100.132 171.832 98.896 165.651 150.199 127.329 106.313 103.223 43.342 171.214 134.128 176.159 3.893 125.616 4.267 229.178 261.781 282.877 238.767 292.466 105.479 3.116 210 200.411 479.452 174.521 237.808 224.384 486.164 23.11 16.685 22.055 64.822 456.438 4.334 419.041 8.937 466.986 10.548 445.89 10.26 70.192 34.616 18.027 496.712 173.562 454.521 615.616 Cystine 23.436 15.752 17.759 11.313 23.223 2.997 7.129 8.154 19.745 8.965 14.355 36.371 19.234 24.113 14.638 19.801 23.206 24.057 12.426 19.915 15.092 11.234 10.416 8.397 10.894 13.56 1.974 12.085 11.404 9.816 7.149 4.777 27.15 7.149 27.291 7.943 14.411 18.043 12.539 16.908 25.589 17.191 11.953 27.688 13.05 17.929 38.335 22.411 17.305 11.574 16.862 18.213 13.787 22.525 11.348 12.142 17.872 15.433 20.936 11.574 6.638 5.635 12.085 11.461 17.702 19.234 15.943 18.326 23.092 13.05 14.241 9.191 6.617 11.688 10.553 22.809 12.823 16.397 17.191 12.482 27.121 22.582 18.95 10.203 7.83 10.27 12.993 44.824 7.898 12.124 17.161 5.422 4.952 21.9 28.474 14.173 16.307 6.617 17.545 10.16 16.393 21.345 15.966 22.839 22.924 14.258 27.834 17.118 37.567 10.374 17.844 7.684 15.795 11.697 4.781 7.001 18.485 11.612 12.465 14.6 3.539 10.075 18.57 30.395 16.094 0.014 0.043 0.101 0.08 0.064 - 0.052 0.152 0.175 0.426 0.069 0.043 0.037 0.108 0.041 0.213 0.169 0.242 0.178 0.116 0.152 0.045 0.089 0.005 0.068 0.003 0.195 0.052 0.01 0.127 0.148 0.06 0.195 0.125 0.228 0.289 0.005 0.26 0.101 0.113 0.482 0.163 0.203 0.169 0.226 0.28 0.166 0.142 0.055 0.132 0.027 0.137 0.104 0.139 0.121 0.113 0.107 0.102 0.098 0.198 0.074 0.026 0.078 0.077 0.116 0.087 0.197 0.12 0.201 0.067 0.116 0.144 0.032 0.086 0.092 0.122 0.124 0.349 0.129 0.169 0.235 0.096 0.108 0.045 0.149 0.128 0.183 - 0.197 0.079 0.503 0.186 0.788 0.349 0.386 0.331 0.087 0.301 0.247 0.57 0.201 0.168 0.561 0.917 0.044 - 0.017 0.029 0.454 0.04 0.333 - 0.306 0.001 0.317 0.001 0.03 0.015 - 0.434 0.121 0.574 0.38 Deoxycholic acid 0.081 0.064 0.015 0.043 0.062 0.207 0.088 0.13 0.002 0.008 - 0.165 0.002 0.004 0.004 0.014 - 0.002 - 0.002 0.012 0.012 0.179 0.002 0.004 - 0.002 0.008 - 0.036 - 0.008 0.173 0.002 0.002 - - 0.002 0.032 - 0.002 0.032 0.16 - 0.002 - 0.53 0.046 0.05 0.052 0.511 0.052 0.066 0.068 0.202 0.066 0.024 0.07 0.014 0.072 0.072 0.414 0.198 0.03 0.08 0.198 0.034 0.462 0.12 0.1 0.07 - 0.724 0.13 0.31 0.272 0.246 0.15 0.02 0.056 0.234 0.29 0.066 0.177 0.242 0.156 0.058 0.049 0.397 0.784 0.714 0.267 0.024 0.267 0.344 0.066 1.201 0.034 0.4 1.297 0.126 0.154 0.075 0.145 0.167 0.141 0.132 0.053 0.203 0.036 0.077 0.28 0.761 0.929 0.461 0.145 0.919 1.177 0.22 0.147 0.073 0.72 0.502 0.216 0.071 DHA 7.517 11.353 12.354 12.283 8.405 10.097 12.678 15.09 15.168 16.534 10.043 8.885 17.354 15.168 10.44 19.677 15.441 6.914 13.473 13.227 14.621 8.841 10.563 14.621 25.826 15.031 16.261 16.534 11.068 19.267 15.714 15.441 18.333 11.096 12.708 21.727 18.857 12.79 17.217 12.64 10.522 16.534 29.615 7.925 15.851 14.894 19.321 4.632 5.971 7.802 10.295 8.554 7.147 7.16 10.904 9.401 7.338 6.914 13.364 10.125 10.194 23.551 13.323 13.528 9.593 12.735 13.487 13.487 12.025 13.46 13.665 10.481 15.231 10.221 18.037 13.159 11.629 11.574 13.651 11.642 12.435 14.075 18.994 19.462 13.801 18.447 10.289 14.808 14.385 16.782 13.031 15.654 11.888 10.803 6.84 4.583 6.558 13.891 9.942 20.449 7.644 7.319 5.274 8.574 10.168 8.038 7.658 5.838 6.374 7.432 6.6 20.026 13.412 9.985 10.097 9.209 9.463 12.565 11.55 10.619 7.587 7.728 6.685 8.123 9.872 1.351 1.786 1.94 3.084 1.674 2.288 2.623 8.894 11.009 14.388 3.488 5.57 5.079 3.281 4.981 5.406 12.971 9.821 2.278 3.292 3.488 2.288 13.516 7.521 23.98 10.355 4.97 25.942 6.605 4.578 19.184 4.326 15.26 5.134 21.582 5.079 7.249 6.922 8.033 4.153 18.639 8.197 2.874 25.942 8.644 6.605 5.33 1.559 6.355 1.831 3.14 2.322 1.788 2.115 4.469 3.935 2.801 4.273 2.834 7.804 6.769 2.358 7.292 4.752 3.521 9.647 6.387 5.919 3.444 7.041 4.142 3.848 3.74 3.183 4.643 4 4.055 8.535 4.796 4.197 4.371 4.251 10.595 6.6 3.085 2.91 4.851 4.884 3.74 2.86 6.07 5.679 7.549 3.586 6.223 11.609 6.112 5.944 4.605 7.591 6.712 2.833 8.26 25.535 12.823 11.219 8.191 16.047 5.107 6.195 5.693 6.377 6.084 7.912 8.386 7.214 49.535 36.14 9.237 4.674 18.279 4.981 5.009 Dimethylarginine 1.74 1.659 1.413 1.694 1.822 1.367 1.74 1.518 2.1 1.623 1.74 1.962 2.227 1.803 1.485 2.227 1.782 1.782 1.453 1.453 1.443 1.273 1.659 1.443 1.347 1.57 1.283 1.506 1.496 1.124 1.771 1.538 1.46 1.336 1.761 1.347 1.262 1.464 1.103 1.58 1.952 1.23 1.88 1.453 1.146 1.75 0.879 1.559 1.336 1.559 1.729 1.421 1.273 1.326 1.485 1.665 2.037 1.358 1.75 1.464 1.602 1.565 1.421 1.549 1.474 1.347 1.464 1.421 1.655 1.294 1.167 1.326 1.764 1.273 1.665 1.952 1.644 1.591 1.665 1.443 1.888 1.729 1.368 1.08 1.57 1.273 1.093 1.694 1.18 1.612 1.46 1.32 0.926 1.717 1.951 1.6 1.097 0.925 1.588 1.437 1.507 1.507 1.167 1.775 1.799 0.967 1.67 1.472 1.659 1.273 1.6 1.437 1.009 1.507 1.448 1.099 1.135 1.378 1.18 1.18 1.296 1.285 1.157 1.518 1.635 0.961 0.804 1.343 1.386 0.843 1.077 1.183 2.666 2.319 1.658 0.942 1.973 1.94 1.691 1.983 1.311 1.059 0.958 1.886 1.236 1.171 1.205 1.528 1.474 1.81 1.767 2.536 1.593 2.211 1.886 1.149 1 1.376 1.853 1.983 1.853 1.68 1.561 2.027 1.973 1.268 1.192 1.801 1.582 1.582 2.038 1.205 0.933 0.916 0.937 0.889 1.027 1.105 0.88 1.29 1.441 1.022 1.203 1.116 0.904 0.981 0.827 0.961 0.864 0.855 0.813 0.942 0.841 0.903 0.832 1.034 1.398 1.407 0.922 1.105 0.923 0.907 0.881 1.203 0.987 1.257 0.826 0.856 1.033 0.89 0.529 0.883 1.13 1.428 1.162 1.748 1.428 1.695 1.652 1.428 0.745 0.981 1.663 1.364 1.759 1.439 1.194 1.556 1.993 1.332 2.27 1.428 1.993 1.674 1.268 1.961 1.578 1.844 1.535 1.791 1.695 1.514 1.215 1.812 2.079 1.801 1.865 1.961 Eicosadienoic acid 4.128 4 3.348 6.319 4.182 4.081 6.205 7.866 4.946 3.685 2.729 1.089 5.743 1.71 3.585 4.083 5.311 3.817 7.668 3.784 3.452 3.419 4.827 1.58 3.13 0.959 1.125 1.56 0.667 2.005 1.245 3.32 1.297 2.742 1.892 3.95 0.498 0.86 2.393 2.29 1.67 4.714 2.299 1.142 1.52 3.14 2.151 2.466 3.296 3.519 2.918 2.991 3.485 4.614 6.573 3.485 5.079 3.718 4.315 4.017 2.41 4.087 1.978 2.569 1.162 1.032 2.231 2.632 1.593 0.949 1.444 2.221 3.187 1.009 1.72 2.121 1.328 1.713 2.154 2.682 3.817 2.33 2.078 2.904 2.795 4.647 3.718 1.929 2.992 3.758 2.992 5.23 2.924 2.01 1.076 1.506 3.025 5.25 2.245 1.56 0.854 1.593 1.499 2.158 2.272 1.909 2.393 1.983 0.928 4.061 1.681 1.97 3.18 1.728 2.662 2.42 1.782 1.439 4.733 0.854 1.378 3.449 1.607 0.908 1.291 2.318 3.297 3.791 6.931 2.587 3.118 5.002 7.914 2.932 3.757 3.918 1.92 1.363 2.168 3.613 2.243 6.778 1.486 1.239 0.168 0.791 3.649 9.978 7.501 13.282 4.783 3.386 20.439 3.592 2.065 10.323 4.284 8.327 0.695 20.645 2.822 4.783 4.666 4.652 4.542 14.039 4.404 3.686 11.837 3.386 3.572 3.806 0.373 2.918 1.899 3.357 2.732 1.686 2.106 0.798 2.519 0.963 1.087 0.936 1.053 0.867 3.761 1.191 1.466 0.665 0.425 2.271 0.771 0.504 0.867 1.087 0.495 3.768 0.627 0.639 0.201 0.312 0.551 1.06 0.462 0.606 0.198 2.257 4.284 1.514 0.601 0.566 4.643 1.136 1.974 4.217 5.503 11.065 5.421 3.963 4.979 4.785 6.153 5.062 3.08 1.66 1.548 4.374 13.458 8.972 2.841 3.985 4.374 2.467 1.63 2.422 3.806 4.15 4.284 2.019 3.237 30.206 15.402 2.841 1.862 4.157 3.619 1.959 Eicosatrienoic acid 1.271 2.705 1.344 2.216 1.01 2.208 2.999 3.072 0.363 0.01 0.471 0.507 1.967 0.345 0.47 0.146 0.537 0.384 0.867 0.66 0.88 0.679 1.247 1.016 0.358 0.692 1.1 0.59 0.426 0.586 0.666 1.048 0.69 0.472 1.262 0.945 1.741 1.398 1.009 0.757 0.485 1.068 1.923 0.481 0.899 0.783 1.817 0.357 1.372 0.582 1.214 0.796 0.618 0.544 0.984 1.294 0.544 0.032 2.342 1.262 0.536 1.369 0.609 1.54 0.192 0.267 1.359 0.692 0.179 1.003 0.686 0.479 1.784 1.029 0.491 1.106 0.925 0.566 0.414 0.24 0.796 0.867 1.909 0.366 0.441 1.223 0.541 0.202 0.937 0.651 1.304 1.491 1.956 1.336 0.896 0.503 0.53 0.144 1.442 1.548 0.399 1.084 0.285 0.484 0.542 1.434 1.45 0.823 0.872 1.907 0.596 0.961 1.157 1.01 0.847 0.235 0.847 1.23 0.806 0.839 1.239 1.124 1.035 0.444 0.453 0.184 0.098 0.475 0.314 0.003 0.424 0.359 1.565 1.626 0.628 0.243 0.171 0.537 0.887 0.788 0.198 0.965 0.974 0.61 0.029 0.284 0.249 1.078 1 2.522 1.565 1.27 5.513 0.74 0.423 1.539 0.011 2.435 0.261 2.357 0.443 0.267 2.043 1.443 0.726 2.93 0.37 0.116 2.548 0.416 0.767 0.122 0.1 0.957 0.552 0.234 0.437 0.091 0.274 1.4 0.323 0.697 1.261 1.33 0.586 0.359 - 0.496 0.036 - 0.417 0.345 0.57 - 0.233 0.047 0.117 0.256 - - 0.32 0.723 0.067 0.066 0.264 0.068 0.217 1.165 0.083 0.053 0.031 0.398 0.024 0.372 0.456 0.615 0.307 1.346 0.166 0.913 0.738 1.035 0.623 0.31 0.631 0.276 0.199 0.837 2.389 1.598 0.398 0.943 1.78 0.135 0.155 0.114 0.593 0.391 0.003 0.434 0.302 4.496 1.765 1.263 0.037 0.31 0.065 0.21 EPA 0.223 0.47 0.306 0.474 0.221 0.383 0.678 0.523 0.48 0.538 0.356 0.263 0.782 0.44 0.361 0.6 0.345 0.188 0.491 0.435 0.316 0.329 0.4 0.709 1.149 0.639 0.64 0.745 0.581 0.789 0.827 1.153 0.845 0.493 0.604 0.784 0.645 0.595 0.813 0.433 0.458 0.776 0.906 0.311 0.673 0.84 1.27 0.071 0.091 0.16 0.493 0.138 0.135 0.133 0.212 0.213 0.107 0.144 0.269 0.185 0.258 0.764 0.408 0.472 0.208 0.318 0.298 0.456 0.251 0.433 0.429 0.391 0.828 0.307 0.495 0.245 0.286 0.248 0.362 0.313 0.322 0.418 0.466 0.882 0.485 0.514 0.321 0.782 0.854 0.523 0.607 0.641 0.421 0.445 0.395 0.412 0.405 0.843 0.39 1.258 0.419 0.38 0.227 0.312 0.345 0.32 0.252 0.174 0.287 0.329 0.274 0.82 0.982 0.5 0.624 0.543 0.647 0.617 0.501 0.593 0.524 0.424 0.355 0.452 0.46 gamma-Aminobutyric acid 0.163 0.227 0.157 0.222 0.153 0.238 0.187 0.14 0.112 0.149 0.13 0.148 0.109 0.121 0.121 0.179 0.125 0.128 0.124 0.185 0.109 0.163 0.194 0.167 0.113 0.164 0.169 0.101 0.109 0.098 0.172 0.152 0.135 0.133 0.131 0.143 0.097 0.1 0.095 0.158 0.124 0.109 0.173 0.113 0.167 0.134 0.108 0.071 0.081 0.112 0.134 0.098 0.097 0.053 0.133 0.134 0.154 0.097 0.125 0.11 0.198 0.2 0.136 0.119 0.202 0.104 0.095 0.125 0.133 0.118 0.084 0.134 0.187 0.131 0.21 0.154 0.125 0.103 0.146 0.125 0.142 0.106 0.116 0.138 0.167 0.145 0.1 0.096 0.225 0.24 0.178 0.14 0.076 0.127 0.108 0.128 0.124 0.085 0.14 0.217 0.102 0.16 0.083 0.109 0.109 0.114 0.105 0.134 0.086 0.171 0.158 0.199 0.117 0.2 0.143 0.114 0.141 0.186 0.16 0.114 0.111 0.131 0.109 0.124 0.17 0.896 1.229 0.981 1.099 1.871 2.971 1.373 1.845 2.12 1.154 1.686 1.194 1.181 1.126 1.57 1.205 1.162 0.91 1.473 1.707 1.118 0.866 1.246 0.866 1.528 1.886 0.812 1.063 1.125 0.768 0.821 0.917 1.06 1.928 1.039 1.168 1.26 0.95 1.015 1.996 1.267 0.944 1.829 1.432 0.986 1.045 1 0.925 1.859 0.804 0.87 0.92 1.207 0.922 1.256 1.307 0.872 1.473 0.819 1.652 1.528 1.22 1.126 0.927 0.949 1.095 1.199 1.096 0.936 1.331 0.96 1.404 1.657 1.597 1.301 1.192 1.179 1.501 0.943 1.17 1.432 0.872 1.225 1.074 1.027 0.76 0.984 0.659 1.403 1.586 2 0.9 2.3 1.071 2.343 0.819 0.901 1.457 1.244 3.857 3.871 2.371 4.257 5.286 3 6.086 5.871 3.514 2.971 2.629 4.386 2.829 4.171 4.071 4.014 3.043 3.443 2.457 3.214 3.5 3.257 4.171 3.671 Glutamic acid 62.705 83.163 53.626 66.337 55.684 86.189 98.295 60.647 63.5 52.936 45.391 56.168 48.409 53.052 52.82 82.423 50.963 44.81 131.18 67.447 56.883 109.007 75.658 76.734 48.525 60.598 47.248 47.712 46.203 38.077 51.543 30.763 69.484 44.81 49.221 54.329 27.281 37.961 29.254 39.006 55.374 37.729 83.042 37.613 84.628 45.274 47.453 38.309 32.273 61.527 100.958 35.987 52.588 22.173 125.375 42.14 86.718 32.621 40.747 43.533 36.8 90.911 30.531 58.741 32.621 35.871 38.425 38.309 46.087 30.531 24.03 47.944 76.626 33.433 49.918 52.704 45.855 36.568 70.35 49.802 46.319 58.509 56.767 40.795 42.14 107.266 38.541 41.279 83.405 168.263 48.421 55.442 43.337 50.721 54.595 51.447 41.521 31.837 69.363 121.053 51.689 30.505 34.016 37.647 27.842 28.326 29.295 41.279 30.384 29.416 30.505 63.916 28.811 67.789 29.174 25.3 31.111 44.184 38.253 23.363 28.447 41.763 21.668 30.747 33.289 1705.474 1353.039 2024.556 2143.517 1415.299 1464.218 1706.586 1596 1326 727 1275.215 1273 1368 1370 1615 982 540 367 1361 973 788 1582.066 656 1026 1013 919 1330 1086 996 1230 755 1675.456 866 1211 1155 1089 1068 827 1311 1219 537 737 1867.795 856 1185 1164 1358.598 1757 1385 1685 1326.356 1633 1533 1649 1587 1750 1710 1502 1470 1388 1309 1132.906 1414 1535 1490 1552 1501 1448 1526 1379 1430 1437 1176.266 1761 1416 1190 1638 1221 1476 1415 1407 1509 1476 1324.133 1508 1427 1531 1749.946 1542.042 1480.894 1488.677 1765.511 1350.816 1712.145 1590.961 1207.396 1600.967 2036.785 1485.341 764.906 707.094 789.366 757.124 1141.801 533.656 582.574 917.221 981.704 1085.1 911.662 958.356 870.526 1181.825 1405.293 1171.819 1350.816 982.816 816.048 1527.589 1401.958 943.903 1033.958 1343.033 Glutamine 634.758 768.457 607.269 702.232 795.947 749.714 642.255 769.707 920.991 681.91 778.485 632.259 979.878 776.129 719.598 822.061 842.083 818.528 918.636 822.061 797.329 716.065 910.903 790.262 950.434 804.395 829.127 666.6 884.481 754.93 784.373 843.26 802.194 713.709 849.149 898.614 802.039 882.126 691.332 916.28 845.616 871.526 928.396 818.528 744.33 892.725 834.682 711.354 767.885 703.11 992.122 777.307 639.512 645.4 847.971 707.82 717.242 676.022 858.571 687.799 753.752 925.897 654.822 888.014 794.973 989.3 823.239 935.124 761.996 723.131 614.779 802.039 980.876 731.375 782.018 883.303 883.303 780.84 971.634 743.153 1240.158 986.944 766.707 893.41 976.345 1164.783 701.932 869.669 1002.118 810.941 915.901 952.137 693.486 935.893 928.396 1075.84 636.008 739.718 977.128 1032.107 808.442 825.935 652.251 765.958 769.707 637.257 680.99 709.73 863.421 719.726 880.914 758.461 674.743 735.97 918.4 712.229 788.45 805.943 797.196 739.718 894.659 993.371 554.789 929.646 950.888 423.226 261.732 425.453 368.652 278.438 394.268 384.244 467.105 204.294 149.884 229.433 537.941 505.089 261.784 446.573 246.385 57.387 66.421 290.529 104.714 139.618 415.43 90.957 243.305 222.773 163.23 316.194 331.593 191.975 201.214 161.177 445.501 134.485 162.203 203.268 324.407 228.933 103.687 324.407 193.002 67.551 176.576 537.942 95.269 310.034 148.858 647.09 685.772 393.189 665.239 397.61 823.336 654.973 652.92 711.437 690.905 619.042 557.446 861.321 484.557 544.1 299.599 648.814 672.426 799.725 553.34 546.153 660.106 739.155 559.499 685.772 602.617 423.226 821.283 533.834 455.812 769.953 415.775 786.379 662.16 682.692 666.266 566.685 355.287 701.171 781.246 816.15 359.742 471.117 353.059 397.61 889.888 426.567 506.757 472.231 536.829 511.212 495.62 433.25 204.93 193.793 267.301 145.902 211.613 148.129 89.991 172.632 247.253 279.552 189.338 219.409 251.708 319.647 309.623 299.599 279.552 315.192 221.637 335.239 353.059 276.211 228.319 260.618 Glycine 306.695 261.305 283.387 291.974 266.212 218.367 264.985 245.356 294.606 302.855 288.714 225.728 293.427 275.751 236.863 339.386 263.967 311.104 355.884 253.361 274.573 339.386 258.851 328.78 219.187 240.398 212.116 239.22 170.871 200.332 326.423 273.394 279.706 260.432 321.71 285.178 252.183 280.465 258.075 258.075 334.672 299.32 342.272 249.826 258.075 286.357 256.397 259.253 259.253 333.494 325.097 213.295 298.141 227.436 253.361 305.212 334.672 271.037 253.361 284 195.618 311.603 260.432 313.461 279.286 308.747 262.788 284 285.178 238.041 221.544 202.689 355.767 279.286 312.282 353.527 288.714 265.145 254.539 266.324 302.855 370.025 301.676 187.698 269.859 267.502 246.29 283.387 295.654 341.045 350.86 257.624 155.801 291.974 285.84 305.469 234.315 199.965 325.097 333.685 280.933 245.356 176.657 246.583 318.963 217.14 280.933 228.181 303.015 225.728 310.376 252.717 212.233 339.819 298.108 190.151 258.851 338.592 283.387 239.222 212.233 226.955 225.728 293.201 347.179 1122.53 683.621 1504.19 1347.036 680.253 729.644 965.375 756.983 640.444 305.523 683.621 730.736 780.081 703.438 733.885 427.312 249.878 195.283 559.601 356.969 355.919 944.047 360.118 430.462 582.699 412.614 714.987 385.316 523.904 704.488 352.769 1404.285 365.368 692.939 661.442 497.656 522.854 486.107 671.941 538.603 266.677 337.02 1495.209 342.27 640.444 550.152 1113.549 594.248 477.708 670.891 867.715 611.046 594.248 670.891 615.246 762.233 619.445 655.142 701.338 410.514 362.218 762.198 617.346 619.445 617.346 478.758 439.911 516.555 534.403 423.113 659.342 457.76 1041.708 794.78 489.257 387.416 577.449 348.569 477.708 645.693 449.36 461.959 549.102 1058.545 448.311 543.852 676.14 1416.632 1244.885 958.64 993.439 1442.451 762.198 1224.68 1106.814 709.439 886.798 1485.107 1038.34 699.336 643.209 569.123 615.146 986.704 493.913 656.68 672.395 801.486 756.585 724.032 932.822 773.423 969.866 926.087 982.213 970.988 652.19 633.107 764.443 852 704.949 820.569 894.656 Heneicosenoic acid 10.998 10.242 7.526 7.664 7.767 7.114 9.863 12.716 3.688 2.943 4.826 6.427 3.453 2.197 3.139 6.513 4.061 5.532 6.258 4.885 3.786 4.081 4.846 3.394 5.493 3.257 5.219 3.865 2.845 4.63 3.257 5.689 2.67 2.393 2.904 4.414 2.099 3.708 7.887 4.238 3.257 5.944 7.87 4.159 4.041 5.199 6.152 4.826 4.532 6.71 6.049 4.375 6.768 5.238 10.045 6.494 6.082 7.082 6.18 4.905 5.925 16.221 4.473 4.532 3.355 5.003 3.335 4.041 3.06 3.002 3.119 4.081 7.32 2.413 4.787 3.335 3.649 4.414 3.531 4.434 4.512 4.767 4.277 5.602 4.375 5.532 2.786 2.622 6.77 6.392 10.035 10.482 8.592 7.63 4.949 3.351 6.358 16.771 7.114 14.159 2.567 8.42 3.712 10.482 14.297 7.698 12.304 3.54 4.571 7.389 5.533 4.09 8.592 4.708 5.361 5.705 6.599 6.839 11.754 3.193 4.433 5.499 3.884 4.571 3.918 3.408 3.312 3.732 3.28 1.648 2.472 3.1 5.451 2.092 4.235 6 0.954 2.714 1.992 2.151 1.311 7.734 2.471 1.116 1.197 1.97 2.988 8.25 3.904 8.25 2.449 1.396 9.944 3.617 1.112 6.961 3.604 6.629 1.469 10.202 2.003 4.235 1.075 3.591 1.934 7.071 3.141 2.1 8.765 2.096 1.528 4.76 2.482 1.864 1.013 1.588 1.683 1.455 1.031 3.867 2.497 0.854 0.63 1.709 2.092 1.167 1.64 1.359 0.726 1.248 0.906 1.142 1.086 0.284 0.773 0.737 0.453 3.124 0.615 0.899 0.976 1.293 0.238 1.075 1.053 0.722 1.153 1.503 3.688 0.368 1.105 1.598 3.3 2.352 1.664 2.836 5.68 5.32 4.52 5.24 4.08 4.44 4.64 3.612 3.524 2.076 2.488 6.28 8.56 6.92 2.812 5.16 3.236 3.364 2.432 2.484 4.48 2.352 2.24 3.024 3.372 16.8 9.04 4.52 2.52 4.08 2.284 2.04 Hippuric acid 53.277 16.079 15.911 113.545 53.518 42.188 24.589 8.871 34.904 106.23 70.061 30.134 133.04 29.087 11.862 44.768 9.814 70.567 112.553 23.37 85.489 107.241 15.115 81.443 124.44 51.85 18.767 69.049 59.944 51.344 79.672 65.508 12.897 91.054 20.765 91.054 19.4 92.066 97.63 106.988 41.733 86.248 15.887 16.111 74.361 32.628 23.794 13.936 74.108 73.855 73.286 79.672 56.403 21.069 53.874 56.15 83.719 89.283 114.07 69.808 61.461 44.116 53.621 49.574 49.574 53.874 51.85 32.881 35.41 43.504 44.768 65.255 76.179 52.103 49.574 51.091 61.461 44.515 53.874 60.45 49.321 56.15 46.286 25.071 75.625 42.998 56.909 15.38 55.688 55.688 53.759 11.282 58.339 35.92 24.348 65.571 67.741 32.786 46.768 49.42 66.054 16.055 34.232 27.482 50.143 17.164 43.393 65.33 33.268 9.474 53.518 34.955 38.571 58.098 73.045 10.487 63.884 73.527 42.67 31.339 92.089 48.696 52.554 71.357 71.598 Histamine 1.156 1.884 0.764 2.023 0.587 4.116 2.879 0.785 1.541 1.741 1.482 0.838 0.912 2.094 2.706 2.588 1.624 0.236 1.494 2.318 0.945 1.588 1.538 0.773 0.685 2.165 1.376 0.64 1.729 0.768 0.767 0.807 2.462 0.982 1.6 0.512 0.874 0.535 0.516 0.632 1.753 0.438 1.445 1.412 1.706 1.859 1.445 1.765 0.178 0.739 0.657 1.071 1.506 1.8 1.518 1.6 2.235 1.318 1.235 0.545 0.527 1.873 0.047 0.572 0.942 1.149 0.214 0.604 0.493 0.738 0.621 0.568 2.624 1.388 1.659 0.592 0.715 0.679 2.118 0.872 1.235 0.944 0.856 1.014 1.329 1.471 0.659 0.387 1.329 0.97 0.929 0.682 1.006 1.445 2.566 0.835 0.785 1.074 1.111 1.12 1.41 1.48 1.202 1.225 0.503 2.624 0.676 1.827 1.046 0.932 1.225 3.017 1.457 0.802 0.748 1.072 0.667 1.618 2.092 0.882 1.032 0.472 0.348 0.371 0.845 3.042 7.031 2.518 1.426 1.259 8.535 2.774 0.96 1.796 0.428 1.482 0.88 1.159 3.192 1.397 3.724 0.186 0.455 1.283 0.403 0.714 1.515 0.661 2.993 0.68 2.546 3.905 10.071 0.467 5.226 8.143 4.067 0.545 2.67 1.273 0.922 4.2 1.397 0.311 3.857 1.178 2.708 1.983 0.14 6.746 0.243 6.318 - - 1.558 1.17 0.782 0.608 0.998 0.644 0.218 0.868 1.938 1.596 0.073 0.316 0.634 0.75 0.215 1.112 0.314 0.297 0.532 0.165 0.025 7.211 0.098 2.485 2.309 - 2.594 0.308 0.552 3.715 0.302 0.495 0.988 0.845 0.528 1.387 7.933 0.47 0.906 4.234 3.109 0.84 40.334 2.095 5.192 0.88 3.008 5.805 3.097 5.136 1.326 1.203 4.758 1.248 3.443 3.164 2.306 3.766 4.635 6.106 2.318 3.844 4.368 4.68 2.518 7.443 7.276 4.735 9.226 1.772 9.961 4.557 0.992 3.053 Histidine 68.799 74.137 75.56 62.038 68.324 69.392 72.476 77.814 85.597 65.298 72.966 74.374 95.86 74.545 68.455 88.304 73.869 75.899 74.996 69.132 70.824 66.425 58.36 67.666 77.703 65.185 60.561 78.154 73.305 86.274 72.29 82.44 60.14 72.177 77.816 71.726 69.019 80.522 67.215 80.184 77.703 69.696 68.68 76.237 67.553 76.011 60.495 78.38 75.109 72.064 60.614 70.824 74.433 67.44 76.237 70.936 76.011 76.35 83.229 70.598 69.696 66.426 55.035 86.5 77.478 81.425 74.433 90.785 66.2 65.185 57.403 81.537 58.36 64.959 79.169 90.221 91.462 80.635 74.545 65.523 110.634 107.251 59.208 69.866 72.854 100.709 56.952 82.321 65.952 71.171 65.952 55.395 44.482 70.222 64.529 64.41 59.072 37.009 62.631 70.697 58.36 75.204 76.865 89.913 73.781 63.935 73.188 61.326 63.817 69.273 85.168 64.173 56.225 71.764 67.375 64.054 69.273 56.462 50.176 53.378 61.326 72.12 51.599 67.257 81.491 82.245 59.082 110.891 94.89 59.865 69.489 77.993 98.323 72.939 51.7 57.963 88.894 85.683 98.53 84.543 53.668 41.132 31.911 81.953 49.835 43.515 71.615 41.961 70.66 64.443 55.948 91.692 67.241 109.823 76.876 50.456 75.531 43.308 91.588 88.894 65.687 60.921 58.227 94.386 72.525 43.308 44.758 90.525 55.844 76.565 64.754 69.601 52.321 42.997 47.141 53.487 53.15 50.042 47.555 53.668 59.056 44.033 65.272 49.938 48.281 38.956 52.256 39.474 45.172 45.794 48.073 41.753 43.618 45.276 40.407 46.623 51.285 58.858 47.452 48.281 36.677 50.974 46.934 46.105 38.645 50.249 38.438 35.226 76.986 41.132 36.988 40.614 75.531 88.735 68.593 73.517 108.093 75.307 85.266 67.027 44.424 55.613 94.33 72.958 69.712 69.936 58.075 70.608 88.847 56.397 79 69.041 75.084 75.307 44.424 71.503 58.858 68.37 77.433 77.098 63.222 50.69 40.843 60.201 75.979 60.873 69.936 78.105 Homoarginine 0.996 0.941 0.704 0.718 0.996 0.95 0.609 0.84 1.105 0.737 0.585 0.567 0.913 0.96 1.074 0.758 1.003 1.309 1.278 0.826 1.688 1.005 1.06 0.628 0.78 0.439 0.506 0.051 0.642 0.602 0.431 0.433 0.453 0.592 0.753 0.421 0.471 0.668 0.453 0.552 0.576 0.709 0.305 0.54 0.499 0.46 0.402 2.27 1.156 0.85 0.27 1.483 1.238 1.728 1.268 1.289 1.483 1.483 1.626 1.555 0.437 0.319 0.505 1.033 0.515 0.687 1.007 0.779 0.72 0.941 0.548 0.89 0.313 0.63 0.673 1.043 0.911 0.536 0.924 0.749 0.948 0.802 0.702 0.493 0.972 0.841 0.674 0.599 0.478 0.269 0.318 0.247 0.226 0.414 0.371 0.289 0.322 0.227 0.584 0.397 0.304 0.776 0.702 0.709 0.713 0.529 0.996 0.649 1.489 0.694 1.17 0.317 0.246 0.395 0.337 0.182 0.326 0.351 0.26 0.298 0.421 0.398 0.28 0.489 0.471 0.16 0.129 0.154 0.153 0.124 0.119 0.099 0.131 0.132 0.125 0.045 0.132 0.165 0.231 0.107 0.138 0.177 0.129 0.135 0.217 0.136 0.198 0.092 0.111 0.097 0.117 0.024 0.099 0.146 0.105 0.06 0.092 0.096 0.188 0.18 0.123 0.089 0.088 0.132 0.111 0.081 0.093 0.074 0.09 0.096 0.059 0.129 0.354 0.147 0.15 0.049 0.284 0.197 0.304 0.224 0.269 0.215 0.259 0.214 0.16 0.053 0.042 0.101 0.138 0.086 0.088 0.124 0.106 0.136 0.172 0.144 0.164 0.071 0.125 0.114 0.124 0.139 0.077 0.174 0.111 0.125 0.093 0.108 0.106 0.122 0.065 0.153 0.094 0.055 0.053 0.068 0.075 0.082 0.078 0.047 0.066 0.093 0.08 0.061 0.155 0.155 0.071 0.1 0.09 0.128 0.155 0.213 0.125 0.215 0.058 0.057 0.059 0.07 0.053 0.084 0.088 0.068 0.058 0.096 0.078 0.056 0.09 0.1 Homocysteine 3.813 4.915 3.974 3.982 4.16 2.661 3.771 3.864 5.805 3.12 4.398 6.991 6.003 3.992 4.646 5.062 4.884 4.854 4.061 4.24 4.953 3.418 4.406 4.755 5.052 6.043 5.369 3.735 6.271 2.239 5.349 5.141 6.287 4.24 5.042 5.795 4.319 5.954 5.3 6.885 6.488 4.091 4.601 5.339 3.299 7.182 3.906 5.854 4.18 4.636 4.067 4.141 4.042 4.121 4.497 5.696 4.646 5.567 5.131 3.754 4.557 4.449 4.695 5.488 5.26 4.616 5.854 5.904 6.726 4.507 4.081 5.458 4.567 4.081 5.26 7.122 6.964 5.181 6.31 6.419 8.598 6.657 6.013 3.737 5.082 6.815 4.785 5.847 3.949 4.449 4.203 3.644 2.33 5.262 5.931 5.22 4.974 2.703 4.474 5.101 3.186 5.033 3.728 5.228 5.05 4.491 5.499 4.999 3.974 3.618 3.669 2.983 4.533 4.872 4.033 4.398 4.787 5.203 5.398 4.525 3.66 3.279 3.957 4.694 6.118 3.332 2.295 3.226 3.313 2.209 1.344 3.332 12.292 6.444 3.795 1.959 6.564 5.388 7.698 6.146 5.215 5.347 3.574 9.01 8.473 5.478 2.391 9.249 6.146 9.368 6.862 8.056 8.593 11.755 8.533 5.788 3.467 11.278 14.142 10.92 14.918 6.146 6.862 6.206 15.992 6.265 4.314 2.66 11.099 6.862 9.07 9.094 3.694 2.697 4.911 2.612 5.931 4.35 4.786 4.255 4.869 2.799 3.646 3.455 2.888 2.232 1.988 3.801 3.801 5.084 2.196 2.721 3.169 4.338 2.614 5.215 5.347 1.479 3.216 4.613 3.467 6.922 2.548 6.683 3.938 4.696 3.938 3.431 1.748 4.577 4.237 4.869 1.748 3.524 1.517 3.726 4.945 4.369 3.908 4.081 2.429 1.335 3.284 4.062 3.159 2.554 2.381 2.065 4.561 1.556 1.709 1.027 2.333 4.091 0.78 4.993 1.373 5.243 0.625 6.078 1.239 3.467 2.42 1.498 8.412 3.697 6.779 6.194 Hypoxanthine 19.95 15.794 20.465 25.175 15.081 23.908 22.127 108.221 117.677 58.839 17.931 59.189 54.286 61.29 71.447 43.779 19.788 16.216 65.843 31.135 28.509 23.196 27.703 49.733 49.733 50.083 56.037 37.124 49.032 47.281 36.424 28.144 37.475 39.576 42.028 38.876 49.382 61.29 72.848 75.65 44.479 52.184 36.813 46.931 86.857 72.147 62.938 37.124 30.855 29.524 13.617 35.724 27.948 22.205 57.088 37.475 29.244 51.834 39.576 50.083 33.972 15.358 24.866 30.855 15.375 25.777 40.276 25.497 22.625 18.422 25.917 19.158 21.731 18.002 23.22 16.391 22.029 21.364 30.96 24.656 14.78 15.34 12.433 33.527 21.154 12.748 14.885 26.442 29.806 23.354 44.333 62.542 56.604 33.29 46.708 41.167 43.146 57 34.952 28.777 21.217 22.365 31.429 60.167 33.527 43.542 36.733 57 29.965 56.208 38.356 52.25 45.125 37.288 39.583 51.063 36.417 44.729 66.896 29.569 45.917 28.54 28.698 Indoleacetic acid 0.424 0.421 0.626 0.47 0.586 0.564 0.62 0.959 0.487 0.447 0.455 2.929 0.681 0.516 0.487 0.532 0.622 0.601 0.489 0.477 0.576 0.467 0.609 0.443 0.542 0.511 0.357 0.647 0.92 0.502 0.477 0.791 0.653 0.527 0.541 0.498 0.35 0.427 0.511 0.564 0.612 0.686 0.536 0.387 0.527 0.716 0.753 0.467 0.459 0.45 0.734 0.578 0.373 0.314 0.348 0.551 0.399 0.339 0.44 0.399 0.573 0.839 0.403 0.51 0.357 0.33 0.453 0.458 0.587 0.418 0.293 0.391 1.457 0.427 0.544 0.637 0.636 0.519 0.545 0.556 1.022 0.972 0.367 0.61 0.653 0.698 0.299 0.599 0.591 1.02 0.736 1.25 0.673 0.916 0.713 1.104 0.799 0.629 0.644 0.844 0.883 0.38 0.411 0.519 0.389 0.336 0.543 0.481 0.469 0.337 0.594 0.569 0.477 0.53 0.466 0.439 0.456 0.427 0.287 0.491 0.491 0.449 0.401 0.469 0.489 Indoxyl sulfate 11.205 16.51 15.438 8.006 16.894 6.589 12.871 14.902 19.635 10.465 10.956 17.87 16.552 8.384 10.23 7.186 6.813 13.528 7.324 9.955 9.484 8.953 12.412 5.321 21.402 13.862 9.091 9.896 14.039 22.384 14.353 20.027 20.494 10.132 9.562 6.322 6.676 6.597 18.319 8.247 10.308 21.991 21.069 10.406 6.853 17.357 15.208 15.021 6.892 11.153 11.339 6.951 7.383 9.503 9.562 9.189 5.184 5.36 5.242 9.955 12.763 16.855 7.913 5.714 4.752 6.244 4.064 11.094 5.596 8.364 8.895 3.181 32.178 9.425 10.563 10.19 7.893 8.62 5.105 5.596 12.861 8.129 7.206 27.007 9.562 9.346 32.201 21.261 22.218 11.301 10.113 22.601 19.728 22.41 18.043 12.45 20.494 13.944 30.263 27.581 13.446 17.506 16.012 12.948 9.155 21.835 18.196 15.936 10.477 21.069 10.63 26.049 18.33 27.773 18.33 7.891 13.599 20.111 13.331 16.472 15.534 11.071 14.155 22.984 14.959 0.294 0.316 0.376 0.316 0.465 0.414 0.258 0.631 0.499 1.891 0.393 1.069 0.48 0.513 0.391 0.832 0.565 0.934 0.482 0.402 0.389 0.176 2.511 1.089 0.422 3.942 0.753 0.584 1.422 0.689 1.16 0.728 0.452 0.48 0.502 1.894 1.764 0.422 1.069 0.565 0.328 1.395 0.54 0.251 0.469 0.741 0.388 0.419 0.13 0.221 0.626 0.229 0.179 0.278 1.885 0.234 0.207 0.221 0.124 0.375 0.422 0.573 0.278 0.469 0.11 0.639 0.096 0.309 0.477 0.314 0.309 3.087 0.85 0.342 0.223 0.223 0.369 0.582 1.265 0.306 5.072 0.138 0.728 0.614 0.229 0.328 0.367 0.841 0.976 0.34 0.86 0.595 0.706 0.752 0.768 1.021 1.154 0.653 0.72 0.229 0.357 0.255 0.181 0.306 2.722 3.541 0.313 2.093 0.357 0.622 0.34 1.043 0.33 0.275 0.352 0.308 0.397 0.966 0.369 2.433 1.506 0.715 0.253 Isoleucine 98.77 127.024 104.35 100.432 96.158 72.772 92.834 137.708 147.789 102.316 90.758 101.263 127.895 104.211 109.895 195.158 132.632 100.421 136.421 133.579 127.895 93.6 91.054 63.474 98.526 92.368 61.295 106.105 72.095 83.937 67.737 76.547 68.498 66.789 100.421 54.379 70.768 74.653 50.968 77.4 84.411 70.863 61.731 92.368 72.095 91.421 73.84 149.684 116.526 108 80.607 120.316 101.368 100.421 110.842 107.053 122.211 104.211 126 100.421 80.053 55.914 68.968 90.284 70.295 76.168 110.842 88.768 86.684 77.021 53.905 93.126 53.54 60.442 76.737 110.842 86.968 76.737 80.242 73.232 126 151.579 66.126 54.846 77.874 151.579 68.495 86.661 63.393 72.297 63.749 59.12 28.966 77.995 67.192 59.357 66.48 32.646 74.79 69.448 52.709 122.275 86.661 118.714 123.462 84.406 114.084 89.273 89.629 121.088 129.398 70.872 60.188 80.963 80.369 79.538 87.017 63.868 72.415 71.466 58.882 111.829 53.184 102.45 83.1 95.765 60.52 91.234 92.241 57.298 80.862 69.583 81.549 62.928 49.464 65.656 79.926 65.889 70.568 84.891 52.424 27.788 29.125 81.358 45.645 35.809 54.176 20.721 50.992 38.769 34.186 63.597 52.902 67.034 45.454 37.05 62.333 29.793 47.841 47.459 44.594 32.467 30.175 37.337 25.305 31.034 24.828 61.427 31.416 59.491 46.981 54.881 62.833 39.342 44.69 48.738 55.576 45.167 49.942 49.464 56.149 46.504 58.918 52.52 53.093 42.493 41.69 32.276 36.382 31.416 37.91 41.156 31.416 41.347 33.613 33.995 46.599 64.75 31.321 35.045 35.809 29.984 39.151 35.332 37.814 41.252 45.836 33.804 43.2 39.247 44.021 31.703 46.523 70.993 58.607 61.225 49.242 72.201 56.09 89.924 34.238 47.329 54.277 42.495 59.513 56.895 60.52 62.836 106.741 58.909 63.038 79.049 78.747 74.215 45.919 67.368 60.923 66.764 67.972 59.312 59.211 47.53 41.992 45.617 78.042 49.846 62.937 64.347 Kynurenine 0.708 1.138 1.815 0.821 1.171 0.89 0.978 1.224 1.252 0.716 1.388 1.385 1.315 1.221 1.117 1.513 1.91 0.986 0.964 1.315 0.642 0.917 1.006 0.528 0.48 0.509 0.362 2.891 0.836 1.117 0.612 0.762 0.973 0.505 0.452 0.788 0.723 0.899 0.554 0.694 0.72 0.611 3.448 0.616 0.482 0.699 0.85 0.845 0.604 0.825 0.757 1.085 0.579 0.725 0.897 0.721 0.61 0.733 1.035 1.388 0.754 0.763 1.085 0.45 0.326 0.653 0.582 0.571 0.615 0.355 0.542 0.329 1.002 0.472 0.75 0.845 0.827 1.075 0.6 0.482 0.918 0.935 0.6 0.964 0.624 0.676 0.587 0.852 0.625 0.641 0.813 0.723 1.321 1.007 0.881 0.754 0.716 1.428 0.915 1.192 0.968 1.332 1.044 1.514 1.321 1.944 2.008 1.171 1.031 1.048 1.085 2.417 0.988 0.893 0.933 0.909 0.772 0.868 0.905 1.117 1.031 1.018 0.709 0.758 0.851 Lactic acid 14435.305 19300.612 12201.842 19734.405 15937.77 11916.019 9470.086 25669.649 20298.17 9878.468 13814.716 7898.062 4920.31 4864.799 13934.57 15085.165 5891.756 19609.327 8727.873 9555.494 11362.131 12074.945 12916.398 12771.358 6243.747 5272.301 7740.026 9835.573 13117.041 4120.444 6380.002 6792.551 7330.211 7610.079 8606.757 7463.731 7364.064 5436.312 4996.007 6737.04 8225.749 6682.79 11913.49 14863.12 8122.296 7428.406 4484.632 13588.886 4728.544 7594.94 26556.205 8650.914 12077.468 5453.974 9155.561 12503.895 12115.317 8213.133 6541.489 9817.91 9086.172 8588.589 5389.632 8724.088 10388.162 10241.814 7462.47 8576.478 12778.928 5964.929 6873.294 9999.583 12877.192 11103.499 11131.255 10291.017 7225.286 7709.747 11941.213 8175.284 9026.876 8483.119 6190.759 11354.491 7900.251 7950.716 6334.583 1771.847 17169.59 17527.5 9390.41 12198.047 1480.966 10567.847 10585.553 15949.153 11413.932 1421.525 6376.626 9982.29 12079.165 13686.601 4102.692 8355.884 10684.2 4225.368 8835.206 10094.849 7647.651 15477.419 12253.694 16271.651 7302.387 11274.815 10311.113 24153.272 7603.386 9361.322 11028.198 9041.352 11088.904 13675.219 5748.069 9821.673 12063.989 10471.861 10316.088 14897.122 21196.854 13040.823 16228.983 14963.325 10916.274 14819.425 4517.569 11131.302 8200.524 7870.23 9273.091 8063.197 6086.169 7431.022 5837.561 7877.333 10136.117 6296.894 10423.831 7158.736 3440.266 7235.687 7119.669 5997.38 8806.655 1734.339 7194.252 2573.688 9394.429 5964.233 8478.728 4776.832 8160.273 6328.858 5520.289 5932.269 8668.144 6163.119 2040.956 15958.976 6259.011 5142.641 4799.325 14980.201 11183.824 8188.685 7873.781 11348.086 12006.599 14794.564 10239.112 10533.891 12011.335 9835.42 12087.101 5906.224 12494.345 14738.923 7304.47 8574.62 6250.724 6443.692 7246.341 11200.398 5238.533 7292.511 10133.75 8048.991 6281.504 11627.18 7032.065 8395.859 7222.664 6528.929 8384.02 9950.253 6890.003 8188.685 8298.783 15354.525 5263.84 10324.349 6068.411 6961.034 8243.005 10556.238 18080.09 11746.606 9513.855 19262.669 10434.216 20212.886 8390.989 6939.701 11018.366 12442.394 10349.839 12320.371 11120.917 9607.319 12415.133 14081.908 9761.795 11376.645 12322.968 15592.909 8879.079 10889.853 14305.183 13801.516 17838.641 8732.393 12156.809 9937.04 9628.089 10201.854 17959.365 8679.17 12494.318 16392.545 Leucine 157.241 190.345 178.522 145.419 150.148 126.502 131.232 223.448 242.115 149.075 137.445 150.148 191.366 161.762 162.819 275.947 193.48 143.789 206.167 191.366 183.965 125.815 126.502 101.815 141.674 144.846 88.282 160.705 95.366 108.899 94.097 95.26 100.493 91.771 151.189 83.524 109.956 118.414 72 104.141 127.93 105.727 111.133 159.648 108.899 124.758 131.232 207.225 176.564 164.934 131.232 186.079 168.106 154.361 169.163 171.278 174.449 155.419 191.366 150.132 134.273 94.227 99.489 130.044 103.295 118.414 146.96 121.586 126.872 107.841 78.449 125.815 81.813 88.493 105.727 154.361 126.872 116.3 111.013 111.013 187.137 228.37 96.952 76.847 120.529 220.969 98.537 143.054 108.177 115.271 100.493 89.852 42.68 121.773 104.749 104.512 99.547 50.365 126.502 106.049 86.187 200.985 140.69 192.709 193.892 135.961 195.074 141.872 131.232 197.438 200.985 109.241 93.517 126.502 116.335 126.502 133.596 112.197 115.389 113.143 100.729 182.069 86.424 151.33 132.414 143.438 101.25 138.75 155.625 91.875 120.938 89.813 127.584 92.788 85.204 101.25 123.123 111.524 110.632 125.799 73.338 43.361 46.929 103.494 72.178 56.833 94.688 37.472 77.978 65.755 54.424 96.357 85.561 92.788 64.327 49.784 90.656 46.037 75.747 76.55 71.108 51.39 52.372 55.316 38.543 55.494 36.045 102.188 54.067 91.004 69.323 76.406 91.896 72 73.695 79.688 98.141 84.58 91.896 84.134 99.033 79.405 110.632 85.829 75.836 69.323 69.375 56.297 69.413 51.747 61.294 60.223 55.851 61.651 53.264 71.019 66.468 94.688 49.071 64.684 57.725 49.784 70.929 61.472 64.595 65.041 80.387 57.279 55.969 72.535 78.602 50.677 75.75 107.813 102.188 98.438 76.781 123.75 80.156 152.813 55.969 66.094 82.5 69.375 109.688 101.25 97.5 103.125 154.688 101.25 105 126.563 134.063 124.688 59.625 110.625 98.438 103.125 108.75 94.688 95.625 71.531 66.656 79.125 122.813 93.75 107.813 108.75 Linoleic acid 28.7 34.396 28.261 30.89 22.127 24.318 30.89 28.261 31.147 25.858 20.373 17.767 32.126 24.291 18.003 37.22 34.869 11.656 28.6 26.837 21.548 19.785 23.004 32.518 69.542 37.024 35.457 34.281 24.878 44.272 46.035 53.87 24.537 37.807 34.477 49.561 31.735 22.136 33.498 29.972 28.992 42.705 34.177 23.899 30.559 36.24 37.025 14.849 25.074 24.878 21.667 30.559 15.103 20.765 32.91 25.27 22.724 20.569 32.518 26.445 36.436 39.873 35.065 39.962 27.033 27.033 33.106 32.322 33.498 27.033 32.714 39.766 35.491 26.054 34.085 23.311 25.662 24.291 26.641 27.621 37.22 32.322 33.889 30.233 29.188 40.158 28.404 27.823 38.339 29.357 32.205 32.862 24.975 22.127 15.226 12.269 20.922 44.473 26.947 35.491 14.744 25.194 20.572 30.89 27.604 24.318 18.753 16.102 16.672 19.454 17.22 44.693 45.569 29.795 28.7 22.127 38.558 27.823 34.615 21.667 17.811 26.071 15.708 19.126 23.223 3.331 4.318 5.182 5.429 2.653 3.558 4.236 14.164 9.754 11.359 3.455 6.35 5.715 6.985 7.496 7.549 13.582 8.414 4.075 3.51 5.539 3.455 17.815 12.206 30.691 13.617 7.038 33.866 8.431 9.225 19.05 5.552 18.521 6.473 29.986 7.038 11.412 13.088 12.647 9.789 28.751 10.477 4.257 28.398 12.418 9.772 11.063 1.958 4.11 2.663 4.174 2.187 3.422 3.246 3.881 4.092 2.575 4.092 4.304 3.651 4.886 4.38 6.738 5.785 4.18 7.444 6.879 6.491 4.004 5.15 4.039 3.775 4.647 4.551 3.845 3.492 4.551 6.773 5.309 5.591 3.969 4.815 11.465 6.601 2.946 3.916 3.228 6.683 4.051 3.414 7.917 14.312 11.392 5.429 10.817 10.056 8.822 8.616 7.897 6.457 5.82 5.079 9.439 24.265 9.994 7.136 12.852 8.657 6.868 6.724 7.341 9.13 9.336 7.547 7.28 8.699 45.24 23.648 10.755 6.478 16.41 5.038 6.375 Lysine 503.603 481.905 338.019 409.962 382.555 348.297 452.215 387.123 474.927 397.883 369.388 508.17 444.321 427.434 341.948 469.65 390.496 474.927 503.423 370.443 562.525 409.493 352.864 237.464 295.51 253.294 279.679 363.055 371.499 262.793 331.394 297.621 227.249 313.452 386.274 213.19 197.359 265.959 254.35 307.12 382.052 278.624 252.372 301.843 315.563 294.455 187.281 568.857 412.659 459.096 243.237 518.198 505.534 431.656 439.044 467.539 577.3 422.157 518.198 534.029 269.125 258.082 215.3 377.831 215.3 234.297 318.729 288.122 327.172 293.399 188.915 326.117 202.126 232.187 335.615 397.883 320.84 322.95 329.283 290.233 412.659 490.758 290.233 196.416 325.061 425.324 246.962 312.896 266.076 277.495 194.132 208.978 117.621 286.631 283.205 251.23 210.12 147.312 259.224 226.107 197.558 354.006 302.618 438.511 362 256.94 471.628 280.921 485.331 333.451 453.356 204.41 178.145 278.637 232.959 192.991 211.262 199.842 186.139 188.423 268.36 275.211 172.435 276.353 290.057 102.453 87.914 123.919 138.555 80.011 127.822 114.162 173.395 138.919 130.807 93.964 135.877 126.751 150.073 120.667 113.569 125.737 124.723 134.863 155.143 106.471 89.183 71.082 83.148 104.443 93.187 145.003 134.863 111.541 127.765 83.453 86.548 87.914 151.087 152.101 99.88 83.655 81.627 98.257 99.17 98.46 65.708 115.137 116.611 119.653 113.569 122.943 148.045 105.457 107.485 66.35 148.045 123.709 124.723 137.905 150.073 118.639 133.849 103.429 123.709 65.099 55.52 68.851 86.495 60.232 78.991 75.442 60.131 79.397 75.746 63.882 90.449 85.475 83.757 73.313 60.638 78.078 93.694 73.617 70.372 80.106 71.792 71.994 64.204 67.33 62.159 72.501 82.353 94.061 81.67 112.21 88.988 128.798 90.842 105.38 79.718 66.741 90.939 72.01 124.895 139.531 107.332 126.846 185.391 139.531 133.677 169.779 152.216 144.41 71.815 120.992 89.28 119.04 111.235 111.235 108.307 96.794 68.009 96.306 131.725 110.259 115.137 133.677 Methionine 83.473 100.879 50.374 47.736 62.11 49.451 71.473 49.451 58.475 65.72 45.763 109.714 64.068 59.746 56.568 52.119 57.458 59.492 66.61 43.093 83.39 56.695 52.352 55.551 53.39 46.525 39.407 52.754 98.644 41.949 69.915 72.585 63.429 52.246 89.619 42.839 31.78 40.169 41.314 63.814 73.729 46.271 59.736 67.754 68.517 79.703 50.637 108.941 70.424 75 62.11 92.797 84.407 71.186 58.856 67.246 78.305 55.805 75.89 72.331 68.136 56.176 54.153 87.839 57.458 56.949 94.068 82.754 91.907 65.847 55.424 101.568 52.22 62.669 78.941 151.271 109.958 84.788 78.814 89.364 163.983 181.78 68.39 38.769 80.212 197.034 58.475 65.143 69.89 68.308 52.352 50.901 30.066 76.484 80.967 62.505 134.505 40.615 57.231 56.308 48.132 50.242 54.066 63.956 60.132 36.923 59.604 43.253 54.462 47.209 61.187 46.154 51.429 61.187 58.681 50.505 57.363 50.505 49.451 44.703 44.835 74.505 42.989 66.066 67.648 105.72 94.664 94.088 87.754 70.595 62.879 83.608 63.92 77.967 35.826 99.962 77.532 67.731 76.225 59.129 41.597 29.728 32.123 46.824 58.367 35.39 68.292 37.241 52.813 53.684 45.082 74.592 93.648 54.338 69.147 40.181 87.754 49.111 74.047 91.906 40.944 34.846 42.142 57.169 63.376 49.655 30.708 76.699 50.2 81.125 65.445 66.449 71.869 43.448 46.606 69.559 64.247 51.724 56.08 46.933 56.842 53.358 57.713 51.833 49.873 38.439 52.975 38.984 59.238 41.379 41.597 52.269 46.388 67.405 44.319 46.715 71.325 69.443 47.477 45.191 47.695 66.969 47.695 57.713 56.407 66.098 71.216 42.142 48.829 51.397 70.345 43.013 109.981 100.537 68.292 80.96 76.353 93.973 112.514 147.409 50.096 56.2 88.56 64.146 40.422 49.29 42.841 43.877 67.486 40.883 43.417 55.624 56.084 52.975 33.628 54.587 48.599 58.503 58.964 57.466 50.557 44.568 35.24 50.787 64.837 48.369 56.2 59.309 Methionine sulfoxide 1.491 1.602 0.873 1.043 1.127 1.09 1.472 0.932 1.099 1.23 0.921 1.975 1.099 0.852 0.978 0.978 0.79 0.903 1.258 0.661 1.593 1.062 0.86 1.127 1.388 1.155 1.258 0.978 5.432 0.735 1.761 1.509 1.137 1.379 1.509 0.894 0.622 0.726 0.96 1.248 1.491 1.099 0.997 1.006 1.528 1.416 1.155 3.168 1.752 1.435 1.286 2.925 2.32 1.36 1.202 1.444 1.379 1.425 1.463 1.835 2.18 1.295 1.09 1.873 2.087 1.528 2.003 1.733 2.739 1.435 0.969 2.748 1.062 1.472 1.752 2.543 2.05 1.742 1.752 1.984 4.379 4.901 1.109 0.941 1.882 6.82 1.099 1.202 1.575 1.36 1.062 1.099 1.118 1.602 1.491 1.621 2.217 1.127 1.547 1.286 1.258 0.997 1.276 1.099 1.165 0.932 1.043 0.868 1.071 0.875 1.22 1.118 1.304 1.286 1.398 1.323 1.351 1.062 1.155 1.062 1.36 1.705 0.96 1.323 1.286 2.688 2.723 2.688 2.723 1.852 1.912 3.047 1.198 1.108 0.563 2.364 1.116 0.692 1.116 0.775 0.761 0.496 0.977 0.651 0.798 0.373 2.048 0.621 0.671 0.837 0.96 1.116 3.004 0.589 1.346 0.599 2.808 0.985 1.707 1.436 0.561 0.493 0.455 1.502 1.157 0.421 0.528 2.04 0.697 1.141 0.821 2.646 2.906 1.502 1.239 1.844 2.84 1.683 1.592 1.092 1.486 1.494 1.691 1.28 1.338 1.338 1.485 1.059 1.527 2.175 1.592 1.494 1.264 2.594 1.305 1.083 2.43 1.878 1.494 1.215 0.919 1.617 0.993 1.551 1.412 1.74 1.601 0.886 1.878 1.133 1.707 1.133 3.525 3.346 2.048 2.39 3.346 2.526 3.653 3.166 1.954 2.467 2.885 2.509 0.72 1.178 0.754 0.815 1.169 1.024 1.067 1.058 1.101 0.956 0.973 1.135 1.289 1.442 1.673 1.246 1.357 1.135 0.871 1.417 1.408 1.092 1.016 1.229 Oleic acid 273.688 257.375 204.813 268.25 177.444 244.688 244.688 308.125 186.942 179.752 138.05 168.744 209.95 184.066 159.62 221.455 202.76 152.43 189.818 185.504 199.884 194.132 219.313 182.628 368.132 174 176.876 189.818 150.992 284.727 251.653 271.785 167.294 204.198 184.066 231.521 161.058 120.362 212.826 152.43 131.435 245.901 217.5 119.787 159.62 254.529 271.875 139.775 220.017 291.917 157.506 258.843 202.76 214.264 286.165 194.132 185.504 204.198 218.579 224.331 218.579 299.063 204.198 204.198 153.868 133.017 174 163.934 168.248 150.992 176.876 185.504 288.188 126.977 169.686 145.24 135.03 112.309 123.526 145.24 201.322 178.314 149.554 262.813 168.248 222.893 101.093 186.688 291.813 226.563 251.938 235.625 246.5 192.125 122.888 122.525 180.344 402.375 217.5 277.313 115.456 172.731 119.988 173.819 174.544 203 135.031 166.931 114.731 204.813 102.588 251.938 288.188 221.125 199.375 166.206 270.063 195.75 293.625 143.006 125.244 197.563 107.844 126.513 145.725 75.208 92.525 88.897 63.663 37.604 65.312 60.199 104.585 67.317 101.395 67.621 58.755 71.514 60.602 62.449 48.683 136.313 67.653 50.53 43.815 36.26 56.9 93.673 90.483 141.181 66.31 68.492 166.362 72.353 53.384 125.737 62.178 100.556 40.457 133.459 36.932 62.952 63.288 73.696 63.12 132.116 69.164 57.23 113.146 68.996 61.777 102.256 33.91 94.344 70.842 43.376 51.033 86.454 63.288 72.689 66.981 38.443 43.983 60.77 45.829 42.136 48.819 57.245 53.048 34.414 67.149 37.268 47.172 24.006 53.216 59.091 32.903 52.777 33.407 39.45 32.399 62.281 66.981 49.522 71.682 35.085 56.237 80.915 66.136 21.32 31.392 36.764 56.9 54.262 34.47 86.918 124.521 105.555 69.105 104.07 87.742 77.517 93.68 91.865 73.723 56.571 72.074 109.348 211.109 97.968 63.827 104.73 90.051 77.022 66.466 72.899 80.98 98.298 54.921 53.107 88.072 361.194 201.213 88.237 53.437 109.678 55.416 68.61 Ornithine 91.366 80.407 88.482 94.019 76.485 148.816 79.945 82.829 108.793 62.099 71.892 94.25 83.715 66.757 70.22 165.996 79.774 74.4 91.119 86.342 84.67 54.576 56.873 69.145 81.087 72.728 58.755 70.817 66.518 48.843 85.028 66.398 49.259 65.204 81.087 56.845 62.816 74.28 59.472 80.013 80.49 79.415 81.099 63.532 52.068 69.981 103.825 66.996 72.131 92.671 70.37 79.893 69.981 53.62 52.904 66.637 165.996 71.534 139.723 81.565 57.681 85.367 64.249 71.175 57.084 71.772 83.715 76.191 68.787 56.009 41.678 68.906 60.565 62.338 70.101 88.969 73.206 63.413 70.817 63.891 108.196 140.918 76.31 60.449 85.148 205.405 53.62 72.678 65.41 78.676 68.986 64.372 36.916 75.677 46.375 61.026 73.831 30.455 95.865 74.523 51.22 70.37 60.795 75.562 86.867 61.603 83.983 77.061 68.986 75.216 80.753 48.913 52.72 92.635 54.451 34.724 52.605 76.6 53.297 50.182 51.336 74.062 54.22 71.293 59.411 13.876 13.402 17.197 22.534 13.283 15.774 15.181 34.796 31.295 43.283 16.486 37.342 27.052 30.341 29.068 31.508 21.748 32.25 36.706 33.311 22.915 11.184 23.763 22.596 33.523 18.777 33.311 30.128 18.247 39.464 24.93 20.755 22.808 26.203 37.661 33.523 26.84 23.551 24.506 25.461 26.946 13.897 24.788 30.765 23.975 33.629 16.841 15.17 18.777 5.368 13.995 12.2 4.615 5.601 14.746 7.585 9.717 13.049 8.487 33.099 15.595 12.335 17.398 16.019 6.609 29.174 22.278 14.109 12.412 9.346 8.932 18.777 16.723 16.337 7.055 8.954 10.152 23.869 10.449 7.819 16.868 8.031 15.807 15.537 8.307 17.186 7.384 16.96 16.486 25.381 23.127 12.453 32.378 17.316 27.278 27.16 21.586 23.483 11.267 20.874 19.806 14.351 19.569 37.953 37.715 26.804 22.06 41.273 9.559 16.367 16.367 17.672 20.044 15.3 21.23 12.928 24.432 25.737 18.739 17.909 36.885 20.281 6.665 p-Cresol sulfate 4.855 6.94 14.051 2.397 4.615 2.735 4.376 18.803 13.923 4.221 6.162 19.282 8.17 2.611 5.719 2.812 9.191 2.907 0.071 3.609 2.012 0.824 8.171 3.081 7.183 4.426 6.332 4.46 3.506 19.098 1.825 7.421 0.256 2.301 4.255 2.686 0.449 0.351 5.277 0.306 1.515 7.115 3.453 2.628 2.475 3.367 0.185 12.426 3.609 5.106 0.821 2.856 4.97 5.345 5.413 4.936 1.76 0.752 1.239 5.617 1.205 3.029 0.157 0.048 0.003 0.031 0.439 0.058 0.095 1.014 0.014 0.031 9.573 0.031 0.63 2.614 0.463 1.321 0.851 0.654 3.142 1.26 1.831 1.186 0.177 3.346 0.02 17.333 0.448 4.786 3.012 0.082 0.834 4.991 5.573 0.103 1.255 0.144 1.378 4.034 2.506 9.983 2.968 13.299 7.487 10.154 8.308 4.342 8.137 11.248 9.47 5.812 1.272 5.094 6.154 5.402 3.863 5.402 2.133 9.709 2.263 3.35 2.862 3.863 2.591 0.175 0.167 0.256 0.13 0.219 0.249 0.111 0.625 0.321 2.461 0.642 1.007 0.213 0.269 0.161 0.864 0.169 0.1 0.143 0.13 0.078 0.1 1.606 0.764 0.191 3.343 0.43 0.282 2.201 0.226 0.981 0.052 0.304 0.195 0.265 0.434 0.46 0.265 0.517 0.195 0.048 0.925 0.067 0.061 0.321 0.2 0.007 0.282 0.152 0.174 0.059 0.109 0.156 0.187 1.441 0.178 0.096 0.074 0.03 0.317 0.048 0.197 0.017 0.152 - 0.191 0.009 0.017 0.052 0.048 - 0.035 0.434 0.004 0.026 0.091 0.065 0.109 0.347 0.026 2.396 0.035 0.417 0.056 0.013 0.13 0.104 0.045 0.694 0.141 0.011 0.056 0.316 0.238 0.097 0.015 0.085 0.145 0.115 0.149 0.104 0.297 0.201 0.201 2.38 2.024 0.282 1.363 0.408 0.208 0.026 0.368 0.152 0.175 0.152 0.149 0.137 0.817 0.097 1.207 0.479 0.208 0.082 Phenylacetylglycine 0.708 1.093 1.822 0.612 1.167 0.471 1.84 2.919 1.385 0.822 0.683 1.58 0.898 0.544 0.596 0.451 0.737 0.942 0.553 0.513 0.513 0.53 1.129 0.149 0.644 1.064 1.172 1.203 0.88 2.132 1.045 0.327 0.166 0.491 0.344 0.391 0.805 0.507 0.977 1.577 1.02 0.813 0.29 0.673 0.348 0.996 0.262 2.505 0.832 0.271 0.223 0.408 0.851 0.6 1.153 0.962 0.014 0.927 0.443 0.54 1.732 0.301 0.524 0.277 0.486 0.402 0.174 1.062 0.536 0.834 0.611 0.571 1.682 0.679 0.577 0.226 0.062 0.213 0.284 0.348 0.228 0.598 0.546 0.448 1.058 0.58 0.455 1.581 0.159 0.333 0.577 1.258 0.071 0.389 0.402 0.425 0.851 0.209 0.276 0.032 0.612 1.169 1.132 1.026 0.644 1.946 1.042 1.84 0.678 2.317 0.564 0.842 0.359 1.083 0.704 0.568 0.513 0.9 0.847 1.125 1.417 0.713 0.306 0.782 0.969 0.02 0.169 0.02 0.002 0.059 0.072 0.061 0.098 0.186 0.324 0.228 0.06 - 0.149 0.053 0.095 0.121 0.222 0.141 0.119 0.047 0.136 2.446 0.222 0.148 3.712 0.172 0.162 0.464 0.213 0.115 - 0.316 0.075 0.129 2.332 1.934 0.422 0.304 0.512 0.262 0.262 0.033 0.33 0.174 0.088 0.11 0.294 0.033 0.043 0.007 0.041 0.001 0.017 2.19 0.001 - 0.366 0.036 0.164 0.223 - 0.082 0.462 0.154 0.643 0.064 0.09 0.118 0.038 0.081 4.309 0.217 0.075 0.04 - 0.028 0.01 1.364 0.044 2.688 0.006 0.796 0.083 0.119 0.046 0.001 0.099 1.015 0.009 0.454 0.07 0.579 0.011 0.561 0.02 - 0.151 0.307 0.158 0.018 0.121 0.092 0.283 2.676 6.975 0.285 3.027 0.292 0.219 0.11 0.684 0.029 0.182 0.031 0.259 0.16 0.985 0.211 2.522 0.89 0.667 0.215 Phenylalanine 90.742 111.242 109.378 96.763 77.84 72.966 82.141 103.787 137.119 90.708 94.799 93.036 88.874 77.87 78.011 152.355 91.131 106.507 107.636 107.213 104.391 87.604 73.11 68.419 89.015 101.993 64.187 130.207 87.322 83.09 74.485 79.563 74.687 65.033 91.695 64.61 75.331 85.206 52.055 82.526 102.416 66.726 73.397 108.482 85.065 94.234 78.844 106.507 83.936 103.686 90.455 88.168 86.758 71.381 102.557 103.827 92.4 79.704 87.322 95.363 87.463 56.481 53.889 79.986 59.672 60.519 66.02 75.049 70.394 73.92 45.848 72.51 61.928 52.337 79.704 87.604 70.676 72.651 75.472 69.265 104.391 113.843 64.61 57.771 74.626 93.529 60.096 66.229 61.498 90.599 61.642 65.799 42.289 70.96 73.253 63.935 77.984 59.635 76.12 80.708 61.498 111.958 76.407 92.749 99.057 77.84 101.78 86.298 79.131 107.658 113.679 78.701 57.484 74.113 77.697 77.84 67.376 64.509 71.533 67.949 60.065 93.466 50.173 81.424 89.739 89.604 65.676 107.674 92.72 54.585 65.427 76.643 93.927 74.462 47.272 79.883 84.143 73.535 78.478 91.249 54.894 34.811 30.794 79.096 57.365 44.183 66.798 38.724 71.372 74.05 53.452 104.02 79.508 93.412 70.239 44.698 72.157 45.522 80.641 60.043 66.429 56.439 49.023 73.947 64.678 41.299 36.252 85.367 46.86 93.412 68.694 70.911 54.894 34.708 44.389 60.193 51.598 44.389 44.595 53.246 56.953 44.492 57.674 52.216 47.066 39.754 47.481 34.399 44.08 31.618 35.326 33.472 32.03 45.007 33.678 36.15 39.651 79.136 33.575 36.767 30.794 33.369 35.944 40.166 35.738 41.093 43.977 35.326 67.172 45.625 33.884 31.515 62.685 105.68 59.071 101.817 117.893 99.2 102.689 93.966 62.436 65.053 111.288 81.504 74.525 64.43 64.181 68.169 109.668 58.573 65.676 81.628 83.497 78.637 54.086 85.491 67.296 75.646 83.996 63.932 80.507 65.303 51.095 70.537 80.507 63.059 76.269 87.984 Proline 180.34 162.638 99.243 92.051 107.54 89.064 119.489 91.94 106.102 90.834 83.532 164.851 96.809 95.702 86.077 102.672 82.315 122.809 127.234 87.847 116.17 102.672 95.26 94.928 97.472 96.255 86.962 119.489 169.277 85.966 118.383 157.106 115.064 93.932 175.915 81.098 64.502 91.498 87.072 120.596 162.638 107.762 121.702 127.234 130.553 148.255 92.604 199.149 110.638 122.809 116.17 151.574 160.426 110.638 103.115 113.957 120.596 97.583 115.064 117.277 120.596 125.021 96.809 168.17 120.596 121.702 179.234 168.17 168.17 134.979 93.157 179.234 105.549 123.915 140.511 245.617 185.872 178.128 154.894 177.021 308.681 344.085 126.128 107.098 137.191 327.489 105.77 105.881 109.532 151.574 93.157 99.132 58.417 159.319 161.532 153.787 137.191 81.983 123.915 115.064 99.132 97.804 75.455 131.66 106.877 68.153 108.979 84.417 110.638 96.587 111.745 96.145 97.251 137.191 107.209 77.779 101.234 98.8 93.489 87.183 90.17 160.426 79.438 127.234 118.383 475.581 380.89 522.394 521.33 324.501 331.949 384.082 334.948 351.549 198.235 394.721 360.338 291.005 417.953 300.77 225.577 163.08 143.549 324.207 266.592 176.751 413.872 169.915 275.38 272.451 263.662 322.254 267.568 324.207 336.901 178.704 362.803 209.953 333.972 395.493 255.85 233.39 219.718 307.606 355.455 189.446 174.798 471.325 236.319 316.394 297.84 279.816 463.85 266.592 300.77 341.524 439.437 298.817 381.822 380.845 432.601 391.587 446.272 331.042 313.465 261.709 269.176 312.488 348.62 300.77 258.779 305.653 277.333 440.413 289.052 276.357 402.329 340.46 285.146 320.3 275.38 346.667 251.944 379.869 321.277 324.207 281.239 300.77 291.519 314.441 282.216 285.146 368.123 497.923 368.123 376.634 424.512 454.302 490.476 475.581 242.578 255.345 365.995 361.739 290.455 278.752 250.026 260.665 352.164 230.875 292.583 341.524 302.159 323.437 229.811 302.159 283.008 312.798 345.78 301.095 295.775 236.194 233.003 308.542 329.821 250.026 330.885 321.309 Proline betaine 0.684 0.715 0.881 0.815 0.693 0.68 0.67 0.645 0.364 0.222 0.323 0.572 0.254 0.347 0.245 0.35 0.302 0.33 0.314 0.292 0.341 0.359 0.867 0.343 0.604 0.472 0.437 0.859 0.314 0.569 0.496 0.607 1.386 0.464 0.523 0.63 0.533 0.501 0.542 0.622 0.617 0.602 0.722 0.539 0.74 0.488 1.348 0.176 0.329 0.318 0.957 0.229 0.281 0.213 0.337 0.266 0.358 0.266 0.423 0.276 0.333 0.749 0.341 0.756 0.465 0.397 0.346 0.515 0.567 0.302 0.542 0.414 0.771 0.458 0.848 0.514 1.039 0.479 0.693 0.679 0.667 0.572 0.809 1.051 0.589 0.494 0.6 0.345 1.222 0.791 0.612 0.866 0.952 0.996 0.929 0.802 1.172 1.036 1.92 1.297 1.057 1.475 0.982 0.757 1.249 0.997 1.093 1.007 0.807 0.79 0.898 0.915 1.217 1.268 1.011 0.676 1.102 1.424 2.009 1.869 0.907 2.06 1.271 1.348 1.475 0.869 0.726 1.129 1.019 0.666 0.56 1.035 0.992 0.819 0.358 0.969 0.808 0.993 0.916 1.108 0.551 0.357 0.206 0.923 0.687 0.472 0.899 0.466 0.917 0.921 0.889 1.569 0.699 1.377 1.135 0.557 1.178 0.805 1.222 1.257 0.969 0.893 0.78 1.182 1.341 0.545 0.715 0.871 0.871 1.222 1.077 1.332 1.413 1.665 1.485 0.7 1.737 1.76 1.545 1.844 1.964 1.341 2.467 1.605 1.437 1.772 0.583 1.689 2.012 1.437 1.341 1.725 1.569 1.461 1.868 1.725 1.593 0.757 1.928 2.012 1.689 2.216 1.485 1.808 2.216 1.689 1.701 1.689 1.251 2.18 1.581 2 1.196 1.05 0.841 0.825 1.549 1.319 1.408 1.408 1.117 1.019 1.254 1.067 1.511 1.257 0.937 1.293 2.01 0.974 1.677 1.793 1.357 1.639 2.343 2.727 2.612 2.702 2.561 2.458 2.497 2.023 1.844 1.818 3.265 1.601 2.407 2.753 Putrescine 1.416 1.522 1.11 2.217 1.088 1.293 1.522 2.297 1.09 1.663 1.158 0.668 0.629 0.658 1.043 1.075 0.717 1.527 0.936 1.191 1.848 1.404 1.349 1.07 0.728 0.721 0.958 0.701 0.801 1.115 1.749 0.76 1.086 0.955 0.682 0.903 0.982 0.687 0.538 0.994 0.951 0.636 1.456 0.836 0.729 0.708 0.351 1.269 1.367 2.045 0.884 1.117 1.613 0.942 1.269 1.613 1.072 1.032 0.903 1.798 1.478 0.94 1.229 1.155 0.781 0.579 0.764 0.804 1.102 0.786 1.096 0.782 0.975 0.783 1.724 1.129 0.788 1.117 1.064 0.735 0.95 0.935 1.143 0.604 0.92 0.819 1.088 0.446 0.97 1.287 1.303 1.179 0.211 0.674 0.642 1.13 0.813 0.274 0.954 1.066 0.728 1.202 0.724 1.496 1.329 1.402 0.96 1.79 0.958 1.843 1.104 1.362 0.637 1.233 1.171 0.975 0.8 1.562 1.349 0.709 0.574 0.78 0.638 0.845 2.27 2.844 1.547 4.663 3.988 1.416 1.885 2.789 4.974 3.156 0.97 2.626 3.785 7.401 5.673 6.932 2.307 1.408 0.898 6.023 1.838 2.787 2.767 2.008 1.898 2.487 1.888 5.304 5.943 2.537 4.255 1.778 2.778 2.187 5.084 6.942 3.426 4.694 1.408 3.286 4.585 0.769 2.078 2.408 1.368 4.215 1.758 3.454 2.717 1.548 4.894 2.212 3.336 3.376 2.547 3.386 3.176 2.287 1.498 4.195 1.348 0.606 1.003 1.778 2.787 2.068 1.149 1.608 2.327 3.586 1.229 2.946 1.838 1.743 5.404 1.588 1.209 4.035 0.956 3.256 3.086 1.089 1.199 2.207 1.242 2.497 3.126 1.828 3.759 2.288 1.765 1.177 5.687 1.46 3.236 1.863 3.486 2.942 1.907 2.778 - 19.72 21.572 12.638 30.724 11.658 17.323 14.054 29.525 - 15.035 21.027 20.047 27.891 17.105 19.829 22.661 12.638 10.045 18.957 17.977 14.599 27.237 - Sarcosine 1.359 2.362 1.816 1.404 1.106 0.866 1.181 1.894 1.342 1.894 1.18 2.34 1.026 1.396 1.191 5.911 1.169 1.076 2.728 1.267 1.169 1.169 1.159 1.032 0.91 1.299 0.882 0.943 1.245 1.288 1.689 1.483 1.237 1.223 1.667 1.559 0.902 1.31 0.88 1.115 1.396 0.868 2.028 1.04 0.863 1.602 0.848 2.187 1.277 1.472 1.248 0.888 1.31 0.825 1.007 1.613 1.321 1.104 0.902 0.913 1.076 1.861 1.494 2.068 1.44 1.407 1.158 1.7 1.602 1.342 1.645 1.147 1.526 1.429 1.57 1.949 1.721 1.775 1.332 1.169 2.165 2.674 2.317 1.281 1.602 2.62 1.31 1.159 1.604 1.727 1.571 0.945 0.731 1.192 1.108 1.482 3.877 0.943 1.226 1.549 1.125 3.187 1.393 1.582 1.571 0.917 1.894 1.604 1.237 2.284 2.351 1.259 1.248 1.448 1.604 1.304 1.181 1.604 1.17 0.969 1.04 1.493 0.949 1.382 1.827 2.612 1.908 2.071 1.918 1.949 2.112 2.418 2.064 2.101 0.661 2.173 1.716 2.881 2.413 2.569 0.927 0.603 0.553 1.844 1.073 0.772 1.653 0.711 0.917 1.587 1.183 2.385 1.569 1.761 1.844 0.735 2.327 0.936 1.706 2.642 1.284 1.294 1.037 1.734 1.661 0.606 0.712 3.867 0.716 1.294 1.385 1.796 2.422 1.651 3.147 1.612 2.101 3.248 2.422 2.211 2.917 2.339 2.11 4.018 1.128 0.695 1.949 1.468 1.78 1.706 1.046 0.886 1.56 2.431 1.11 2.055 1.33 2.01 2.248 1.413 0.936 2.275 0.963 1.651 1.936 1.138 1.477 1.734 1.806 1.541 1.661 1.954 2.357 2.929 1.99 1.867 3.367 1.765 2.122 1.908 1.602 1.673 2.378 2.214 0.634 0.774 0.54 0.541 0.557 0.57 0.479 0.783 0.507 0.683 0.612 0.712 0.622 0.759 0.77 0.669 0.871 0.692 0.646 0.797 0.635 0.636 0.568 0.788 Serine 202.056 176.948 137.493 132.711 153.036 145.863 153.036 119.32 127.925 159.623 115.472 157.819 142.642 135.849 98.377 134.717 123.396 148.302 156.226 110.038 169.811 169.811 124.342 176.604 138.113 124.528 132.453 125.66 147.17 113.208 182.264 159.623 145.863 186.792 201.509 138.113 106.528 114.34 135.849 157.358 208.302 167.547 215.207 139.245 191.321 175.472 162.601 181.132 150.566 153.962 205.642 148.302 178.868 138.113 116.604 148.302 173.208 130.189 173.208 165.283 136.981 249.879 146.038 218.491 182.264 198.113 194.717 213.962 194.717 141.509 150.566 187.925 182.926 177.736 182.264 253.585 208.302 198.113 190.189 178.868 278.491 302.264 204.906 162.601 161.887 305.66 173.208 234.337 157.819 263.031 184.122 153.036 80.822 217.598 224.772 219.99 160.21 102.941 192.491 182.926 172.166 138.689 101.028 169.775 184.122 104.495 151.841 107.484 153.036 116.212 187.708 143.471 121.951 200.86 178.144 106.886 139.885 143.471 144.667 133.907 173.361 147.058 132.711 176.948 197.273 192.509 85.392 165.623 152.717 60.764 136.585 116.151 122.537 129.568 50.421 63.775 146.643 139.612 74.527 106.467 72.116 38.569 33.648 85.374 63.077 59.662 89.049 62.876 67.195 84.169 63.88 129.568 108.476 52.129 94.916 76.636 162.396 69.605 138.608 103.454 84.37 59.963 67.295 117.515 64.382 45.6 48.814 223.698 55.744 175.771 77.942 178.528 222.978 114.502 190.837 117.226 222.978 179.789 197.868 126.555 194.855 165.727 155.683 207.912 128.564 103.454 94.104 167.736 234.026 221.974 146.643 141.621 196.863 234.026 113.498 191.841 200.881 178.528 246.079 125.551 116.511 206.907 106.467 204.899 157.692 175.771 197.868 214.943 96.685 176.775 219.965 215.947 147.34 233.377 153.792 164.547 351.679 160.245 171 160.245 122.604 162.396 138.736 146.264 233.377 217.245 277.472 258.113 280.698 179.604 173.151 249.509 224.774 343.075 192.509 288.226 288.226 333.396 305.434 338.774 340.925 237.679 183.906 294.679 377.491 247.358 262.415 385.019 Serotonin 0.298 2.893 0.575 13.794 0.51 13.234 12.561 4.093 1.286 5.414 0.276 0.266 0.512 4.508 0.119 0.498 0.067 0.914 0.908 12.304 0.244 13.31 12.449 10.011 0.785 10.548 0.095 0.189 0.2 1.103 0.108 0.054 1.166 0.059 0.057 0.362 0.068 0.188 0.242 0.106 0.126 0.131 0.418 0.055 12.192 0.185 0.178 2.025 0.572 0.971 0.776 2.259 8.545 0.275 15.324 16.218 13.422 1.04 1.32 1.98 7.74 8.624 0.265 0.271 2.114 0.138 0.271 0.218 0.388 0.333 0.114 2.069 8.658 0.299 10.536 0.345 0.206 0.397 11.744 2.282 0.161 0.837 0.803 1.189 4.138 9.809 0.479 0.297 0.617 10.576 1.2 1.604 1.839 1.761 0.265 0.663 0.758 0.083 2.68 14.579 0.122 0.277 9.331 1.2 0.191 1.155 0.539 11.327 0.421 0.459 0.165 9.14 0.087 11.888 0.924 0.117 0.085 0.492 1.963 0.298 1.402 2.725 0.676 0.191 8.321 0.091 0.131 0.117 0.081 0.082 0.11 0.114 0.156 0.161 0.073 0.083 0.122 0.128 0.301 0.263 0.392 0.096 0.159 0.135 0.09 0.132 0.06 0.044 0.098 0.094 0.086 0.137 0.332 0.055 0.301 0.219 0.08 0.065 0.132 0.112 0.076 0.16 0.089 0.063 0.183 0.136 0.21 0.056 0.072 0.113 0.046 0.114 0.07 0.061 0.101 0.053 0.088 0.098 0.071 0.139 0.11 0.083 0.204 0.061 0.132 0.074 0.023 0.046 0.076 0.045 0.042 0.045 0.05 0.06 0.069 0.094 0.036 0.11 0.074 0.048 0.053 0.039 0.076 0.113 0.046 0.091 0.078 0.043 0.038 0.057 0.085 0.09 0.063 0.088 0.068 0.044 1.117 0.109 0.093 0.052 0.089 0.095 0.065 0.109 0.143 0.095 0.239 0.219 0.247 0.313 0.219 0.276 0.133 0.201 0.03 0.143 0.201 0.088 0.07 0.198 0.131 0.221 0.102 0.041 0.214 0.107 0.08 0.11 Spermidine 1.343 1.526 0.74 1.526 0.738 1.79 2.089 1.721 0.501 1.571 0.62 0.637 0.431 0.73 0.516 0.712 0.467 0.681 0.556 1.199 0.984 1.525 1.457 0.764 0.669 0.939 0.688 0.4 0.646 0.796 1.012 0.453 0.908 0.547 0.672 0.711 0.509 0.34 0.611 0.748 0.74 0.592 0.877 0.609 1.769 0.497 0.383 0.991 0.913 1.839 0.702 0.734 1.246 0.533 3.376 1.066 3.865 0.85 1.199 1.067 1.149 1.297 0.858 0.875 0.576 0.582 0.574 0.568 0.697 0.583 0.683 0.636 1.088 0.75 1.862 1.56 0.62 0.709 1.828 0.689 0.811 1.149 1.056 0.391 0.927 3.83 0.836 0.608 0.931 2.743 1.074 1.04 0.59 0.515 0.625 1.023 0.816 0.568 1.118 2.18 0.639 0.593 0.71 0.908 0.931 0.8 0.645 0.783 0.69 1.011 0.638 1.262 0.651 1.308 0.849 0.58 0.677 1.526 1.744 0.537 0.462 0.846 0.604 0.659 1.423 5.947 3.453 7.295 9.547 3.347 16.632 5.568 13.493 9.507 4.171 2.926 11.742 13.699 10.3 15.964 7.024 3.213 2.915 10.022 5.84 5.634 5.032 3.605 3.728 7.869 12.566 13.287 7.869 8.374 7.364 3.78 5.695 4.439 10.506 10.918 6.705 23.689 4.975 4.037 9.63 2.235 2.915 4.947 3.77 6.211 7.993 5.421 14.625 9.939 15.861 2.832 15.964 17.097 15.14 15.655 16.788 13.081 14.316 15.655 9.63 9.228 1.2 13.493 15.037 14.522 11.021 11.021 12.875 15.449 13.39 15.14 13.493 31.158 19.569 12.463 9.558 17.2 10.052 14.934 14.316 11.433 12.566 13.493 2.358 13.493 14.728 15.861 - 4.642 - 3.105 10.842 3.116 5.589 4.442 6.789 - 4.379 4.421 7.642 12.526 9.474 5.989 10.947 22 - 22.737 - 9.411 - 10.947 - 13.053 - 11.053 - 19.053 21.053 - 9.789 17.263 9.074 11.579 Spermine 2.509 1.987 2.574 4.029 3.128 11.186 2.65 2.549 2.514 1.28 2.389 2.8 3.383 2.594 3.337 1.851 0.837 0.755 2.457 1.92 1.314 2.433 0.838 0.561 1.863 5.806 2.937 1.257 1.577 1.966 0.702 2.313 1.223 2.743 2.72 1.646 26.629 1.52 0.606 2.491 0.63 0.427 2.118 1.136 1.015 2.446 1.14 2.32 2.857 2.171 1.059 2.857 2.571 2.617 3.029 2.971 2.423 2.537 1.977 2.686 2.331 0.382 2.88 2.823 2.651 3.234 2.377 2.343 2.069 3.017 2.503 2.469 37.249 3.166 2.834 2.434 3.143 2.857 2.48 2.149 3.097 2.914 2.891 1.444 2.446 2.537 3.177 41.919 2.433 43.765 1.944 2.639 1.683 2.378 2.194 2.107 53.321 2.954 2.237 2.53 6.016 3.128 2.313 2.824 15.312 36.163 26.715 17.267 2.878 58.208 3.725 48.76 3.54 55.385 3.464 43.33 12.38 15.855 27.041 3.128 6.548 3.388 3.747 Succinic acid 48.213 132 227.489 205.957 93.617 89.217 22.281 166.638 82.996 68.833 27.288 74.238 15.296 17.279 46.549 61.751 23.983 152.017 147.296 43.245 101.03 52.876 261.191 386.18 52.592 101.974 251.159 323.863 185.064 26.627 73.082 80.73 115.149 156.738 86.773 91.021 124.635 136.91 28.704 68.361 172.79 68.549 451.234 393.734 139.742 61.845 36.323 80.258 43.811 101.03 593.532 75.348 46.738 12.464 101.03 110.472 118.026 55.803 55.236 35.408 353.133 205.021 86.678 312.532 324.807 255.88 236.052 281.373 341.803 148.24 111.416 275.708 224.681 284.206 276.652 383.348 253.991 161.459 365.408 223.777 215.279 116.137 155.794 97.362 247.382 236.052 94.137 20.596 1002.638 509.277 232.17 225.617 20.221 111.404 180.681 498.979 325.787 7.18 121.702 176.936 220.936 318.298 74.8 154.468 108.596 20.596 70.587 96.426 114.213 410.043 358.553 146.979 94.553 237.787 305.191 690.894 175.064 234.979 104.851 93.617 159.149 352 58.791 182.553 189.106 55.06 40.794 93.77 127.432 39.031 114.608 73.494 33.739 31.64 9.406 49.049 68.41 96.396 82.403 101.837 28.686 27.83 20.912 68.021 49.131 21.378 103.388 22.466 53.562 53.562 51.618 108.057 67.322 42.834 80.071 27.286 77.18 30.24 59.548 52.24 68.021 48.353 11.428 40.191 29.23 10.961 20.523 133.042 17.258 52.707 57.293 22.281 68.488 63.59 87.067 96.976 115.83 136.82 80.071 76.728 106.502 94.841 82.403 73.541 62.813 70.975 55.781 88.622 67.399 78.516 59.47 57.915 62.269 77.428 102.615 102.615 94.064 96.976 110.389 87.067 70.276 100.283 67.088 126.714 74.396 83.18 74.862 100.283 45.362 157.809 101.837 97.951 70.608 64.517 103.388 65.559 26.368 69.246 42.958 120.219 37.909 31.818 33.341 46.725 33.982 37.268 11.22 44.16 31.097 45.843 20.357 39.191 48.328 76.219 89.763 43.279 93.77 51.293 71.57 37.668 62.995 21.639 29.013 21.239 141.858 18.353 85.756 117.814 Symmetric dimethyl-arginine 0.403 0.408 0.428 0.414 0.373 0.314 0.404 0.363 0.652 0.43 0.589 0.432 0.61 0.597 0.377 0.666 0.59 0.522 0.37 0.427 0.413 0.395 0.422 0.45 0.442 0.509 0.497 0.621 0.506 0.493 0.691 0.768 0.552 0.411 0.506 0.607 0.462 0.503 0.561 0.539 0.705 0.504 0.57 0.394 0.36 0.668 0.266 0.368 0.303 0.374 0.401 0.311 0.324 0.306 0.388 0.408 0.461 0.33 0.363 0.318 0.466 0.423 0.433 0.447 0.432 0.425 0.379 0.407 0.452 0.373 0.339 0.374 0.379 0.417 0.527 0.589 0.535 0.462 0.437 0.456 0.519 0.545 0.407 0.455 0.502 0.383 0.358 0.383 0.538 0.397 0.418 0.354 0.351 0.381 0.515 0.365 0.339 0.352 0.507 0.497 0.449 0.415 0.37 0.446 0.475 0.365 0.49 0.479 0.493 0.457 0.408 0.644 0.417 0.53 0.497 0.403 0.418 0.515 0.378 0.381 0.446 0.381 0.401 0.48 0.511 0.156 0.138 0.255 0.228 0.138 0.173 0.171 0.468 0.298 0.302 0.152 0.327 0.317 0.295 0.313 0.254 0.224 0.149 0.317 0.223 0.188 0.22 0.49 0.269 0.418 0.504 0.439 0.305 0.43 0.367 0.31 0.264 0.295 0.387 0.411 0.456 0.37 0.386 0.418 0.418 0.309 0.225 0.33 0.272 0.276 0.415 0.287 0.126 0.12 0.137 0.183 0.127 0.138 0.137 0.26 0.193 0.148 0.18 0.112 0.123 0.155 0.158 0.181 0.162 0.169 0.202 0.135 0.137 0.181 0.139 0.173 0.343 0.22 0.168 0.192 0.163 0.202 0.183 0.274 0.174 0.378 0.133 0.227 0.241 0.17 0.088 0.172 0.256 0.319 0.2 0.311 0.303 0.258 0.29 0.221 0.238 0.212 0.309 0.273 0.292 0.245 0.184 0.224 0.317 0.297 0.543 0.259 0.332 0.259 0.326 0.418 0.309 0.352 0.366 0.319 0.328 0.271 0.248 0.306 0.405 0.313 0.364 0.373 Taurine 536.225 530.486 390.726 679.165 470.588 429.016 531.722 448.35 619.544 372.642 557.659 639.235 671.219 743.182 386.791 807.118 433.883 613.565 904.473 664.165 295.878 607.376 486.967 525.87 445.129 482.232 314.751 381.975 224.619 497.162 374.545 420.649 561.968 258.245 441.449 363.076 250.512 508.885 392.547 366.954 671.629 406.605 472.515 453.764 671.62 674.192 393.227 339.676 497.162 374.545 603.968 420.649 258.245 441.449 613.565 250.512 508.885 392.547 366.954 671.629 406.605 676.607 453.764 671.62 674.192 265.604 325.639 427.701 270.356 339.676 198.189 292.182 695.156 374.579 576.038 313.029 315.736 267.759 484.069 328.134 368.636 481.063 307.262 406.786 393.551 450.69 180.843 408.114 648.513 843.245 534.902 400.172 415.023 744.052 499.639 434.967 387.973 479.188 523.194 762.4 598.529 404.754 362.093 493.894 365.044 266.353 493.926 519.891 491.415 285.678 540.807 585.531 373.492 627.801 414.372 271.547 342.192 480.869 439.951 371.059 303.019 461.539 377.298 488.64 608.589 1139.413 957.24 1171.518 1101.771 945.155 1133.656 1209.455 1213.029 1240.533 764.454 1044.214 1304.003 1210.018 1097.453 1416.198 965.309 637.197 492.576 1247.196 961.508 865.783 958.939 789.59 1072.658 993.118 1130.242 1299.117 1062.82 1326.941 1208.158 853.861 1129.44 903.559 1212.778 1126.973 1263.642 1031.128 787.486 1085.232 1294.708 708.441 864.949 1187.069 800.396 1226.72 1237.619 1536.553 1352.482 1384.246 1475.677 1010.854 1420.94 1532.681 1437.089 1424.236 1518.004 1308.234 1438.911 1464.6 1398.471 1375.008 1021.926 1356.925 1437.732 1429.017 1243.331 1336.674 1382.224 1304.857 1416.013 1478.975 1287.601 1127.77 1583.358 1334.784 1237.724 1441.768 1252.339 1369.313 1463.722 1245.498 1399.506 1297.372 1110.987 1393.692 1485.252 1502.41 1076.288 1152.529 996.087 1122.21 1384.945 1192.762 1227.79 1298.037 1380.346 1061.838 1273.668 1116.999 1640.359 1512.394 1513.689 1479.351 1600.296 1373.463 1555.128 1510.6 1702.243 1681.026 1639.588 1678.525 1739.141 1707.687 1659.852 1728.13 1724.614 1528.804 1512.151 1692.58 1687.885 1527.911 1639.03 1758.038 Taurochenodeoxycholic acid 0.017 0.039 0.015 0.013 0.004 0.014 0.013 0.012 0.035 0.02 0.008 0.018 0.028 0.022 0.006 0.032 0.004 0.012 0.013 0.01 0.011 0.03 0.011 0.056 0.039 0.012 0.036 0.036 0.032 0.069 0.012 0.21 0.143 0.026 0.063 0.041 0.056 0.018 0.063 0.033 0.02 0.116 0.076 0.032 0.072 0.091 0.246 0.007 0.007 0.014 0.101 0.005 0.01 0.006 0.015 0.008 0.06 0.013 0.01 0.007 0.032 0.136 0.015 0.034 0.033 0.107 0.018 0.093 0.039 0.01 0.033 0.047 0.038 0.053 0.06 0.087 0.331 0.072 0.035 0.031 0.432 0.083 0.026 0.218 0.034 0.131 0.012 0.01 0.397 0.153 0.092 0.026 0.047 0.023 0.067 0.053 0.227 0.061 0.162 0.252 0.07 0.069 0.018 0.024 0.043 0.068 0.012 0.09 0.029 0.035 0.014 0.257 0.503 0.165 0.117 0.188 0.138 0.207 0.159 0.058 0.06 0.388 0.31 0.037 0.507 Taurocholic acid 0.971 2.544 0.605 0.476 0.663 0.64 1.287 0.285 3.412 0.179 0.175 0.762 1.616 1.733 0.359 0.87 0.166 0.19 0.825 0.367 0.289 0.801 0.223 0.887 6.24 0.392 1.191 3.253 2.2 2.169 0.744 11.799 9.342 1.563 2.987 3.253 1.424 0.26 2.285 2.105 0.992 8.111 1.901 0.837 5.092 7.994 12.57 0.202 0.213 1.084 9.774 0.254 0.502 0.258 0.195 0.1 9.046 0.416 0.321 0.382 1.499 3.771 0.76 4.38 1.095 5.368 1.286 6.378 3.412 0.484 1.573 2.307 0.424 2.976 2.147 5.581 19.772 5.219 2.53 1.754 22.217 4.783 1.722 10.86 0.966 12.969 0.47 0.183 9.06 6.597 3.691 0.628 2.665 1.559 6.697 2.031 11.363 10.458 6.617 11.564 2.142 2.504 0.515 0.987 1.579 1.458 0.276 4.887 0.765 1.287 0.319 13.676 15.385 14.38 3.821 9.815 12.268 11.162 11.263 2.393 2.836 18 13.274 0.652 17.296 0.048 0.066 0.066 0.047 0.078 0.721 0.085 0.047 0.275 1.45 0.042 2.736 0.992 0.17 0.097 0.793 0.103 0.223 1.409 1.276 0.089 0.201 1.46 7.717 0.289 3.46 0.873 0.719 7.391 0.469 6.176 0.417 12.25 0.793 0.359 0.489 1.398 14.087 0.459 1.439 28.276 11.127 0.641 25.928 3.665 1.552 0.822 0.425 0.031 0.028 0.208 0.024 0.028 0.095 1.082 0.037 0.047 0.334 0.068 0.044 0.111 0.112 0.08 0.246 0.058 0.333 0.193 0.276 0.861 0.079 0.099 0.102 0.279 0.125 0.055 0.226 0.479 0.362 0.61 0.104 0.63 0.12 0.158 0.613 0.046 0.227 0.06 0.481 0.319 0.438 0.082 0.136 0.5 0.219 0.28 0.866 0.532 0.427 0.245 0.095 0.075 0.595 0.105 0.104 0.088 0.111 0.054 0.101 0.043 0.24 0.484 9.962 6.631 0.378 5.143 5.468 3.855 0.189 0.593 0.783 3.729 0.259 0.376 Taurodeoxycholic acid 0.067 0.373 0.022 0.066 0.026 0.091 0.084 0.302 0.007 0.007 0.007 0.639 0.006 0.009 0.013 0.028 0.001 0.011 0.004 0.004 0.013 0.015 0.093 0.004 0.002 0.002 0.001 0.017 - 0.035 0.002 0.015 0.146 0.01 0.001 - 0.005 0.001 0.093 0.004 0.009 0.092 0.046 - 0.031 0.002 0.348 0.02 0.021 0.098 0.695 0.043 0.092 0.093 0.086 0.027 0.081 0.032 0.016 0.01 0.219 2.584 0.528 0.024 0.032 0.684 0.026 1.479 0.043 0.034 0.749 0.005 0.861 0.076 0.142 0.178 2.041 0.422 0.082 0.176 0.357 1.014 0.155 0.122 0.104 0.615 0.079 0.037 1.805 0.426 0.32 0.702 0.036 0.219 0.686 0.347 2.733 0.11 2.234 0.542 0.043 0.236 0.045 0.185 0.169 0.063 0.105 0.551 0.078 0.125 0.021 2.165 0.583 0.775 0.909 0.783 1.347 3.83 1.217 0.412 0.036 1.406 0.237 0.081 0.223 0.01 0.025 0.01 0.018 0.01 0.094 0.01 0.003 0.002 0.003 0.052 0.004 0.002 0.003 0.003 0.003 0.004 0.001 0.002 0.009 0.002 0.01 0.002 0.008 0.002 0.028 0.009 0.003 0.004 0.001 0.039 0.012 0.082 0.003 0.001 0.002 0.009 0.121 0.007 0.005 0.967 0.107 0.191 0.014 0.009 0.001 0.021 0.01 0.002 0.005 0.028 0.004 0.003 0.011 0.026 0.001 0.002 0.007 0.002 0.001 0.011 0.087 0.044 0.005 0.004 0.036 0.005 0.035 0.02 0.003 0.034 0.001 0.092 0.005 0.004 0.005 0.028 0.023 0.015 0.008 0.009 0.023 0.009 0.018 0.004 0.015 0.007 0.112 0.048 0.037 0.105 0.01 0.129 0.029 0.096 0.01 0.194 0.039 0.012 0.016 0.01 0.031 0.026 0.006 0.039 0.027 0.013 0.022 0.011 0.042 0.019 0.586 0.113 0.031 0.259 0.212 0.308 0.051 0.04 0.049 0.039 0.02 0.018 Tauromuricholic acid 0.555 1.378 0.505 0.252 0.667 0.645 0.812 0.209 3.383 0.176 0.144 0.924 1.138 1.531 0.355 0.968 0.181 0.172 0.718 0.257 0.215 0.928 0.096 1.601 4.064 0.357 0.822 3.988 1.879 2.438 0.765 9.073 7.27 1.306 1.631 3.742 1.314 0.401 2.041 1.813 0.607 7.731 0.943 0.794 3.27 8.165 10.781 0.17 0.1 1.187 8.21 0.093 0.223 0.136 0.098 0.087 5.878 0.225 0.234 0.155 1.007 2.89 0.527 2.873 1.047 4.404 0.612 6.426 1.429 0.287 0.953 2.249 0.285 1.947 1.622 3.081 17.691 3.364 1.499 0.633 21.547 1.843 1.077 10.852 0.55 11.775 0.278 0.117 4.929 3.936 1.559 0.223 0.761 0.56 3.209 1.552 5.958 3.635 4.717 6.703 1.227 3.866 0.468 0.663 1.128 1.358 0.241 4.681 0.516 0.94 0.314 8.689 14.044 8.6 2.181 7.802 7.536 8.387 9.504 1.161 1.686 19.86 13.512 0.447 20.569 0.024 0.033 0.046 0.028 0.044 0.765 0.057 0.035 0.366 1.302 0.031 3.424 0.973 0.259 0.097 0.786 0.091 0.181 1.496 2.354 0.08 0.156 1.81 7.549 0.265 4.923 1.055 0.772 9.086 0.547 9.553 0.299 17.531 0.858 0.202 0.64 1.86 21.014 0.424 1.344 62.652 15.138 0.229 33.271 4.008 2.296 0.629 0.516 0.016 0.016 0.141 0.012 0.021 0.109 1.21 0.029 0.027 0.307 0.033 0.023 0.06 0.068 0.056 0.202 0.043 0.346 0.08 0.265 0.86 0.053 0.053 0.078 0.156 0.074 0.027 0.136 0.294 0.2 0.514 0.047 0.387 0.045 0.097 0.425 0.023 0.21 0.033 0.249 0.183 0.242 0.022 0.057 0.222 0.103 0.094 0.334 0.321 0.182 0.106 0.07 0.057 0.644 0.059 0.084 0.046 0.086 0.042 0.073 0.035 0.116 0.299 6.748 4.786 0.284 3.062 3.557 2.182 0.101 0.339 0.482 2.365 0.167 0.306 Tetradecanedioic acid 0.075 0.072 0.122 0.152 0.112 0.133 0.061 0.109 0.13 0.069 0.097 0.074 0.115 0.08 0.075 0.24 0.072 0.083 0.1 0.109 0.081 0.068 0.168 0.146 0.171 0.068 0.162 0.329 0.836 0.161 0.111 0.656 0.347 0.118 0.137 0.052 0.088 0.09 0.055 0.115 0.077 0.15 0.237 0.068 0.304 0.103 0.49 0.083 0.116 0.149 0.293 0.078 0.084 0.044 0.143 0.109 0.127 0.094 0.094 0.059 0.398 0.699 0.072 0.348 0.352 0.292 0.189 0.685 0.505 0.102 0.049 0.458 0.12 0.193 0.308 0.307 0.261 0.18 0.212 0.301 0.402 0.563 0.186 0.245 0.27 0.651 0.08 0.038 1.12 0.403 0.288 0.08 0.214 0.085 0.102 0.416 0.461 0.397 0.662 0.824 0.202 0.187 0.05 0.045 0.19 0.062 0.086 0.118 0.067 0.115 0.192 0.198 0.288 0.29 0.518 0.494 0.301 0.373 0.184 0.11 0.21 0.85 0.138 0.243 0.162 Threonine 204.786 196.952 119.738 119.738 146.595 118.619 181.286 146.595 186.907 185.814 149.744 267.452 194.558 153.023 123.512 182.535 157.395 178.163 200.023 147.558 214.233 166.14 105.526 93.453 209.86 110.395 103.619 173.791 150.837 197.837 144.279 180.349 95.567 90.065 138.814 89.737 79.572 105.367 158.488 139.907 161.767 157.395 87.845 137.721 181.442 201.116 123.095 289.651 227.349 230.628 128.69 253.581 237.186 229.535 174.884 225.163 268.884 178.163 236.093 241.558 132.256 121.976 118.047 148.651 119.14 113.674 135.535 120.233 127.884 126.791 112.581 153.023 110.45 110.395 147.558 143.186 147.558 144.279 121.326 125.698 162.86 260.14 104.493 116.381 131.163 220.791 126.791 125.333 64.457 154.429 109.667 103.848 56.064 133.167 137.643 147.714 157.786 71.843 93.664 111.121 102.729 137.643 120.857 175.69 174.571 114.143 173.452 117.5 144.357 126.452 180.167 98.252 98.812 138.762 110.114 87.621 101.162 94.448 107.652 110.898 91.986 165.619 89.636 128.69 128.69 480.444 302.889 371.822 414.644 301.844 288.267 381.222 272.505 262.061 139.576 343.622 325.677 272.505 279.152 288.646 177.556 115.838 104.444 241.172 176.606 141.475 250.667 84.22 293.394 172.808 145.273 335.172 190.848 344.667 199.394 147.172 222.467 113.939 175.657 188 138.626 116.788 115.838 312.384 191.798 93.24 144.323 196.356 125.333 297.192 232.626 237.089 464.303 263.01 412.081 266.333 501.333 368.404 440.566 316.182 481.394 407.333 372.202 447.212 241.172 149.071 178.6 218.384 237.374 218.384 146.222 166.162 164.263 215.535 168.061 263.01 233.576 217.244 218.384 204.141 127.232 214.586 147.172 189.899 196.545 160.465 218.384 160.465 251.711 197.495 199.394 243.071 153.533 336.311 229.778 266.333 226.644 236.044 312.289 269.467 120.111 113.844 275.733 221.422 162.933 167.111 155.622 161.889 219.333 137.867 136.822 174.422 184.867 208.889 87.211 150.4 127.422 142.044 147.267 134.733 135.778 125.333 114.889 130.556 206.8 128.467 136.822 161.889 trans-4-Hydroxyproline 13.184 13.303 14.742 15.581 13.663 10.882 10.679 11.889 20.014 22.615 18.996 21.693 21.597 31.208 18.092 18.205 23.633 27.477 21.71 15.152 21.484 23.067 19.176 26.799 29.739 18.318 17.527 17.187 26.912 20.127 28.834 42.742 16.3 24.876 41.046 24.763 16.17 20.919 30.756 23.519 33.47 24.989 15.7 19.562 31.322 29.512 12.225 22.502 19.223 21.597 13.783 22.163 23.746 20.127 17.413 21.823 23.633 19.449 19.562 21.936 14.926 15.101 16.622 29.286 20.353 18.544 29.852 20.353 29.286 23.067 18.318 27.251 12.584 23.859 25.668 43.42 30.53 25.102 27.929 23.633 31.548 31.548 27.816 14.022 19.562 26.346 18.657 12.105 16.3 16.419 17.498 13.184 11.973 13.184 17.738 14.022 10.739 14.861 14.262 13.303 14.382 12.225 10.331 15.7 17.858 10.918 16.539 12.824 22.412 11.494 18.577 11.697 9.888 16.18 14.022 8.593 9.888 15.581 11.985 10.199 11.446 10.103 10.007 13.783 15.581 28.385 18.073 51.668 47.841 18.286 17.648 21.369 45.012 31.904 16.867 22.326 37.494 51.759 42.988 37.494 27.084 19.181 11.084 32.482 21.205 22.072 56.133 31.711 47.904 40.193 33.735 59.952 37.494 45.88 53.976 40.482 41.462 28.048 56.289 73.639 43.277 41.639 39.036 73.542 51.277 24 33.735 43.375 27.084 59.373 43.855 33.276 36.337 20.627 44.819 27.854 46.265 44.916 37.012 34.12 48.867 38.265 34.12 41.542 21.687 20.048 22.538 35.663 46.651 39.422 22.361 39.229 29.494 55.325 33.157 43.855 43.277 27.216 48.675 35.855 41.831 51.566 26.024 52.337 45.783 33.831 37.88 44.916 36.359 38.651 36.145 43.663 57.834 44.864 33.169 38.91 84.731 23.601 47.734 27.641 35.508 27.322 45.289 35.296 14.14 12.651 13.502 13.502 13.714 11.482 12.545 14.033 16.585 21.9 14.352 16.904 20.306 22.963 19.349 18.073 24.558 15.734 13.927 20.412 15.309 16.053 17.329 21.369 Trigonelline 0.044 0.036 0.044 0.03 0.09 0.04 0.042 0.059 0.231 0.088 0.129 0.035 0.233 0.123 0.189 0.159 0.111 0.107 0.168 0.099 0.085 0.066 0.037 0.033 0.037 0.048 0.046 0.042 0.033 0.046 0.026 0.097 0.02 0.036 0.037 0.066 0.02 0.033 0.027 0.032 0.06 0.045 0.014 0.038 0.013 0.094 0.018 0.071 0.071 0.08 0.096 0.069 0.069 0.086 0.069 0.098 0.116 0.063 0.171 0.07 0.056 0.056 0.047 0.021 0.03 0.029 0.021 0.035 0.051 0.025 0.036 0.044 0.106 0.018 0.029 0.022 0.065 0.022 0.018 0.081 0.035 0.027 0.04 0.04 0.019 0.015 0.04 0.031 0.014 0.062 0.023 0.09 0.026 0.029 0.01 0.027 0.108 0.029 0.037 0.168 0.07 0.101 0.168 0.065 0.048 0.049 0.044 0.043 0.031 0.045 0.037 0.027 0.021 0.042 0.042 0.021 0.018 0.026 0.058 0.026 0.026 0.024 0.009 0.022 0.038 Tryptophan 117.5 134.779 139.387 124.412 122.108 93.77 113.238 139.387 106.746 132.01 86.148 138.235 104.584 117.215 134.286 120.63 121.768 135.424 124.044 122.906 154.77 133.148 133.627 76.702 88.651 105.494 63.729 74.995 72.264 53.145 85.692 60.429 86.973 80.002 94.797 77.726 89.107 83.189 62.363 100.145 114.939 75.906 83.287 93.317 61.453 103.673 81.328 146.804 121.768 127.458 105.635 141.114 120.63 127.458 135.424 128.596 112.777 126.32 126.32 125.182 69.077 86.973 81.937 96.617 66.801 71.354 84.668 87.172 72.947 77.385 68.053 58.722 110.243 76.816 88.993 97.642 76.361 72.719 90.245 67.37 84.327 116.077 74.426 51.838 101.625 86.831 69.76 109.897 63.243 112.316 99.76 109.206 39.858 112.431 116.348 78.909 90.314 38.591 72.574 88.931 93.309 107.478 76.145 137.083 125.564 114.505 123.26 117.5 104.252 110.588 110.127 74.762 67.966 97.686 84.784 80.752 84.554 80.176 83.863 87.203 91.696 82.25 76.375 85.13 93.539 37.556 32.556 63.667 52.778 30.111 29 37.111 44.521 40.98 28.433 29.889 42.902 42.7 59.395 47.759 33.593 24.992 22.058 48.062 32.581 27.117 46.222 18.213 29.546 32.48 23.374 40.575 24.385 27.724 30.558 18.921 32.889 20.743 33.087 36.123 26.004 29.445 26.409 34.605 30.962 21.957 18.719 36.667 21.552 31.367 35.617 30 29.141 16.797 25.296 29.778 31.468 23.374 25.397 28.837 32.48 24.891 30.153 23.374 20.844 14.368 24.444 17.201 15.279 13.963 14.469 16.695 13.356 18.921 14.571 13.559 13.963 38.333 15.279 16.189 16.898 14.672 15.886 19.225 14.874 17.606 16.493 14.469 30.111 19.63 13.255 13.154 31.222 55.889 33.111 46.889 38.444 42.111 49.778 34 22.889 21 38.889 37.444 27.444 25.667 26.444 29.556 35.222 26.444 29.778 31.889 32 32.889 12.444 27.778 23.556 27.111 26.667 25.667 23.111 21.556 21 26.222 26.333 25.222 22.333 28.111 Tyrosine 128.193 139.15 86.448 90.283 103.979 81.189 85.133 111.758 75.952 111.203 56.158 94.008 62.385 80.178 75.285 112.315 65.721 107.978 117.876 74.729 118.988 98.193 84.805 63.497 63.052 65.388 61.162 90.631 108.09 42.48 88.073 106.866 70.561 71.615 82.29 55.713 46.372 54.823 48.373 96.524 111.203 62.274 90.721 87.183 68.39 89.074 57.194 140.116 101.306 109.535 80.86 100.75 113.427 73.172 97.637 104.309 102.418 80.289 88.407 108.646 87.183 72.314 77.62 137.892 77.398 57.492 91.854 90.408 80.734 86.294 77.286 88.073 86.667 76.619 98.193 143.452 120.1 113.427 82.513 76.174 154.573 155.685 69.502 50.51 74.395 143.452 87.406 55.112 67.274 91.707 79.436 79.107 33.418 97.405 107.047 76.697 146.819 31.555 67.603 78.778 66.945 87.872 57.961 88.968 86.339 64.863 84.476 83.599 80.751 93.899 87.105 72.424 55.331 86.01 76.149 68.698 80.641 71.328 71.547 60.043 62.234 97.186 55.989 83.052 80.751 152.486 130.553 133.687 116.976 90.656 89.821 125.331 90.021 118.784 52.618 102.667 82.265 91.689 105.04 93.849 51.048 48.593 45.354 80.007 80.105 56.741 95.043 46.237 61.061 86.781 63.319 97.972 96.107 55.367 95.223 69.994 85.016 64.889 101.114 108.967 58.999 54.484 56.741 74.51 101.114 57.232 47.415 146.22 62.926 94.144 79.615 75.93 93.751 53.895 68.423 85.539 70.878 70.779 60.177 62.632 81.382 64.202 76.768 58.901 66.362 50.36 72.274 53.993 76.473 47.808 44.568 52.618 46.728 60.472 54.091 58.901 62.042 120.109 54.876 53.305 55.662 65.184 59.883 56.349 51.538 70.583 62.533 44.078 66.634 49.281 58.214 54.484 98.176 158.753 99.743 130.553 113.843 133.687 174.419 178.597 54.415 66.948 122.198 104.129 73.945 74.468 75.199 76.243 108.62 61.935 75.094 90.134 87.627 87.001 57.443 77.183 77.183 82.301 87.836 90.761 85.016 76.557 56.086 83.45 101.623 72.588 79.794 89.403 Valine 208.545 269.091 183.879 182.758 187.242 140.152 217.515 272.455 337.868 226.868 191.816 271.333 274.579 240.5 202.526 355.395 221.026 199.605 259 277.5 279.447 192.789 133.424 95.226 129.5 130.474 95.129 149.947 159.684 122.684 118.789 119.763 95.415 111.974 175.263 80.621 91.526 126.579 79.55 123.658 147.026 101.263 94.63 162.605 114.895 139.237 127.818 323.263 236.605 214.211 127.818 277.5 223.947 228.816 202.526 224.921 219.079 222.974 281.395 236.605 148.974 99.9 107.105 147.026 107.105 116.842 174.289 149.947 149.947 118.789 80.621 150.921 81.961 94.155 114.895 169.421 126.579 122.684 120.737 123.658 205.447 326.184 103.211 89.024 126.579 294.053 108.079 142.394 99.676 127.818 114.364 89.361 54.267 141.273 103.376 123.333 173.788 67.945 117.727 108.421 93.061 192.848 171.545 233.212 199.576 153.606 242.182 151.364 168.182 217.515 251.152 125.576 109.542 159.212 125.576 128.939 133.424 102.479 122.212 109.542 91.491 186.121 79.718 146.879 148 240.93 171.137 215.116 228.501 151.059 180.698 203.643 173.438 136.438 93.271 197.907 164.188 133.354 182.688 161.104 100.208 66.06 63.671 168.042 109.458 77.083 133.85 44.785 84.792 78.625 69.529 111.771 109.458 133.354 94.042 65.829 123.333 70.3 111 107.146 90.188 65.675 65.752 90.188 84.021 53.958 45.556 125.245 63.979 125.646 82.479 104.212 123.333 77.854 76.467 105.168 105.604 87.104 87.875 88.646 91.729 84.021 98.667 90.188 89.417 64.21 104.212 59.585 58.506 51.492 73.46 78.625 54.883 68.681 51.877 57.658 71.302 119.509 52.802 56.502 51.26 55.808 61.975 59.971 56.656 64.442 70.84 46.25 99.432 62.592 66.215 49.95 107.08 156.796 133.85 127.158 152.016 143.411 122.377 209.38 74.86 95.607 128.114 108.992 108.992 131.938 106.124 134.806 179.742 105.168 123.333 148.191 137.674 152.016 81.935 135.762 108.036 120.465 125.245 105.168 102.3 92.452 73.331 86.907 158.708 94.747 112.817 132.894 Xanthine 5.02 4.538 6.345 6.265 3.373 9.116 6.746 28.003 24.089 14.039 4.739 9.861 8.732 14.942 12.609 9.824 5.081 3.666 13.964 7.001 5.269 5.18 6.85 9.861 16.448 12.646 10.539 10.877 10.953 10.652 8.506 7.188 9.899 8.243 11.931 8.092 11.894 15.093 13.475 17.276 12.458 9.824 12.73 13.061 18.104 17.728 16.665 6.399 7.678 6.7 4.096 7.678 6.173 5.345 14.566 8.017 5.57 11.367 8.318 10.84 7.189 3.972 6.135 7.114 3.561 6.436 9.108 6.022 4.968 4.291 8.469 5.119 10.28 4.441 7.151 5.269 5.985 5.721 9.146 7.942 4.667 4.592 6.737 8.353 8.92 4.291 4.291 7.75 7.911 9.357 14.216 26.383 21.123 9.798 15.26 12.449 12.449 14.376 10.24 10.642 7.389 7.67 8.232 37.869 12.128 12.65 16.264 19.557 10.441 11.164 11.967 14.417 15.34 10.32 13.894 14.457 12.369 15.782 18.071 11.445 14.698 9.317 9.598 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name HMDB PubChem KEGG 1-Methylhistidine HMDB0000001 92105 C01152 2-Aminobutyric acid HMDB0000452 80283 C02356 3-Aminobutyric acid HMDB0031654 10932 NA 3-Hydroxyglutaric acid HMDB0000428 181976 NA 3-Indolepropionic acid HMDB0002302 3744 NA 3-Methylhistidine HMDB0000479 64969 C01152 5-Aminopentanoic acid HMDB0003355 138 C00431 Alanine HMDB0000161 5950 C00041 alpha-Aminoadipic acid HMDB0000510 469 C00956 Anserine HMDB0000194 112072 C01262 Arachidonic acid HMDB0001043 444899 C00219 Arginine HMDB0000517 6322 C00062 Asparagine HMDB0000168 6267 C00152 Aspartic acid HMDB0000191 5960 C00049 beta-Alanine HMDB0000056 239 C00099 Betaine HMDB0000043 247 C00719 Carnosine HMDB0000033 439224 C00386 Cholic acid HMDB0000619 221493 C00695 Choline HMDB0000097 305 C00114 cis-Aconitic acid HMDB0000072 643757 C00417 Citrulline HMDB0000904 9750 C00327 Creatinine HMDB0000562 588 C00791 Cysteine HMDB0000574 5862 C00097 Cystine HMDB0000192 67678 C00491 Deoxycholic acid HMDB0000626 222528 C04483 DHA HMDB0001882 670 C00184 Dimethylarginine HMDB0001539 123831 C03626 Eicosadienoic acid HMDB0005060 6439848 C16525 Eicosatrienoic acid HMDB0002925 5280581 C03242 EPA HMDB0001999 446284 C06428 gamma-Aminobutyric acid HMDB0000112 223130 C00334 Glutamic acid HMDB0000148 33032 C00025 Glutamine HMDB0000641 5961 C00064 Glycine HMDB0000123 750 C00037 Heneicosenoic acid NA NA NA Hippuric acid HMDB0000714 464 C01586 Histamine HMDB0000870 774 C00388 Histidine HMDB0000177 6274 C00135 Homoarginine HMDB0000670 9085 C01924 Homocysteine NA 91552 NA Hypoxanthine HMDB0000157 790 C00262 Indoleacetic acid HMDB0000197 802 C00954 Indoxyl sulfate HMDB0000682 10258 NA Isoleucine HMDB0000172 6306 C00407 Kynurenine HMDB0000684 161166 C00328 Lactic acid HMDB0000190 107689 C00186 Leucine HMDB0000687 6106 C00123 Linoleic acid HMDB0000673 5280450 C01595 Lysine HMDB0000182 5962 C00047 Methionine HMDB0000696 6137 C00073 Methionine sulfoxide HMDB0002005 158980 C02989 Oleic acid HMDB0000207 445639 C00712 Ornithine HMDB0000214 6262 C00077 p-Cresol sulfate HMDB0011635 4615423 NA Phenylacetylglycine HMDB0000821 68144 C05598 Phenylalanine HMDB0000159 6140 C00079 Proline HMDB0000162 145742 C00148 Proline betaine HMDB0004827 7016563 C10172 Putrescine HMDB0001414 1045 C00134 Sarcosine HMDB0000271 1088 C00213 Serine HMDB0062263 5951 C00716 Serotonin HMDB0000259 5202 C00780 Spermidine HMDB0001257 1102 C00315 Spermine HMDB0001256 1103 C00750 Succinic acid HMDB0000254 1110 C00042 Symmetric dimethyl-arginine HMDB0003334 169148 NA Taurine HMDB0000251 1123 C00245 Taurochenodeoxycholic acid HMDB0000951 387316 C05465 Taurocholic acid HMDB0000036 6675 C05122 Taurodeoxycholic acid HMDB0000896 2733768 C05463 Tauromuricholic acid HMDB0000932 21124703 NA Tetradecanedioic acid HMDB0000872 13185 C11002 Threonine HMDB0000167 6288 C00188 trans-4-Hydroxyproline HMDB0000725 5810 C01157 Trigonelline HMDB0000875 5570 C01004 Tryptophan HMDB0000929 6305 C00078 Tyrosine HMDB0000158 6057 C00082 Valine HMDB0000883 6287 C00183 Xanthine HMDB0000292 1188 C00385 METABOLITES_END #END