#METABOLOMICS WORKBENCH cclish_20201105_073925 DATATRACK_ID:2227 STUDY_ID:ST001519 ANALYSIS_ID:AN002525 PROJECT_ID:PR001024 VERSION 1 CREATED_ON November 5, 2020, 11:52 am #PROJECT PR:PROJECT_TITLE Role of Diet in the Reconstitution of the Human Gut Microbiome and its PR:PROJECT_TITLE Metabolome PR:PROJECT_TYPE Observational study PR:PROJECT_SUMMARY We studied the impact of three divergent diets, vegan, omnivore, and a synthetic PR:PROJECT_SUMMARY enteral nutrition (EEN) diet lacking fiber, on the human gut microbiome and its PR:PROJECT_SUMMARY metabolome in a longitudinal analysis that included a microbiota depletion PR:PROJECT_SUMMARY intervention. Hybrid nontargeted LC-MS methods were used to profile stool and PR:PROJECT_SUMMARY plasma metabolites. PR:INSTITUTE Broad Institute of MIT and Harvard PR:LAST_NAME Clish PR:FIRST_NAME Clary PR:ADDRESS 415 Main Street, Cambridge, MA, 02142, USA PR:EMAIL clary@broadinstitute.org PR:PHONE 617-714-7654 PR:FUNDING_SOURCE Crohn’s & Colitis Foundation, P30 DK 050306, PennCHOP Microbiome Program, and PR:FUNDING_SOURCE the Penn Center for Nutritional Science and Medicine PR:CONTRIBUTORS Ceylan Tanes, Kyle Bittinger, Yuan Gao, Elliot S. Friedman, Lisa Nessel, Unmesha PR:CONTRIBUTORS Roy Paladhi, Lillian Chau, Erika Panfen, Michael A. Fischbach, Jonathan Braun, PR:CONTRIBUTORS Ramnik J. Xavier, Clary B. Clish, Hongzhe Li, Frederic D. Bushman, James D. PR:CONTRIBUTORS Lewis, Gary D. Wu #STUDY ST:STUDY_TITLE Stool metabolites of known identity profiled using hybrid nontargeted methods ST:STUDY_TITLE (part-I) ST:STUDY_SUMMARY We determined the effect of diet on the composition and metabolic function of ST:STUDY_SUMMARY human gut microbiome using a controlled feeding experiment with three divergent ST:STUDY_SUMMARY diets (vegan, omnivore, and an exclusive enteral nutrition diet (EEN) devoid of ST:STUDY_SUMMARY dietary fiber) in the Food And Resulting Microbial Metabolites (FARMM) study. ST:STUDY_SUMMARY The study included an antibiotic and polyethylene glycol (Abx/PEG) intervention ST:STUDY_SUMMARY to dynamically assess the effect of diet on the reconstitution of the gut ST:STUDY_SUMMARY microbiota and its associated fecal and plasma metabolome. Samples from thirty ST:STUDY_SUMMARY healthy volunteers between the ages of 18 and 60, 10 mper diet group were ST:STUDY_SUMMARY analyzed. Self-reported vegans were required to have followed a vegan diet for a ST:STUDY_SUMMARY minimum of 6 months prior to enrollment. Key exclusion criteria included ST:STUDY_SUMMARY inflammatory bowel disease, celiac disease, or other chronic intestinal ST:STUDY_SUMMARY disorders; prior bowel resection surgery other than appendectomy; baseline bowel ST:STUDY_SUMMARY frequency less than every 2 days or greater than 3 times daily; creatinine ST:STUDY_SUMMARY concentration greater than the upper limit of normal; diabetes mellitus; ST:STUDY_SUMMARY currently smoking; body mass index (BMI) <18.5 or >35; and use of antibiotics ST:STUDY_SUMMARY and probiotics in the prior 6 months. The 10 vegans continued to follow their ST:STUDY_SUMMARY usual diet as outpatients. All participants completed the Diet History ST:STUDY_SUMMARY Questionnaire II (DHQ II), a food frequency questionnaire developed by the Risk ST:STUDY_SUMMARY Factor Monitoring and Methods Branch of the National Cancer Institute. The vegan ST:STUDY_SUMMARY participants also completed three 24 hour diet recalls with a dietitian in the ST:STUDY_SUMMARY week prior to starting antibiotics. We randomly assigned the 20 omnivores to ST:STUDY_SUMMARY receive an omnivore diet or EEN (Modulen® IBD) while residing in an inpatient ST:STUDY_SUMMARY research unit. The macronutrient composition of Modulen® is protein 36g, fat ST:STUDY_SUMMARY 47g, and carbohydrate 110g per 1000 Kcal. The two omnivore diets were engineered ST:STUDY_SUMMARY to have a similar composition to EEN. All the subjects consumed the menu A on ST:STUDY_SUMMARY day 11 and menu B on days 4 and 14. Diets for omnivores were constructed to ST:STUDY_SUMMARY provide the expected total calories required per day for the participant to ST:STUDY_SUMMARY maintain their current weight and were adjusted if there was weight gain or loss ST:STUDY_SUMMARY of more than 2.5 pounds. On days 6, 7, and 8, inpatients participants received ST:STUDY_SUMMARY vancomycin 500mg orally every 6 hours and neomycin 1000mg orally every 6 hours. ST:STUDY_SUMMARY On day 7, participants consumed 4L of polyethylene glycol (PEG) based bowel ST:STUDY_SUMMARY purgative (GoLytely®). Participants in the omnivore and EEN arms left the ST:STUDY_SUMMARY inpatient research unit only under the direct supervision of a research staff ST:STUDY_SUMMARY member. The vegan outpatients reported to the hospital twice on days 6,7 and 8 ST:STUDY_SUMMARY to receive antibiotics and to consume PEG on day 7. The first stool sample of ST:STUDY_SUMMARY each day of the inpatient groups was collected, aliquoted and frozen immediately ST:STUDY_SUMMARY at -80oC. Blood was collected on days 1, 5, 9, 12 and 15 from which plasma ST:STUDY_SUMMARY aliquots were immediately isolated and frozen at -80oC. The outpatient ST:STUDY_SUMMARY participants following the vegan diet also had blood collected on days 1, 5, 9, ST:STUDY_SUMMARY 12, and 15 from which plasma aliquots were immediately isolated and frozen at ST:STUDY_SUMMARY -80oC. Among these participants, the first stool of the day was collected at ST:STUDY_SUMMARY home daily and kept on ice packs until it was brought to the research unit where ST:STUDY_SUMMARY it could be aliquoted and frozen. Samples from vegans were received for ST:STUDY_SUMMARY aliquoting within 24 hours and on average within 4 hours (Wu et al., 2010). Day ST:STUDY_SUMMARY 0 stool was not collected from vegans since their diet did not change. The ST:STUDY_SUMMARY aliquoted amounts for all samples ranged from 500 mg to 1 g. The aliquots were ST:STUDY_SUMMARY taken from different areas of the sample. Remaining sample was then collected ST:STUDY_SUMMARY into one residual 50 ml conical tube with a tongue depressor. Any remaining ST:STUDY_SUMMARY stool was discarded. The University of Pennsylvania Institutional Review Board ST:STUDY_SUMMARY (IRB) approved the research protocol. ST:INSTITUTE Broad Institute of MIT and Harvard ST:LAST_NAME Clish ST:FIRST_NAME Clary ST:ADDRESS 415 Main Street, Cambridge, MA, 02142, USA ST:EMAIL clary@broadinstitute.org ST:PHONE 617-714-7654 ST:NUM_GROUPS 3 ST:TOTAL_SUBJECTS 30 ST:NUM_MALES 20 ST:NUM_FEMALES 10 ST:STUDY_COMMENTS stool samples collected at baseline and 3-4 timepoints #SUBJECT SU:SUBJECT_TYPE Human SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 SU:AGE_OR_AGE_RANGE 20-60 SU:WEIGHT_OR_WEIGHT_RANGE BMI range: 20-35 SU:GENDER Male and female SU:HUMAN_RACE White; American Indian/Alaskan Native; Black/African American SU:HUMAN_ETHNICITY Hispanic or Latino; Non-Hispanic or Latino SU:HUMAN_TRIAL_TYPE Intervention trial SU:HUMAN_EXCLUSION_CRITERIA Key exclusion criteria included inflammatory bowel disease, celiac disease, or SU:HUMAN_EXCLUSION_CRITERIA other chronic intestinal disorders; prior bowel resection surgery other than SU:HUMAN_EXCLUSION_CRITERIA appendectomy; baseline bowel frequency less than every 2 days or greater than 3 SU:HUMAN_EXCLUSION_CRITERIA times daily; creatinine concentration greater than the upper limit of normal; SU:HUMAN_EXCLUSION_CRITERIA diabetes mellitus; currently smoking; body mass index (BMI) <18.5 or >35; and SU:HUMAN_EXCLUSION_CRITERIA use of antibiotics and probiotics in the prior 6 months #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 9002 9002-3-SA Age:20 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.3; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0229_WUG_FARMM_HIL-9002-3-SA.raw 0229_WUG_FARMM_LIP-9002-3-SA.raw 0229_WU_FARMM_CMH_9002-3-SA.raw 0229_WUG_FARMM_FFA-9002-3-SA.raw SUBJECT_SAMPLE_FACTORS 9002 9002-3-SB Age:20 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.3; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0227_WUG_FARMM_HIL-9002-3-SB.raw 0227_WUG_FARMM_LIP-9002-3-SB.raw 0227_WU_FARMM_CMH_9002-3-SB.raw 0227_WUG_FARMM_FFA-9002-3-SB.raw SUBJECT_SAMPLE_FACTORS 9002 9002-3-SC Age:20 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.3; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0230_WUG_FARMM_HIL-9002-3-SC.raw 0230_WUG_FARMM_LIP-9002-3-SC.raw 0230_WU_FARMM_CMH_9002-3-SC.raw 0230_WUG_FARMM_FFA-9002-3-SC.raw SUBJECT_SAMPLE_FACTORS 9002 9002-3-SD Age:20 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.3; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0231_WUG_FARMM_HIL-9002-3-SD.raw 0231_WUG_FARMM_LIP-9002-3-SD.raw 0231_WU_FARMM_CMH_9002-3-SD.raw 0231_WUG_FARMM_FFA-9002-3-SD.raw SUBJECT_SAMPLE_FACTORS 9002 9002-3-SE Age:20 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.3; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0228_WUG_FARMM_HIL-9002-3-SE.raw 0228_WUG_FARMM_LIP-9002-3-SE.raw 0228_WU_FARMM_CMH_9002-3-SE.raw 0228_WUG_FARMM_FFA-9002-3-SE.raw SUBJECT_SAMPLE_FACTORS 9003 9003-2-SA Age:20 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=20.3; Ethnicity=NA; Time=Day 15; RAW_FILE_NAME=0296_WUG_FARMM_HIL-9003-2-SA.raw 0296_WUG_FARMM_LIP-9003-2-SA.raw 0296_WU_FARMM_CMH_9003-2-SA.raw 0296_WUG_FARMM_FFA-9003-2-SA.raw SUBJECT_SAMPLE_FACTORS 9003 9003-2-SB Age:20 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=20.3; Ethnicity=NA; Time=Day 12; RAW_FILE_NAME=0293_WUG_FARMM_HIL-9003-2-SB.raw 0293_WUG_FARMM_LIP-9003-2-SB.raw 0293_WU_FARMM_CMH_9003-2-SB.raw 0293_WUG_FARMM_FFA-9003-2-SB.raw SUBJECT_SAMPLE_FACTORS 9003 9003-2-SC Age:20 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=20.3; Ethnicity=NA; Time=Day 9; RAW_FILE_NAME=0295_WUG_FARMM_HIL-9003-2-SC.raw 0295_WUG_FARMM_LIP-9003-2-SC.raw 0295_WU_FARMM_CMH_9003-2-SC.raw 0295_WUG_FARMM_FFA-9003-2-SC.raw SUBJECT_SAMPLE_FACTORS 9003 9003-2-SE Age:20 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=20.3; Ethnicity=NA; Time=Baseline; RAW_FILE_NAME=0297_WUG_FARMM_HIL-9003-2-SE.raw 0297_WUG_FARMM_LIP-9003-2-SE.raw 0297_WU_FARMM_CMH_9003-2-SE.raw 0297_WUG_FARMM_FFA-9003-2-SE.raw SUBJECT_SAMPLE_FACTORS 9004 9004-3-SA Age:24 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.7; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0242_WUG_FARMM_HIL-9004-3-SA.raw 0242_WUG_FARMM_LIP-9004-3-SA.raw 0242_WU_FARMM_CMH_9004-3-SA.raw 0242_WUG_FARMM_FFA-9004-3-SA.raw SUBJECT_SAMPLE_FACTORS 9004 9004-3-SB Age:24 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.7; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0243_WUG_FARMM_HIL-9004-3-SB.raw 0243_WUG_FARMM_LIP-9004-3-SB.raw 0243_WU_FARMM_CMH_9004-3-SB.raw 0243_WUG_FARMM_FFA-9004-3-SB.raw SUBJECT_SAMPLE_FACTORS 9004 9004-3-SC Age:24 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.7; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0246_WUG_FARMM_HIL-9004-3-SC.raw 0246_WUG_FARMM_LIP-9004-3-SC.raw 0246_WU_FARMM_CMH_9004-3-SC.raw 0246_WUG_FARMM_FFA-9004-3-SC.raw SUBJECT_SAMPLE_FACTORS 9004 9004-3-SD Age:24 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.7; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0244_WUG_FARMM_HIL-9004-3-SD.raw 0244_WUG_FARMM_LIP-9004-3-SD.raw 0244_WU_FARMM_CMH_9004-3-SD.raw 0244_WUG_FARMM_FFA-9004-3-SD.raw SUBJECT_SAMPLE_FACTORS 9004 9004-3-SE Age:24 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.7; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0245_WUG_FARMM_HIL-9004-3-SE.raw 0245_WUG_FARMM_LIP-9004-3-SE.raw 0245_WU_FARMM_CMH_9004-3-SE.raw 0245_WUG_FARMM_FFA-9004-3-SE.raw SUBJECT_SAMPLE_FACTORS 9005 9005-1-SA Age:23 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=21.6; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0260_WUG_FARMM_HIL-9005-1-SA.raw 0260_WUG_FARMM_LIP-9005-1-SA.raw 0260_WU_FARMM_CMH_9005-1-SA.raw 0260_WUG_FARMM_FFA-9005-1-SA.raw SUBJECT_SAMPLE_FACTORS 9005 9005-1-SB Age:23 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=21.6; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0257_WUG_FARMM_HIL-9005-1-SB.raw 0257_WUG_FARMM_LIP-9005-1-SB.raw 0257_WU_FARMM_CMH_9005-1-SB.raw 0257_WUG_FARMM_FFA-9005-1-SB.raw SUBJECT_SAMPLE_FACTORS 9005 9005-1-SC Age:23 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=21.6; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0259_WUG_FARMM_HIL-9005-1-SC.raw 0259_WUG_FARMM_LIP-9005-1-SC.raw 0259_WU_FARMM_CMH_9005-1-SC.raw 0259_WUG_FARMM_FFA-9005-1-SC.raw SUBJECT_SAMPLE_FACTORS 9005 9005-1-SD Age:23 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=21.6; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0258_WUG_FARMM_HIL-9005-1-SD.raw 0258_WUG_FARMM_LIP-9005-1-SD.raw 0258_WU_FARMM_CMH_9005-1-SD.raw 0258_WUG_FARMM_FFA-9005-1-SD.raw SUBJECT_SAMPLE_FACTORS 9005 9005-1-SE Age:23 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=21.6; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0261_WUG_FARMM_HIL-9005-1-SE.raw 0261_WUG_FARMM_LIP-9005-1-SE.raw 0261_WU_FARMM_CMH_9005-1-SE.raw 0261_WUG_FARMM_FFA-9005-1-SE.raw SUBJECT_SAMPLE_FACTORS 9006 9006-1-SA Age:24 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=28.2; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0198_WUG_FARMM_HIL-9006-1-SA.raw 0198_WUG_FARMM_LIP-9006-1-SA.raw 0198_WU_FARMM_CMH_9006-1-SA.raw 0198_WUG_FARMM_FFA-9006-1-SA.raw SUBJECT_SAMPLE_FACTORS 9006 9006-1-SB Age:24 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=28.2; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0199_WUG_FARMM_HIL-9006-1-SB.raw 0199_WUG_FARMM_LIP-9006-1-SB.raw 0199_WU_FARMM_CMH_9006-1-SB.raw 0199_WUG_FARMM_FFA-9006-1-SB.raw SUBJECT_SAMPLE_FACTORS 9006 9006-1-SC Age:24 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=28.2; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0201_WUG_FARMM_HIL-9006-1-SC.raw 0201_WUG_FARMM_LIP-9006-1-SC.raw 0201_WU_FARMM_CMH_9006-1-SC.raw 0201_WUG_FARMM_FFA-9006-1-SC.raw SUBJECT_SAMPLE_FACTORS 9006 9006-1-SD Age:24 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=28.2; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0197_WUG_FARMM_HIL-9006-1-SD.raw 0197_WUG_FARMM_LIP-9006-1-SD.raw 0197_WU_FARMM_CMH_9006-1-SD.raw 0197_WUG_FARMM_FFA-9006-1-SD.raw SUBJECT_SAMPLE_FACTORS 9006 9006-1-SE Age:24 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=28.2; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0200_WUG_FARMM_HIL-9006-1-SE.raw 0200_WUG_FARMM_LIP-9006-1-SE.raw 0200_WU_FARMM_CMH_9006-1-SE.raw 0200_WUG_FARMM_FFA-9006-1-SE.raw SUBJECT_SAMPLE_FACTORS 9008 9008-3-SA Age:23 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=20; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0254_WUG_FARMM_HIL-9008-3-SA.raw 0254_WUG_FARMM_LIP-9008-3-SA.raw 0254_WU_FARMM_CMH_9008-3-SA.raw 0254_WUG_FARMM_FFA-9008-3-SA.raw SUBJECT_SAMPLE_FACTORS 9008 9008-3-SB Age:23 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=20; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0256_WUG_FARMM_HIL-9008-3-SB.raw 0256_WUG_FARMM_LIP-9008-3-SB.raw 0256_WU_FARMM_CMH_9008-3-SB.raw 0256_WUG_FARMM_FFA-9008-3-SB.raw SUBJECT_SAMPLE_FACTORS 9008 9008-3-SC Age:23 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=20; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0252_WUG_FARMM_HIL-9008-3-SC.raw 0252_WUG_FARMM_LIP-9008-3-SC.raw 0252_WU_FARMM_CMH_9008-3-SC.raw 0252_WUG_FARMM_FFA-9008-3-SC.raw SUBJECT_SAMPLE_FACTORS 9008 9008-3-SD Age:23 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=20; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0255_WUG_FARMM_HIL-9008-3-SD.raw 0255_WUG_FARMM_LIP-9008-3-SD.raw 0255_WU_FARMM_CMH_9008-3-SD.raw 0255_WUG_FARMM_FFA-9008-3-SD.raw SUBJECT_SAMPLE_FACTORS 9008 9008-3-SE Age:23 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=20; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0253_WUG_FARMM_HIL-9008-3-SE.raw 0253_WUG_FARMM_LIP-9008-3-SE.raw 0253_WU_FARMM_CMH_9008-3-SE.raw 0253_WUG_FARMM_FFA-9008-3-SE.raw SUBJECT_SAMPLE_FACTORS 9009 9009-2-SA Age:23 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=22.4; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0282_WUG_FARMM_HIL-9009-2-SA.raw 0282_WUG_FARMM_LIP-9009-2-SA.raw 0282_WU_FARMM_CMH_9009-2-SA.raw 0282_WUG_FARMM_FFA-9009-2-SA.raw SUBJECT_SAMPLE_FACTORS 9009 9009-2-SB Age:23 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=22.4; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0283_WUG_FARMM_HIL-9009-2-SB.raw 0283_WUG_FARMM_LIP-9009-2-SB.raw 0283_WU_FARMM_CMH_9009-2-SB.raw 0283_WUG_FARMM_FFA-9009-2-SB.raw SUBJECT_SAMPLE_FACTORS 9009 9009-2-SC Age:23 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=22.4; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0284_WUG_FARMM_HIL-9009-2-SC.raw 0284_WUG_FARMM_LIP-9009-2-SC.raw 0284_WU_FARMM_CMH_9009-2-SC.raw 0284_WUG_FARMM_FFA-9009-2-SC.raw SUBJECT_SAMPLE_FACTORS 9009 9009-2-SD Age:23 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=22.4; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0285_WUG_FARMM_HIL-9009-2-SD.raw 0302f_0285ri_WUG_FARMM_LIP-9009-2-SD.raw 0285_WU_FARMM_CMH_9009-2-SD.raw 0285_WUG_FARMM_FFA-9009-2-SD.raw SUBJECT_SAMPLE_FACTORS 9009 9009-2-SE Age:23 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=22.4; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0286_WUG_FARMM_HIL-9009-2-SE.raw 0286_WUG_FARMM_LIP-9009-2-SE.raw 0286_WU_FARMM_CMH_9009-2-SE.raw 0286_WUG_FARMM_FFA-9009-2-SE.raw SUBJECT_SAMPLE_FACTORS 9010 9010-1-SA Age:24 | Sex:Female | Race:White | Study_Diet:Western Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0301_WUG_FARMM_HIL-9010-1-SA.raw 0301_WUG_FARMM_LIP-9010-1-SA.raw 0301_WU_FARMM_CMH_9010-1-SA.raw 0301_WUG_FARMM_FFA-9010-1-SA.raw SUBJECT_SAMPLE_FACTORS 9010 9010-1-SB Age:24 | Sex:Female | Race:White | Study_Diet:Western Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0300_WUG_FARMM_HIL-9010-1-SB.raw 0300_WUG_FARMM_LIP-9010-1-SB.raw 0300_WU_FARMM_CMH_9010-1-SB.raw 0300_WUG_FARMM_FFA-9010-1-SB.raw SUBJECT_SAMPLE_FACTORS 9010 9010-1-SC Age:24 | Sex:Female | Race:White | Study_Diet:Western Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0299_WUG_FARMM_HIL-9010-1-SC.raw 0302h_0299ri_WUG_FARMM_LIP-9010-1-SC.raw 0299_WU_FARMM_CMH_9010-1-SC.raw 0299_WUG_FARMM_FFA-9010-1-SC.raw SUBJECT_SAMPLE_FACTORS 9010 9010-1-SD Age:24 | Sex:Female | Race:White | Study_Diet:Western Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0298_WUG_FARMM_HIL-9010-1-SD.raw 0298_WUG_FARMM_LIP-9010-1-SD.raw 0298_WU_FARMM_CMH_9010-1-SD.raw 0298_WUG_FARMM_FFA-9010-1-SD.raw SUBJECT_SAMPLE_FACTORS 9010 9010-1-SE Age:24 | Sex:Female | Race:White | Study_Diet:Western Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0302_WUG_FARMM_HIL-9010-1-SE.raw 0302_WUG_FARMM_LIP-9010-1-SE.raw 0302_WU_FARMM_CMH_9010-1-SE.raw 0302_WUG_FARMM_FFA-9010-1-SE.raw SUBJECT_SAMPLE_FACTORS 9013 9013-2-SA Age:40 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=24.1; Ethnicity=Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0226_WUG_FARMM_HIL-9013-2-SA.raw 0226_WUG_FARMM_LIP-9013-2-SA.raw 0226_WU_FARMM_CMH_9013-2-SA.raw 0226_WUG_FARMM_FFA-9013-2-SA.raw SUBJECT_SAMPLE_FACTORS 9013 9013-2-SB Age:40 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=24.1; Ethnicity=Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0225_WUG_FARMM_HIL-9013-2-SB.raw 0225_WUG_FARMM_LIP-9013-2-SB.raw 0225_WU_FARMM_CMH_9013-2-SB.raw 0225_WUG_FARMM_FFA-9013-2-SB.raw SUBJECT_SAMPLE_FACTORS 9013 9013-2-SC Age:40 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=24.1; Ethnicity=Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0223_WUG_FARMM_HIL-9013-2-SC.raw 0223_WUG_FARMM_LIP-9013-2-SC.raw 0223_WU_FARMM_CMH_9013-2-SC.raw 0223_WUG_FARMM_FFA-9013-2-SC.raw SUBJECT_SAMPLE_FACTORS 9013 9013-2-SD Age:40 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=24.1; Ethnicity=Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0222_WUG_FARMM_HIL-9013-2-SD.raw 0222_WUG_FARMM_LIP-9013-2-SD.raw 0222_WU_FARMM_CMH_9013-2-SD.raw 0222_WUG_FARMM_FFA-9013-2-SD.raw SUBJECT_SAMPLE_FACTORS 9013 9013-2-SE Age:40 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=24.1; Ethnicity=Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0224_WUG_FARMM_HIL-9013-2-SE.raw 0224_WUG_FARMM_LIP-9013-2-SE.raw 0224_WU_FARMM_CMH_9013-2-SE.raw 0224_WUG_FARMM_FFA-9013-2-SE.raw SUBJECT_SAMPLE_FACTORS 9014 9014-3-SA Age:23 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=20.9; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0161_WUG_FARMM_HIL-9014-3-SA.raw 0161_WUG_FARMM_LIP-9014-3-SA.raw 0161_WU_FARMM_CMH_9014-3-SA.raw 0161_WUG_FARMM_FFA-9014-3-SA.raw SUBJECT_SAMPLE_FACTORS 9014 9014-3-SB Age:23 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=20.9; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0159_WUG_FARMM_HIL-9014-3-SB.raw 0159_WUG_FARMM_LIP-9014-3-SB.raw 0159_WU_FARMM_CMH_9014-3-SB.raw 0159_WUG_FARMM_FFA-9014-3-SB.raw SUBJECT_SAMPLE_FACTORS 9014 9014-3-SC Age:23 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=20.9; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0157_WUG_FARMM_HIL-9014-3-SC.raw 0157_WUG_FARMM_LIP-9014-3-SC.raw 0157_WU_FARMM_CMH_9014-3-SC.raw 0157_WUG_FARMM_FFA-9014-3-SC.raw SUBJECT_SAMPLE_FACTORS 9014 9014-3-SD Age:23 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=20.9; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0160_WUG_FARMM_HIL-9014-3-SD.raw 0160_WUG_FARMM_LIP-9014-3-SD.raw 0160_WU_FARMM_CMH_9014-3-SD.raw 0160_WUG_FARMM_FFA-9014-3-SD.raw SUBJECT_SAMPLE_FACTORS 9014 9014-3-SE Age:23 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=20.9; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0158_WUG_FARMM_HIL-9014-3-SE.raw 0158_WUG_FARMM_LIP-9014-3-SE.raw 0158_WU_FARMM_CMH_9014-3-SE.raw 0158_WUG_FARMM_FFA-9014-3-SE.raw SUBJECT_SAMPLE_FACTORS 9015 9015-1-SA Age:23 | Sex:Female | Race:White | Study_Diet:Western Type=Stool; BMI=20.5; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0248_WUG_FARMM_HIL-9015-1-SA.raw 0248_WUG_FARMM_LIP-9015-1-SA.raw 0248_WU_FARMM_CMH_9015-1-SA.raw 0248_WUG_FARMM_FFA-9015-1-SA.raw SUBJECT_SAMPLE_FACTORS 9015 9015-1-SB Age:23 | Sex:Female | Race:White | Study_Diet:Western Type=Stool; BMI=20.5; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0247_WUG_FARMM_HIL-9015-1-SB.raw 0247_WUG_FARMM_LIP-9015-1-SB.raw 0247_WU_FARMM_CMH_9015-1-SB.raw 0247_WUG_FARMM_FFA-9015-1-SB.raw SUBJECT_SAMPLE_FACTORS 9015 9015-1-SC Age:23 | Sex:Female | Race:White | Study_Diet:Western Type=Stool; BMI=20.5; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0251_WUG_FARMM_HIL-9015-1-SC.raw 0251_WUG_FARMM_LIP-9015-1-SC.raw 0251_WU_FARMM_CMH_9015-1-SC.raw 0251_WUG_FARMM_FFA-9015-1-SC.raw SUBJECT_SAMPLE_FACTORS 9015 9015-1-SD Age:23 | Sex:Female | Race:White | Study_Diet:Western Type=Stool; BMI=20.5; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0250_WUG_FARMM_HIL-9015-1-SD.raw 0250_WUG_FARMM_LIP-9015-1-SD.raw 0250_WU_FARMM_CMH_9015-1-SD.raw 0250_WUG_FARMM_FFA-9015-1-SD.raw SUBJECT_SAMPLE_FACTORS 9015 9015-1-SE Age:23 | Sex:Female | Race:White | Study_Diet:Western Type=Stool; BMI=20.5; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0249_WUG_FARMM_HIL-9015-1-SE.raw 0249_WUG_FARMM_LIP-9015-1-SE.raw 0249_WU_FARMM_CMH_9015-1-SE.raw 0249_WUG_FARMM_FFA-9015-1-SE.raw SUBJECT_SAMPLE_FACTORS 9016 9016-2-SA Age:38 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=25.6; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0218_WUG_FARMM_HIL-9016-2-SA.raw 0218_WUG_FARMM_LIP-9016-2-SA.raw 0218_WU_FARMM_CMH_9016-2-SA.raw 0218_WUG_FARMM_FFA-9016-2-SA.raw SUBJECT_SAMPLE_FACTORS 9016 9016-2-SB Age:38 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=25.6; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0217_WUG_FARMM_HIL-9016-2-SB.raw 0217_WUG_FARMM_LIP-9016-2-SB.raw 0217_WU_FARMM_CMH_9016-2-SB.raw 0217_WUG_FARMM_FFA-9016-2-SB.raw SUBJECT_SAMPLE_FACTORS 9016 9016-2-SC Age:38 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=25.6; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0221_WUG_FARMM_HIL-9016-2-SC.raw 0221_WUG_FARMM_LIP-9016-2-SC.raw 0221_WU_FARMM_CMH_9016-2-SC.raw 0221_WUG_FARMM_FFA-9016-2-SC.raw SUBJECT_SAMPLE_FACTORS 9016 9016-2-SD Age:38 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=25.6; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0219_WUG_FARMM_HIL-9016-2-SD.raw 0219_WUG_FARMM_LIP-9016-2-SD.raw 0219_WU_FARMM_CMH_9016-2-SD.raw 0219_WUG_FARMM_FFA-9016-2-SD.raw SUBJECT_SAMPLE_FACTORS 9016 9016-2-SE Age:38 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=25.6; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0220_WUG_FARMM_HIL-9016-2-SE.raw 0220_WUG_FARMM_LIP-9016-2-SE.raw 0220_WU_FARMM_CMH_9016-2-SE.raw 0220_WUG_FARMM_FFA-9016-2-SE.raw SUBJECT_SAMPLE_FACTORS 9017 9017-3-SA Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=20.6; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0208_WUG_FARMM_HIL-9017-3-SA.raw 0208_WUG_FARMM_LIP-9017-3-SA.raw 0208_WU_FARMM_CMH_9017-3-SA.raw 0208_WUG_FARMM_FFA-9017-3-SA.raw SUBJECT_SAMPLE_FACTORS 9017 9017-3-SB Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=20.6; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0207_WUG_FARMM_HIL-9017-3-SB.raw 0207_WUG_FARMM_LIP-9017-3-SB.raw 0207_WU_FARMM_CMH_9017-3-SB.raw 0207_WUG_FARMM_FFA-9017-3-SB.raw SUBJECT_SAMPLE_FACTORS 9017 9017-3-SC Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=20.6; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0209_WUG_FARMM_HIL-9017-3-SC.raw 0209_WUG_FARMM_LIP-9017-3-SC.raw 0209_WU_FARMM_CMH_9017-3-SC.raw 0209_WUG_FARMM_FFA-9017-3-SC.raw SUBJECT_SAMPLE_FACTORS 9017 9017-3-SD Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=20.6; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0211_WUG_FARMM_HIL-9017-3-SD.raw 0211_WUG_FARMM_LIP-9017-3-SD.raw 0211_WU_FARMM_CMH_9017-3-SD.raw 0211_WUG_FARMM_FFA-9017-3-SD.raw SUBJECT_SAMPLE_FACTORS 9017 9017-3-SE Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=20.6; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0210_WUG_FARMM_HIL-9017-3-SE.raw 0210_WUG_FARMM_LIP-9017-3-SE.raw 0210_WU_FARMM_CMH_9017-3-SE.raw 0210_WUG_FARMM_FFA-9017-3-SE.raw SUBJECT_SAMPLE_FACTORS 9019 9019-1-SA Age:36 | Sex:Male | Race:Black/African American | Study_Diet:Western Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0212_WUG_FARMM_HIL-9019-1-SA.raw 0212_WUG_FARMM_LIP-9019-1-SA.raw 0212_WU_FARMM_CMH_9019-1-SA.raw 0212_WUG_FARMM_FFA-9019-1-SA.raw SUBJECT_SAMPLE_FACTORS 9019 9019-1-SB Age:36 | Sex:Male | Race:Black/African American | Study_Diet:Western Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0214_WUG_FARMM_HIL-9019-1-SB.raw 0214_WUG_FARMM_LIP-9019-1-SB.raw 0214_WU_FARMM_CMH_9019-1-SB.raw 0214_WUG_FARMM_FFA-9019-1-SB.raw SUBJECT_SAMPLE_FACTORS 9019 9019-1-SC Age:36 | Sex:Male | Race:Black/African American | Study_Diet:Western Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0215_WUG_FARMM_HIL-9019-1-SC.raw 0302g_0215re_WUG_FARMM_LIP-9019-1-SC.raw 0215_WU_FARMM_CMH_9019-1-SC.raw 0215_WUG_FARMM_FFA-9019-1-SC.raw SUBJECT_SAMPLE_FACTORS 9019 9019-1-SD Age:36 | Sex:Male | Race:Black/African American | Study_Diet:Western Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0213_WUG_FARMM_HIL-9019-1-SD.raw 0213_WUG_FARMM_LIP-9019-1-SD.raw 0213_WU_FARMM_CMH_9019-1-SD.raw 0213_WUG_FARMM_FFA-9019-1-SD.raw SUBJECT_SAMPLE_FACTORS 9019 9019-1-SE Age:36 | Sex:Male | Race:Black/African American | Study_Diet:Western Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0216_WUG_FARMM_HIL-9019-1-SE.raw 0216_WUG_FARMM_LIP-9019-1-SE.raw 0216_WU_FARMM_CMH_9019-1-SE.raw 0216_WUG_FARMM_FFA-9019-1-SE.raw SUBJECT_SAMPLE_FACTORS 9022 9022-3-SA Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0156_WUG_FARMM_HIL-9022-3-SA.raw 0156_WUG_FARMM_LIP-9022-3-SA.raw 0156_WU_FARMM_CMH_9022-3-SA.raw 0156_WUG_FARMM_FFA-9022-3-SA.raw SUBJECT_SAMPLE_FACTORS 9022 9022-3-SB Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0154_WUG_FARMM_HIL-9022-3-SB.raw 0154_WUG_FARMM_LIP-9022-3-SB.raw 0154_WU_FARMM_CMH_9022-3-SB.raw 0154_WUG_FARMM_FFA-9022-3-SB.raw SUBJECT_SAMPLE_FACTORS 9022 9022-3-SC Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0155_WUG_FARMM_HIL-9022-3-SC.raw 0155_WUG_FARMM_LIP-9022-3-SC.raw 0155_WU_FARMM_CMH_9022-3-SC.raw 0155_WUG_FARMM_FFA-9022-3-SC.raw SUBJECT_SAMPLE_FACTORS 9022 9022-3-SD Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0153_WUG_FARMM_HIL-9022-3-SD.raw 0153_WUG_FARMM_LIP-9022-3-SD.raw 0153_WU_FARMM_CMH_9022-3-SD.raw 0153_WUG_FARMM_FFA-9022-3-SD.raw SUBJECT_SAMPLE_FACTORS 9022 9022-3-SE Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=21.8; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0152_WUG_FARMM_HIL-9022-3-SE.raw 0152_WUG_FARMM_LIP-9022-3-SE.raw 0152_WU_FARMM_CMH_9022-3-SE.raw 0152_WUG_FARMM_FFA-9022-3-SE.raw SUBJECT_SAMPLE_FACTORS 9024 9024-2-SA Age:27 | Sex:Female | Race:Black/African American | Study_Diet:Modulen Type=Stool; BMI=34.6; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0163_WUG_FARMM_HIL-9024-2-SA.raw 0163_WUG_FARMM_LIP-9024-2-SA.raw 0163_WU_FARMM_CMH_9024-2-SA.raw 0163_WUG_FARMM_FFA-9024-2-SA.raw SUBJECT_SAMPLE_FACTORS 9024 9024-2-SB Age:27 | Sex:Female | Race:Black/African American | Study_Diet:Modulen Type=Stool; BMI=34.6; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0164_WUG_FARMM_HIL-9024-2-SB.raw 0164_WUG_FARMM_LIP-9024-2-SB.raw 0164_WU_FARMM_CMH_9024-2-SB.raw 0164_WUG_FARMM_FFA-9024-2-SB.raw SUBJECT_SAMPLE_FACTORS 9024 9024-2-SD Age:27 | Sex:Female | Race:Black/African American | Study_Diet:Modulen Type=Stool; BMI=34.6; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0165_WUG_FARMM_HIL-9024-2-SD.raw 0165_WUG_FARMM_LIP-9024-2-SD.raw 0165_WU_FARMM_CMH_9024-2-SD.raw 0165_WUG_FARMM_FFA-9024-2-SD.raw SUBJECT_SAMPLE_FACTORS 9024 9024-2-SE Age:27 | Sex:Female | Race:Black/African American | Study_Diet:Modulen Type=Stool; BMI=34.6; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0162_WUG_FARMM_HIL-9024-2-SE.raw 0162_WUG_FARMM_LIP-9024-2-SE.raw 0162_WU_FARMM_CMH_9024-2-SE.raw 0162_WUG_FARMM_FFA-9024-2-SE.raw SUBJECT_SAMPLE_FACTORS 9025 9025-2-SA Age:28 | Sex:Male | Race:Black/African American | Study_Diet:Modulen Type=Stool; BMI=30.8; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0192_WUG_FARMM_HIL-9025-2-SA.raw 0192_WUG_FARMM_LIP-9025-2-SA.raw 0192_WU_FARMM_CMH_9025-2-SA.raw 0192_WUG_FARMM_FFA-9025-2-SA.raw SUBJECT_SAMPLE_FACTORS 9025 9025-2-SB Age:28 | Sex:Male | Race:Black/African American | Study_Diet:Modulen Type=Stool; BMI=30.8; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0196_WUG_FARMM_HIL-9025-2-SB.raw 0302e_0196re_WUG_FARMM_LIP-9025-2-SB.raw 0196_WU_FARMM_CMH_9025-2-SB.raw 0196_WUG_FARMM_FFA-9025-2-SB.raw SUBJECT_SAMPLE_FACTORS 9025 9025-2-SC Age:28 | Sex:Male | Race:Black/African American | Study_Diet:Modulen Type=Stool; BMI=30.8; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0194_WUG_FARMM_HIL-9025-2-SC.raw 0194_WUG_FARMM_LIP-9025-2-SC.raw 0194_WU_FARMM_CMH_9025-2-SC.raw 0194_WUG_FARMM_FFA-9025-2-SC.raw SUBJECT_SAMPLE_FACTORS 9025 9025-2-SD Age:28 | Sex:Male | Race:Black/African American | Study_Diet:Modulen Type=Stool; BMI=30.8; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0195_WUG_FARMM_HIL-9025-2-SD.raw 0195_WUG_FARMM_LIP-9025-2-SD.raw 0195_WU_FARMM_CMH_9025-2-SD.raw 0195_WUG_FARMM_FFA-9025-2-SD.raw SUBJECT_SAMPLE_FACTORS 9025 9025-2-SE Age:28 | Sex:Male | Race:Black/African American | Study_Diet:Modulen Type=Stool; BMI=30.8; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0193_WUG_FARMM_HIL-9025-2-SE.raw 0193_WUG_FARMM_LIP-9025-2-SE.raw 0193_WU_FARMM_CMH_9025-2-SE.raw 0193_WUG_FARMM_FFA-9025-2-SE.raw SUBJECT_SAMPLE_FACTORS 9026 9026-3-SA Age:24 | Sex:Female | Race:Black/African American | Study_Diet:Vegan Type=Stool; BMI=21.3; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0190_WUG_FARMM_HIL-9026-3-SA.raw 0190_WUG_FARMM_LIP-9026-3-SA.raw 0190_WU_FARMM_CMH_9026-3-SA.raw 0190_WUG_FARMM_FFA-9026-3-SA.raw SUBJECT_SAMPLE_FACTORS 9026 9026-3-SB Age:24 | Sex:Female | Race:Black/African American | Study_Diet:Vegan Type=Stool; BMI=21.3; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0191_WUG_FARMM_HIL-9026-3-SB.raw 0191_WUG_FARMM_LIP-9026-3-SB.raw 0191_WU_FARMM_CMH_9026-3-SB.raw 0191_WUG_FARMM_FFA-9026-3-SB.raw SUBJECT_SAMPLE_FACTORS 9026 9026-3-SC Age:24 | Sex:Female | Race:Black/African American | Study_Diet:Vegan Type=Stool; BMI=21.3; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0189_WUG_FARMM_HIL-9026-3-SC.raw 0189_WUG_FARMM_LIP-9026-3-SC.raw 0189_WU_FARMM_CMH_9026-3-SC.raw 0189_WUG_FARMM_FFA-9026-3-SC.raw SUBJECT_SAMPLE_FACTORS 9026 9026-3-SD Age:24 | Sex:Female | Race:Black/African American | Study_Diet:Vegan Type=Stool; BMI=21.3; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0187_WUG_FARMM_HIL-9026-3-SD.raw 0187_WUG_FARMM_LIP-9026-3-SD.raw 0187_WU_FARMM_CMH_9026-3-SD.raw 0187_WUG_FARMM_FFA-9026-3-SD.raw SUBJECT_SAMPLE_FACTORS 9026 9026-3-SE Age:24 | Sex:Female | Race:Black/African American | Study_Diet:Vegan Type=Stool; BMI=21.3; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0188_WUG_FARMM_HIL-9026-3-SE.raw 0188_WUG_FARMM_LIP-9026-3-SE.raw 0188_WU_FARMM_CMH_9026-3-SE.raw 0188_WUG_FARMM_FFA-9026-3-SE.raw SUBJECT_SAMPLE_FACTORS 9027 9027-3-SB Age:22 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=25.1; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0179_WUG_FARMM_HIL-9027-3-SB.raw 0179_WUG_FARMM_LIP-9027-3-SB.raw 0179_WU_FARMM_CMH_9027-3-SB.raw 0179_WUG_FARMM_FFA-9027-3-SB.raw SUBJECT_SAMPLE_FACTORS 9027 9027-3-SC Age:22 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=25.1; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0180_WUG_FARMM_HIL-9027-3-SC.raw 0180_WUG_FARMM_LIP-9027-3-SC.raw 0180_WU_FARMM_CMH_9027-3-SC.raw 0180_WUG_FARMM_FFA-9027-3-SC.raw SUBJECT_SAMPLE_FACTORS 9027 9027-3-SD Age:22 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=25.1; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0177_WUG_FARMM_HIL-9027-3-SD.raw 0177_WUG_FARMM_LIP-9027-3-SD.raw 0177_WU_FARMM_CMH_9027-3-SD.raw 0177_WUG_FARMM_FFA-9027-3-SD.raw SUBJECT_SAMPLE_FACTORS 9027 9027-3-SE Age:22 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=25.1; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0178_WUG_FARMM_HIL-9027-3-SE.raw 0178_WUG_FARMM_LIP-9027-3-SE.raw 0178_WU_FARMM_CMH_9027-3-SE.raw 0178_WUG_FARMM_FFA-9027-3-SE.raw SUBJECT_SAMPLE_FACTORS 9029 9029-2-SA Age:26 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=35.4; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0279_WUG_FARMM_HIL-9029-2-SA.raw 0279_WUG_FARMM_LIP-9029-2-SA.raw 0279_WU_FARMM_CMH_9029-2-SA.raw 0279_WUG_FARMM_FFA-9029-2-SA.raw SUBJECT_SAMPLE_FACTORS 9029 9029-2-SB Age:26 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=35.4; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0277_WUG_FARMM_HIL-9029-2-SB.raw 0277_WUG_FARMM_LIP-9029-2-SB.raw 0277_WU_FARMM_CMH_9029-2-SB.raw 0277_WUG_FARMM_FFA-9029-2-SB.raw SUBJECT_SAMPLE_FACTORS 9029 9029-2-SC Age:26 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=35.4; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0281_WUG_FARMM_HIL-9029-2-SC.raw 0281_WUG_FARMM_LIP-9029-2-SC.raw 0281_WU_FARMM_CMH_9029-2-SC.raw 0281_WUG_FARMM_FFA-9029-2-SC.raw SUBJECT_SAMPLE_FACTORS 9029 9029-2-SD Age:26 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=35.4; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0278_WUG_FARMM_HIL-9029-2-SD.raw 0278_WUG_FARMM_LIP-9029-2-SD.raw 0278_WU_FARMM_CMH_9029-2-SD.raw 0278_WUG_FARMM_FFA-9029-2-SD.raw SUBJECT_SAMPLE_FACTORS 9029 9029-2-SE Age:26 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=35.4; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0280_WUG_FARMM_HIL-9029-2-SE.raw 0280_WUG_FARMM_LIP-9029-2-SE.raw 0280_WU_FARMM_CMH_9029-2-SE.raw 0280_WUG_FARMM_FFA-9029-2-SE.raw SUBJECT_SAMPLE_FACTORS 9030 9030-1-SA Age:46 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=27.7; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0204_WUG_FARMM_HIL-9030-1-SA.raw 0302f_0204re_WUG_FARMM_LIP-9030-1-SA.raw 0204_WU_FARMM_CMH_9030-1-SA.raw 0204_WUG_FARMM_FFA-9030-1-SA.raw SUBJECT_SAMPLE_FACTORS 9030 9030-1-SB Age:46 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=27.7; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0205_WUG_FARMM_HIL-9030-1-SB.raw 0205_WUG_FARMM_LIP-9030-1-SB.raw 0205_WU_FARMM_CMH_9030-1-SB.raw 0205_WUG_FARMM_FFA-9030-1-SB.raw SUBJECT_SAMPLE_FACTORS 9030 9030-1-SC Age:46 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=27.7; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0206_WUG_FARMM_HIL-9030-1-SC.raw 0206_WUG_FARMM_LIP-9030-1-SC.raw 0206_WU_FARMM_CMH_9030-1-SC.raw 0206_WUG_FARMM_FFA-9030-1-SC.raw SUBJECT_SAMPLE_FACTORS 9030 9030-1-SD Age:46 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=27.7; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0202_WUG_FARMM_HIL-9030-1-SD.raw 0202_WUG_FARMM_LIP-9030-1-SD.raw 0202_WU_FARMM_CMH_9030-1-SD.raw 0202_WUG_FARMM_FFA-9030-1-SD.raw SUBJECT_SAMPLE_FACTORS 9030 9030-1-SE Age:46 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=27.7; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0203_WUG_FARMM_HIL-9030-1-SE.raw 0203_WUG_FARMM_LIP-9030-1-SE.raw 0203_WU_FARMM_CMH_9030-1-SE.raw 0203_WUG_FARMM_FFA-9030-1-SE.raw SUBJECT_SAMPLE_FACTORS 9031 9031-3-SA Age:32 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=22.8; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0170_WUG_FARMM_HIL-9031-3-SA.raw 0221b_0170ri_WUG_FARMM_LIP-9031-3-SA.raw 0170_WU_FARMM_CMH_9031-3-SA.raw 0170_WUG_FARMM_FFA-9031-3-SA.raw SUBJECT_SAMPLE_FACTORS 9031 9031-3-SB Age:32 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=22.8; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0169_WUG_FARMM_HIL-9031-3-SB.raw 0169_WUG_FARMM_LIP-9031-3-SB.raw 0169_WU_FARMM_CMH_9031-3-SB.raw 0169_WUG_FARMM_FFA-9031-3-SB.raw SUBJECT_SAMPLE_FACTORS 9031 9031-3-SC Age:32 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=22.8; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0171_WUG_FARMM_HIL-9031-3-SC.raw 0171_WUG_FARMM_LIP-9031-3-SC.raw 0171_WU_FARMM_CMH_9031-3-SC.raw 0171_WUG_FARMM_FFA-9031-3-SC.raw SUBJECT_SAMPLE_FACTORS 9031 9031-3-SD Age:32 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=22.8; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0167_WUG_FARMM_HIL-9031-3-SD.raw 0167_WUG_FARMM_LIP-9031-3-SD.raw 0167_WU_FARMM_CMH_9031-3-SD.raw 0167_WUG_FARMM_FFA-9031-3-SD.raw SUBJECT_SAMPLE_FACTORS 9031 9031-3-SE Age:32 | Sex:Female | Race:White | Study_Diet:Vegan Type=Stool; BMI=22.8; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0168_WUG_FARMM_HIL-9031-3-SE.raw 0168_WUG_FARMM_LIP-9031-3-SE.raw 0168_WU_FARMM_CMH_9031-3-SE.raw 0168_WUG_FARMM_FFA-9031-3-SE.raw SUBJECT_SAMPLE_FACTORS 9032 9032-2-SA Age:53 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=31; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0262_WUG_FARMM_HIL-9032-2-SA.raw 0262_WUG_FARMM_LIP-9032-2-SA.raw 0262_WU_FARMM_CMH_9032-2-SA.raw 0262_WUG_FARMM_FFA-9032-2-SA.raw SUBJECT_SAMPLE_FACTORS 9032 9032-2-SB Age:53 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=31; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0265_WUG_FARMM_HIL-9032-2-SB.raw 0302d_0265ri_WUG_FARMM_LIP-9032-2-SB.raw 0265_WU_FARMM_CMH_9032-2-SB.raw 0265_WUG_FARMM_FFA-9032-2-SB.raw SUBJECT_SAMPLE_FACTORS 9032 9032-2-SC Age:53 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=31; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0263_WUG_FARMM_HIL-9032-2-SC_160922155707.raw 0302c_0263ri_WUG_FARMM_LIP-9032-2-SC.raw 0263_WU_FARMM_CMH_9032-2-SC.raw 0263_WUG_FARMM_FFA-9032-2-SC.raw SUBJECT_SAMPLE_FACTORS 9032 9032-2-SD Age:53 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=31; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0264_WUG_FARMM_HIL-9032-2-SD.raw 0264_WUG_FARMM_LIP-9032-2-SD.raw 0264_WU_FARMM_CMH_9032-2-SD.raw 0264_WUG_FARMM_FFA-9032-2-SD.raw SUBJECT_SAMPLE_FACTORS 9032 9032-2-SE Age:53 | Sex:Male | Race:White | Study_Diet:Modulen Type=Stool; BMI=31; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0266_WUG_FARMM_HIL-9032-2-SE.raw 0266_WUG_FARMM_LIP-9032-2-SE.raw 0266_WU_FARMM_CMH_9032-2-SE.raw 0266_WUG_FARMM_FFA-9032-2-SE.raw SUBJECT_SAMPLE_FACTORS 9033 9033-1-SA Age:57 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=27.1; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0184_WUG_FARMM_HIL-9033-1-SA.raw 0184_WUG_FARMM_LIP-9033-1-SA.raw 0184_WU_FARMM_CMH_9033-1-SA.raw 0184_WUG_FARMM_FFA-9033-1-SA.raw SUBJECT_SAMPLE_FACTORS 9033 9033-1-SB Age:57 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=27.1; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0182_WUG_FARMM_HIL-9033-1-SB.raw 0182_WUG_FARMM_LIP-9033-1-SB.raw 0182_WU_FARMM_CMH_9033-1-SB.raw 0182_WUG_FARMM_FFA-9033-1-SB.raw SUBJECT_SAMPLE_FACTORS 9033 9033-1-SC Age:57 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=27.1; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0185_WUG_FARMM_HIL-9033-1-SC.raw 0185_WUG_FARMM_LIP-9033-1-SC.raw 0185_WU_FARMM_CMH_9033-1-SC.raw 0185_WUG_FARMM_FFA-9033-1-SC.raw SUBJECT_SAMPLE_FACTORS 9033 9033-1-SD Age:57 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=27.1; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0186_WUG_FARMM_HIL-9033-1-SD.raw 0186_WUG_FARMM_LIP-9033-1-SD.raw 0186_WU_FARMM_CMH_9033-1-SD.raw 0186_WUG_FARMM_FFA-9033-1-SD.raw SUBJECT_SAMPLE_FACTORS 9033 9033-1-SE Age:57 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=27.1; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0183_WUG_FARMM_HIL-9033-1-SE.raw 0302c_0183re_WUG_FARMM_LIP-9033-1-SE.raw 0183_WU_FARMM_CMH_9033-1-SE.raw 0183_WUG_FARMM_FFA-9033-1-SE.raw SUBJECT_SAMPLE_FACTORS 9034 9034-2-SA Age:43 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=25.3; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0175_WUG_FARMM_HIL-9034-2-SA.raw 0175_WUG_FARMM_LIP-9034-2-SA.raw 0175_WU_FARMM_CMH_9034-2-SA.raw 0175_WUG_FARMM_FFA-9034-2-SA.raw SUBJECT_SAMPLE_FACTORS 9034 9034-2-SB Age:43 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=25.3; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0174_WUG_FARMM_HIL-9034-2-SB.raw 0174_WUG_FARMM_LIP-9034-2-SB.raw 0174_WU_FARMM_CMH_9034-2-SB.raw 0174_WUG_FARMM_FFA-9034-2-SB.raw SUBJECT_SAMPLE_FACTORS 9034 9034-2-SC Age:43 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=25.3; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0176_WUG_FARMM_HIL-9034-2-SC.raw 0176_WUG_FARMM_LIP-9034-2-SC.raw 0176_WU_FARMM_CMH_9034-2-SC.raw 0176_WUG_FARMM_FFA-9034-2-SC.raw SUBJECT_SAMPLE_FACTORS 9034 9034-2-SD Age:43 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=25.3; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0172_WUG_FARMM_HIL-9034-2-SD.raw 0172_WUG_FARMM_LIP-9034-2-SD.raw 0172_WU_FARMM_CMH_9034-2-SD.raw 0172_WUG_FARMM_FFA-9034-2-SD.raw SUBJECT_SAMPLE_FACTORS 9034 9034-2-SE Age:43 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=25.3; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0173_WUG_FARMM_HIL-9034-2-SE.raw 0173_WUG_FARMM_LIP-9034-2-SE.raw 0173_WU_FARMM_CMH_9034-2-SE.raw 0173_WUG_FARMM_FFA-9034-2-SE.raw SUBJECT_SAMPLE_FACTORS 9035 9035-3-SA Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=19.7; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0290_WUG_FARMM_HIL-9035-3-SA.raw 0290_WUG_FARMM_LIP-9035-3-SA.raw 0290_WU_FARMM_CMH_9035-3-SA.raw 0290_WUG_FARMM_FFA-9035-3-SA.raw SUBJECT_SAMPLE_FACTORS 9035 9035-3-SB Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=19.7; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0289_WUG_FARMM_HIL-9035-3-SB.raw 0289_WUG_FARMM_LIP-9035-3-SB.raw 0289_WU_FARMM_CMH_9035-3-SB.raw 0289_WUG_FARMM_FFA-9035-3-SB.raw SUBJECT_SAMPLE_FACTORS 9035 9035-3-SC Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=19.7; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0288_WUG_FARMM_HIL-9035-3-SC.raw 0288_WUG_FARMM_LIP-9035-3-SC.raw 0288_WU_FARMM_CMH_9035-3-SC.raw 0288_WUG_FARMM_FFA-9035-3-SC.raw SUBJECT_SAMPLE_FACTORS 9035 9035-3-SD Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=19.7; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0287_WUG_FARMM_HIL-9035-3-SD.raw 0287_WUG_FARMM_LIP-9035-3-SD.raw 0287_WU_FARMM_CMH_9035-3-SD.raw 0287_WUG_FARMM_FFA-9035-3-SD.raw SUBJECT_SAMPLE_FACTORS 9035 9035-3-SE Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Type=Stool; BMI=19.7; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0291_WUG_FARMM_HIL-9035-3-SE.raw 0291_WUG_FARMM_LIP-9035-3-SE.raw 0291_WU_FARMM_CMH_9035-3-SE.raw 0291_WUG_FARMM_FFA-9035-3-SE.raw SUBJECT_SAMPLE_FACTORS 9036 9036-1-SA Age:60 | Sex:Male | Race:American Indian/Alaskan Native; White | Study_Diet:Western Type=Stool; BMI=23.9; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0232_WUG_FARMM_HIL-9036-1-SA.raw 0232_WUG_FARMM_LIP-9036-1-SA.raw 0232_WU_FARMM_CMH_9036-1-SA.raw 0232_WUG_FARMM_FFA-9036-1-SA.raw SUBJECT_SAMPLE_FACTORS 9036 9036-1-SB Age:60 | Sex:Male | Race:American Indian/Alaskan Native; White | Study_Diet:Western Type=Stool; BMI=23.9; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0234_WUG_FARMM_HIL-9036-1-SB.raw 0234_WUG_FARMM_LIP-9036-1-SB.raw 0234_WU_FARMM_CMH_9036-1-SB.raw 0234_WUG_FARMM_FFA-9036-1-SB.raw SUBJECT_SAMPLE_FACTORS 9036 9036-1-SC Age:60 | Sex:Male | Race:American Indian/Alaskan Native; White | Study_Diet:Western Type=Stool; BMI=23.9; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0235_WUG_FARMM_HIL-9036-1-SC.raw 0235_WUG_FARMM_LIP-9036-1-SC.raw 0235_WU_FARMM_CMH_9036-1-SC.raw 0235_WUG_FARMM_FFA-9036-1-SC.raw SUBJECT_SAMPLE_FACTORS 9036 9036-1-SD Age:60 | Sex:Male | Race:American Indian/Alaskan Native; White | Study_Diet:Western Type=Stool; BMI=23.9; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0236_WUG_FARMM_HIL-9036-1-SD.raw 0236_WUG_FARMM_LIP-9036-1-SD.raw 0236_WU_FARMM_CMH_9036-1-SD.raw 0236_WUG_FARMM_FFA-9036-1-SD.raw SUBJECT_SAMPLE_FACTORS 9036 9036-1-SE Age:60 | Sex:Male | Race:American Indian/Alaskan Native; White | Study_Diet:Western Type=Stool; BMI=23.9; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0233_WUG_FARMM_HIL-9036-1-SE.raw 0233_WUG_FARMM_LIP-9036-1-SE.raw 0233_WU_FARMM_CMH_9036-1-SE.raw 0233_WUG_FARMM_FFA-9036-1-SE.raw SUBJECT_SAMPLE_FACTORS 9037 9037-1-SA Age:29 | Sex:Male | Race:Black/African American; White | Study_Diet:Western Type=Stool; BMI=23; Ethnicity=Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0274_WUG_FARMM_HIL-9037-1-SA.raw 0274_WUG_FARMM_LIP-9037-1-SA.raw 0274_WU_FARMM_CMH_9037-1-SA.raw 0274_WUG_FARMM_FFA-9037-1-SA.raw SUBJECT_SAMPLE_FACTORS 9037 9037-1-SB Age:29 | Sex:Male | Race:Black/African American; White | Study_Diet:Western Type=Stool; BMI=23; Ethnicity=Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0276_WUG_FARMM_HIL-9037-1-SB.raw 0276_WUG_FARMM_LIP-9037-1-SB.raw 0276_WU_FARMM_CMH_9037-1-SB.raw 0276_WUG_FARMM_FFA-9037-1-SB.raw SUBJECT_SAMPLE_FACTORS 9037 9037-1-SC Age:29 | Sex:Male | Race:Black/African American; White | Study_Diet:Western Type=Stool; BMI=23; Ethnicity=Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0272_WUG_FARMM_HIL-9037-1-SC.raw 0272_WUG_FARMM_LIP-9037-1-SC.raw 0272_WU_FARMM_CMH_9037-1-SC.raw 0272_WUG_FARMM_FFA-9037-1-SC.raw SUBJECT_SAMPLE_FACTORS 9037 9037-1-SD Age:29 | Sex:Male | Race:Black/African American; White | Study_Diet:Western Type=Stool; BMI=23; Ethnicity=Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0273_WUG_FARMM_HIL-9037-1-SD.raw 0273_WUG_FARMM_LIP-9037-1-SD.raw 0273_WU_FARMM_CMH_9037-1-SD.raw 0273_WUG_FARMM_FFA-9037-1-SD.raw SUBJECT_SAMPLE_FACTORS 9037 9037-1-SE Age:29 | Sex:Male | Race:Black/African American; White | Study_Diet:Western Type=Stool; BMI=23; Ethnicity=Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0275_WUG_FARMM_HIL-9037-1-SE.raw 0275_WUG_FARMM_LIP-9037-1-SE.raw 0275_WU_FARMM_CMH_9037-1-SE.raw 0275_WUG_FARMM_FFA-9037-1-SE.raw SUBJECT_SAMPLE_FACTORS 9038 9038-2-SA Age:59 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=34.3; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0237_WUG_FARMM_HIL-9038-2-SA.raw 0237_WUG_FARMM_LIP-9038-2-SA.raw 0237_WU_FARMM_CMH_9038-2-SA.raw 0237_WUG_FARMM_FFA-9038-2-SA.raw SUBJECT_SAMPLE_FACTORS 9038 9038-2-SB Age:59 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=34.3; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0241_WUG_FARMM_HIL-9038-2-SB.raw 0241_WUG_FARMM_LIP-9038-2-SB.raw 0241_WU_FARMM_CMH_9038-2-SB.raw 0241_WUG_FARMM_FFA-9038-2-SB.raw SUBJECT_SAMPLE_FACTORS 9038 9038-2-SC Age:59 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=34.3; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0239_WUG_FARMM_HIL-9038-2-SC.raw 0239_WUG_FARMM_LIP-9038-2-SC.raw 0239_WU_FARMM_CMH_9038-2-SC.raw 0239_WUG_FARMM_FFA-9038-2-SC.raw SUBJECT_SAMPLE_FACTORS 9038 9038-2-SD Age:59 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=34.3; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0240_WUG_FARMM_HIL-9038-2-SD.raw 0240_WUG_FARMM_LIP-9038-2-SD.raw 0240_WU_FARMM_CMH_9038-2-SD.raw 0240_WUG_FARMM_FFA-9038-2-SD.raw SUBJECT_SAMPLE_FACTORS 9038 9038-2-SE Age:59 | Sex:Female | Race:White | Study_Diet:Modulen Type=Stool; BMI=34.3; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0238_WUG_FARMM_HIL-9038-2-SE.raw 0238_WUG_FARMM_LIP-9038-2-SE.raw 0238_WU_FARMM_CMH_9038-2-SE.raw 0238_WUG_FARMM_FFA-9038-2-SE.raw SUBJECT_SAMPLE_FACTORS 9040 9040-1-SA Age:22 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=23.7; Ethnicity=Not Hispanic or Latino; Time=Day 15; RAW_FILE_NAME=0271_WUG_FARMM_HIL-9040-1-SA.raw 0271_WUG_FARMM_LIP-9040-1-SA.raw 0271_WU_FARMM_CMH_9040-1-SA.raw 0271_WUG_FARMM_FFA-9040-1-SA.raw SUBJECT_SAMPLE_FACTORS 9040 9040-1-SB Age:22 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=23.7; Ethnicity=Not Hispanic or Latino; Time=Day 12; RAW_FILE_NAME=0267_WUG_FARMM_HIL-9040-1-SB.raw 0267_WUG_FARMM_LIP-9040-1-SB.raw 0267_WU_FARMM_CMH_9040-1-SB.raw 0267_WUG_FARMM_FFA-9040-1-SB.raw SUBJECT_SAMPLE_FACTORS 9040 9040-1-SC Age:22 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=23.7; Ethnicity=Not Hispanic or Latino; Time=Day 9; RAW_FILE_NAME=0270_WUG_FARMM_HIL-9040-1-SC.raw 0270_WUG_FARMM_LIP-9040-1-SC.raw 0270_WU_FARMM_CMH_9040-1-SC.raw 0270_WUG_FARMM_FFA-9040-1-SC.raw SUBJECT_SAMPLE_FACTORS 9040 9040-1-SD Age:22 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=23.7; Ethnicity=Not Hispanic or Latino; Time=Day 5; RAW_FILE_NAME=0268_WUG_FARMM_HIL-9040-1-SD.raw 0268_WUG_FARMM_LIP-9040-1-SD.raw 0268_WU_FARMM_CMH_9040-1-SD.raw 0268_WUG_FARMM_FFA-9040-1-SD.raw SUBJECT_SAMPLE_FACTORS 9040 9040-1-SE Age:22 | Sex:Male | Race:White | Study_Diet:Western Type=Stool; BMI=23.7; Ethnicity=Not Hispanic or Latino; Time=Baseline; RAW_FILE_NAME=0269_WUG_FARMM_HIL-9040-1-SE.raw 0302i_0269re_WUG_FARMM_LIP-9040-1-SE.raw 0269_WU_FARMM_CMH_9040-1-SE.raw 0269_WUG_FARMM_FFA-9040-1-SE.raw SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS02 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;0171a_WUG_FARMM_LIP-QCPS02.raw NA;0171a_WUG_FARMM_FFA-QCPS02.raw SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS03 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;0191a_WUG_FARMM_LIP-QCPS03.raw NA;0191a_WUG_FARMM_FFA-QCPS03.raw SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS04 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;0211a_WUG_FARMM_LIP-QCPS04.raw NA;0211a_WUG_FARMM_FFA-QCPS04.raw SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS05 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;0231a_WUG_FARMM_LIP-QCPS05.raw NA;0231a_WUG_FARMM_FFA-QCPS05.raw SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS06 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;0251a_WUG_FARMM_LIP-QCPS06.raw NA;0251a_WUG_FARMM_FFA-QCPS06.raw SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS07 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;0271a_WUG_FARMM_LIP-QCPS07.raw NA;0271a_WUG_FARMM_FFA-QCPS07.raw SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS08 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;0302a_WUG_FARMM_LIP-QCPS08.raw NA;0302a_WUG_FARMM_FFA-QCPS08.raw SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS09 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;0302k_0302are_WUG_FARMM_LIP-QCPS09.raw NA;NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS10 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;NA;NA;NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS11 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=0160a_WUG_FARMM_HIL-QPS11.raw NA;0150g_WU_FARMM_CMH_QPP-11.raw NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS12 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=0180a_WUG_FARMM_HIL-QPS12.raw NA;0171a_WU_FARMM_CMH_QPP-12.raw NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS13 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=0200a_WUG_FARMM_HIL-QPS13.raw NA;0191a_WU_FARMM_CMH_QPP-13.raw NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS14 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=0220a_WUG_FARMM_HIL-QPS14.raw NA;0211a_WU_FARMM_CMH_QPP-14.raw NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS15 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=0240a_WUG_FARMM_HIL-QPS15.raw NA;0231a_WU_FARMM_CMH_QPP-15.raw NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS16 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=0260a_WUG_FARMM_HIL-QPS16.raw NA;0231d_WU_FARMM_CMH_QPP-16.raw NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS17 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=0280a_WUG_FARMM_HIL-QPS17.raw NA;0251a_WU_FARMM_CMH_QPP-17.raw NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS18 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=0302a_WUG_FARMM_HIL-QPS18.raw NA;0271a_WU_FARMM_CMH_QPP-18.raw NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS19 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;NA;0291a_WU_FARMM_CMH_QPP-19.raw NA SUBJECT_SAMPLE_FACTORS QC-pooled_stool QCPS20 Age:NA | Sex:NA | Race:NA | Study_Diet:NA Type=NA; BMI=NA; Ethnicity=NA; Time=NA; RAW_FILE_NAME=NA;NA;0302a_WU_FARMM_CMH_QPP-20.raw NA #COLLECTION CO:COLLECTION_SUMMARY The first stool sample of each day of the inpatient groups was collected, CO:COLLECTION_SUMMARY aliquoted and frozen immediately at -80oC. Blood was collected on days 1, 5, 9, CO:COLLECTION_SUMMARY 12 and 15 from which plasma aliquots were immediately isolated and frozen at CO:COLLECTION_SUMMARY -80oC. The outpatient participants following the vegan diet also had blood CO:COLLECTION_SUMMARY collected on days 1, 5, 9, 12, and 15 from which plasma aliquots were CO:COLLECTION_SUMMARY immediately isolated and frozen at -80oC. Among these participants, the first CO:COLLECTION_SUMMARY stool of the day was collected at home daily and kept on ice packs until it was CO:COLLECTION_SUMMARY brought to the research unit where it could be aliquoted and frozen. Samples CO:COLLECTION_SUMMARY from vegans were received for aliquoting within 24 hours and on average within 4 CO:COLLECTION_SUMMARY hours (Wu et al., 2010). Day 0 stool was not collected from vegans since their CO:COLLECTION_SUMMARY diet did not change. The aliquoted amounts for all samples ranged from 500 mg to CO:COLLECTION_SUMMARY 1 g. The aliquots were taken from different areas of the sample. Remaining CO:COLLECTION_SUMMARY sample was then collected into one residual 50 ml conical tube with a tongue CO:COLLECTION_SUMMARY depressor. Any remaining stool was discarded. The University of Pennsylvania CO:COLLECTION_SUMMARY Institutional Review Board (IRB) approved the research protocol. CO:SAMPLE_TYPE Feces CO:STORAGE_CONDITIONS -80℃ #TREATMENT TR:TREATMENT_SUMMARY The 10 vegan participants continued to follow their usual diet as outpatients. TR:TREATMENT_SUMMARY All participants completed the Diet History Questionnaire II (DHQ II), a food TR:TREATMENT_SUMMARY frequency questionnaire developed by the Risk Factor Monitoring and Methods TR:TREATMENT_SUMMARY Branch of the National Cancer Institute. The vegan participants also completed TR:TREATMENT_SUMMARY three 24 hour diet recalls with a dietitian in the week prior to starting TR:TREATMENT_SUMMARY antibiotics. 20 omnivores were randomly assigned to receive an omnivore diet or TR:TREATMENT_SUMMARY EEN (Modulen® IBD) while residing in an inpatient research unit. The TR:TREATMENT_SUMMARY macronutrient composition of Modulen® is protein 36g, fat 47g, and carbohydrate TR:TREATMENT_SUMMARY 110g per 1000 Kcal. The two omnivore diets were engineered to have a similar TR:TREATMENT_SUMMARY composition to EEN. All the subjects consumed the menu A on day 11 and menu B on TR:TREATMENT_SUMMARY days 4 and 14. Diets for omnivores were constructed to provide the expected TR:TREATMENT_SUMMARY total calories required per day for the participant to maintain their current TR:TREATMENT_SUMMARY weight and were adjusted if there was weight gain or loss of more than 2.5 TR:TREATMENT_SUMMARY pounds. On days 6, 7, and 8, inpatients participants received vancomycin 500mg TR:TREATMENT_SUMMARY orally every 6 hours and neomycin 1000mg orally every 6 hours. On day 7, TR:TREATMENT_SUMMARY participants consumed 4L of polyethylene glycol (PEG) based bowel purgative TR:TREATMENT_SUMMARY (GoLytely®). Participants in the omnivore and EEN arms left the inpatient TR:TREATMENT_SUMMARY research unit only under the direct supervision of a research staff member. The TR:TREATMENT_SUMMARY vegan outpatients reported to the hospital twice on days 6,7 and 8 to receive TR:TREATMENT_SUMMARY antibiotics and to consume PEG on day 7. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Stool samples (weight range 42.99-90.35 mg) were homogenized in 4 μL of water SP:SAMPLEPREP_SUMMARY per milligram stool sample weight using a bead mill (TissueLyser II; Qiagen) and SP:SAMPLEPREP_SUMMARY the aqueous homogenates were aliquoted for metabolite profiling analyses. Plasma SP:SAMPLEPREP_SUMMARY samples were thawed and aliquoted for each LC-MS method. LC-MS samples were SP:SAMPLEPREP_SUMMARY prepared for four profiling methods as follows: HILIC-pos: Metabolites were SP:SAMPLEPREP_SUMMARY extracted by adding 90 μL of 74.9:24.9:0.2 v/v/v acetonitrile/methanol/formic SP:SAMPLEPREP_SUMMARY acid containing stable isotope-labeled internal standards (valine-d8, Isotec; SP:SAMPLEPREP_SUMMARY and phenylalanine-d8, Cambridge Isotope Laboratories; Andover, MA) to a 10 μL SP:SAMPLEPREP_SUMMARY aliquot of stool homogenate or plasma. Samples were vortexed and then SP:SAMPLEPREP_SUMMARY centrifuged (10 min, 9,000 x g, 4°C) to pellet protein precipitates. SP:SAMPLEPREP_SUMMARY Supernatants were transferred to glass autosampler vials containing inserts for SP:SAMPLEPREP_SUMMARY LC-MS analysis. C8-pos: Lipids were extracted by adding 190 μL of isopropanol SP:SAMPLEPREP_SUMMARY containing 1-dodecanoyl-2-tridecanoyl-sn-glycero-3-phosphocholine as an internal SP:SAMPLEPREP_SUMMARY standard (Avanti Polar Lipids; Alabaster, AL) to a 10 μL aliquot of stool SP:SAMPLEPREP_SUMMARY homogenate or plasma. Samples were vortexed and then centrifuged (10 min, 9,000 SP:SAMPLEPREP_SUMMARY x g, ambient temperature) to pellet protein precipitates. Supernatants were SP:SAMPLEPREP_SUMMARY transferred to glass autosampler vials containing inserts for LC-MS analysis. SP:SAMPLEPREP_SUMMARY HILIC-neg: Metabolites were extracted by adding 120 μL of 80% methanol SP:SAMPLEPREP_SUMMARY containing inosine-15N4, thymine-d4 and glycocholate-d4 internal standards SP:SAMPLEPREP_SUMMARY (Cambridge Isotope Laboratories; Andover, MA) to a 30 μL aliquot of stool SP:SAMPLEPREP_SUMMARY homogenate or plasma. Samples were vortexed and then centrifuged (10 min, 9,000 SP:SAMPLEPREP_SUMMARY x g, 4°C) to pellet protein precipitates. Supernatants were transferred to SP:SAMPLEPREP_SUMMARY glass autosampler vials containing inserts for LC-MS analysis. C18-neg: SP:SAMPLEPREP_SUMMARY Metabolites were extracted by adding 90 μL of methanol containing PGE2-d4 as an SP:SAMPLEPREP_SUMMARY internal standard (Cayman Chemical Co.; Ann Arbor, MI) to a 30 μL aliquot of SP:SAMPLEPREP_SUMMARY stool homogenate or plasma. Samples were vortexed and then centrifuged (10 min, SP:SAMPLEPREP_SUMMARY 9,000 x g, 4°C) to pellet protein precipitates. Supernatants were transferred SP:SAMPLEPREP_SUMMARY to glass autosampler vials containing inserts for LC-MS analysis. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY HILIC-pos: high resolution and accurate mass profiling of polar metabolites CH:CHROMATOGRAPHY_SUMMARY using HILIC and positive ion mode full scan MS CH:CHROMATOGRAPHY_TYPE HILIC CH:INSTRUMENT_NAME Shimadzu Nexera X2 CH:COLUMN_NAME Waters Atlantis HILIC (150 x 2 mm, 3 µm) CH:FLOW_GRADIENT linear CH:FLOW_RATE 250 uL/min CH:COLUMN_TEMPERATURE 30 ℃ CH:SOLVENT_A 10 mM Ammonium formate/0.1% Formic acid in water CH:SOLVENT_B 0.1% Formic acid in Acetonitrile CH:INJECTION_TEMPERATURE 4 #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Exactive Plus Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS MS analyses were carried out using electrospray ionization in the positive ion MS:MS_COMMENTS mode using full scan analysis over m/z 70-800 at 70,000 resolution and 3 Hz data MS:MS_COMMENTS acquisition rate. Additional MS settings were: ion spray voltage, 3.5 kV; MS:MS_COMMENTS capillary temperature, 350°C; probe heater temperature, 300°C; sheath gas, 40; MS:MS_COMMENTS auxiliary gas, 15; and S-lens RF level 40. All raw data were processed using MS:MS_COMMENTS Progenesis QI software (NonLinear Dynamics) for feature alignment, nontargeted MS:MS_COMMENTS signal detection, and signal integration. Targeted processing of a subset of MS:MS_COMMENTS known metabolites was conducted using TraceFinder software (Thermo Fisher MS:MS_COMMENTS Scientific; Waltham, MA). Compound identities were confirmed using reference MS:MS_COMMENTS standards #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS unitless peak areas MS_METABOLITE_DATA_START Samples 9022-3-SE 9022-3-SD 9022-3-SB 9022-3-SC 9022-3-SA 9014-3-SC 9014-3-SE 9014-3-SB 9014-3-SD QCPS11 9014-3-SA 9024-2-SE 9024-2-SA 9024-2-SB 9024-2-SD 9031-3-SD 9031-3-SE 9031-3-SB 9031-3-SA 9031-3-SC 9034-2-SD 9034-2-SE 9034-2-SB 9034-2-SA 9034-2-SC 9027-3-SD 9027-3-SE 9027-3-SB 9027-3-SC QCPS12 9033-1-SB 9033-1-SE 9033-1-SA 9033-1-SC 9033-1-SD 9026-3-SD 9026-3-SE 9026-3-SC 9026-3-SA 9026-3-SB 9025-2-SA 9025-2-SE 9025-2-SC 9025-2-SD 9025-2-SB 9006-1-SD 9006-1-SA 9006-1-SB 9006-1-SE QCPS13 9006-1-SC 9030-1-SD 9030-1-SE 9030-1-SA 9030-1-SB 9030-1-SC 9017-3-SB 9017-3-SA 9017-3-SC 9017-3-SE 9017-3-SD 9019-1-SA 9019-1-SD 9019-1-SB 9019-1-SC 9019-1-SE 9016-2-SB 9016-2-SA 9016-2-SD 9016-2-SE QCPS14 9016-2-SC 9013-2-SD 9013-2-SC 9013-2-SE 9013-2-SB 9013-2-SA 9002-3-SB 9002-3-SE 9002-3-SA 9002-3-SC 9002-3-SD 9036-1-SA 9036-1-SE 9036-1-SB 9036-1-SC 9036-1-SD 9038-2-SA 9038-2-SE 9038-2-SC 9038-2-SD QCPS15 9038-2-SB 9004-3-SA 9004-3-SB 9004-3-SD 9004-3-SE 9004-3-SC 9015-1-SB 9015-1-SA 9015-1-SE 9015-1-SD 9015-1-SC 9008-3-SC 9008-3-SE 9008-3-SA 9008-3-SD 9008-3-SB 9005-1-SB 9005-1-SD 9005-1-SC 9005-1-SA QCPS16 9005-1-SE 9032-2-SA 9032-2-SC 9032-2-SD 9032-2-SB 9032-2-SE 9040-1-SB 9040-1-SD 9040-1-SE 9040-1-SC 9040-1-SA 9037-1-SC 9037-1-SD 9037-1-SA 9037-1-SE 9037-1-SB 9029-2-SB 9029-2-SD 9029-2-SA 9029-2-SE QCPS17 9029-2-SC 9009-2-SA 9009-2-SB 9009-2-SC 9009-2-SD 9009-2-SE 9035-3-SD 9035-3-SC 9035-3-SB 9035-3-SA 9035-3-SE 9003-2-SB 9003-2-SC 9003-2-SA 9003-2-SE 9010-1-SD 9010-1-SC 9010-1-SB 9010-1-SA 9010-1-SE QCPS18 Factors Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:23 | Sex:Female | Race:White | Study_Diet:Vegan Age:23 | Sex:Female | Race:White | Study_Diet:Vegan Age:23 | Sex:Female | Race:White | Study_Diet:Vegan Age:23 | Sex:Female | Race:White | Study_Diet:Vegan Age:NA | Sex:NA | Race:NA | Study_Diet:NA Age:23 | Sex:Female | Race:White | Study_Diet:Vegan Age:27 | Sex:Female | Race:Black/African American | Study_Diet:Modulen Age:27 | Sex:Female | Race:Black/African American | Study_Diet:Modulen Age:27 | Sex:Female | Race:Black/African American | Study_Diet:Modulen Age:27 | Sex:Female | Race:Black/African American | Study_Diet:Modulen Age:32 | Sex:Female | Race:White | Study_Diet:Vegan Age:32 | Sex:Female | Race:White | Study_Diet:Vegan Age:32 | Sex:Female | Race:White | Study_Diet:Vegan Age:32 | Sex:Female | Race:White | Study_Diet:Vegan Age:32 | Sex:Female | Race:White | Study_Diet:Vegan Age:43 | Sex:Female | Race:White | Study_Diet:Modulen Age:43 | Sex:Female | Race:White | Study_Diet:Modulen Age:43 | Sex:Female | Race:White | Study_Diet:Modulen Age:43 | Sex:Female | Race:White | Study_Diet:Modulen Age:43 | Sex:Female | Race:White | Study_Diet:Modulen Age:22 | Sex:Female | Race:White | Study_Diet:Vegan Age:22 | Sex:Female | Race:White | Study_Diet:Vegan Age:22 | Sex:Female | Race:White | Study_Diet:Vegan Age:22 | Sex:Female | Race:White | Study_Diet:Vegan Age:NA | Sex:NA | Race:NA | Study_Diet:NA Age:57 | Sex:Male | Race:White | Study_Diet:Western Age:57 | Sex:Male | Race:White | Study_Diet:Western Age:57 | Sex:Male | Race:White | Study_Diet:Western Age:57 | Sex:Male | Race:White | Study_Diet:Western Age:57 | Sex:Male | Race:White | Study_Diet:Western Age:24 | Sex:Female | Race:Black/African American | Study_Diet:Vegan Age:24 | Sex:Female | Race:Black/African American | Study_Diet:Vegan Age:24 | Sex:Female | Race:Black/African American | Study_Diet:Vegan Age:24 | Sex:Female | Race:Black/African American | Study_Diet:Vegan Age:24 | Sex:Female | Race:Black/African American | Study_Diet:Vegan Age:28 | Sex:Male | Race:Black/African American | Study_Diet:Modulen Age:28 | Sex:Male | Race:Black/African American | Study_Diet:Modulen Age:28 | Sex:Male | Race:Black/African American | Study_Diet:Modulen Age:28 | Sex:Male | Race:Black/African American | Study_Diet:Modulen Age:28 | Sex:Male | Race:Black/African American | Study_Diet:Modulen Age:24 | Sex:Male | Race:White | Study_Diet:Western Age:24 | Sex:Male | Race:White | Study_Diet:Western Age:24 | Sex:Male | Race:White | Study_Diet:Western Age:24 | Sex:Male | Race:White | Study_Diet:Western Age:NA | Sex:NA | Race:NA | Study_Diet:NA Age:24 | Sex:Male | Race:White | Study_Diet:Western Age:46 | Sex:Male | Race:White | Study_Diet:Western Age:46 | Sex:Male | Race:White | Study_Diet:Western Age:46 | Sex:Male | Race:White | Study_Diet:Western Age:46 | Sex:Male | Race:White | Study_Diet:Western Age:46 | Sex:Male | Race:White | Study_Diet:Western Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:36 | Sex:Male | Race:Black/African American | Study_Diet:Western Age:36 | Sex:Male | Race:Black/African American | Study_Diet:Western Age:36 | Sex:Male | Race:Black/African American | Study_Diet:Western Age:36 | Sex:Male | Race:Black/African American | Study_Diet:Western Age:36 | Sex:Male | Race:Black/African American | Study_Diet:Western Age:38 | Sex:Female | Race:White | Study_Diet:Modulen Age:38 | Sex:Female | Race:White | Study_Diet:Modulen Age:38 | Sex:Female | Race:White | Study_Diet:Modulen Age:38 | Sex:Female | Race:White | Study_Diet:Modulen Age:NA | Sex:NA | Race:NA | Study_Diet:NA Age:38 | Sex:Female | Race:White | Study_Diet:Modulen Age:40 | Sex:Male | Race:White | Study_Diet:Modulen Age:40 | Sex:Male | Race:White | Study_Diet:Modulen Age:40 | Sex:Male | Race:White | Study_Diet:Modulen Age:40 | Sex:Male | Race:White | Study_Diet:Modulen Age:40 | Sex:Male | Race:White | Study_Diet:Modulen Age:20 | Sex:Male | Race:White | Study_Diet:Vegan Age:20 | Sex:Male | Race:White | Study_Diet:Vegan Age:20 | Sex:Male | Race:White | Study_Diet:Vegan Age:20 | Sex:Male | Race:White | Study_Diet:Vegan Age:20 | Sex:Male | Race:White | Study_Diet:Vegan Age:60 | Sex:Male | Race:American Indian/Alaskan Native; White | Study_Diet:Western Age:60 | Sex:Male | Race:American Indian/Alaskan Native; White | Study_Diet:Western Age:60 | Sex:Male | Race:American Indian/Alaskan Native; White | Study_Diet:Western Age:60 | Sex:Male | Race:American Indian/Alaskan Native; White | Study_Diet:Western Age:60 | Sex:Male | Race:American Indian/Alaskan Native; White | Study_Diet:Western Age:59 | Sex:Female | Race:White | Study_Diet:Modulen Age:59 | Sex:Female | Race:White | Study_Diet:Modulen Age:59 | Sex:Female | Race:White | Study_Diet:Modulen Age:59 | Sex:Female | Race:White | Study_Diet:Modulen Age:NA | Sex:NA | Race:NA | Study_Diet:NA Age:59 | Sex:Female | Race:White | Study_Diet:Modulen Age:24 | Sex:Male | Race:White | Study_Diet:Vegan Age:24 | Sex:Male | Race:White | Study_Diet:Vegan Age:24 | Sex:Male | Race:White | Study_Diet:Vegan Age:24 | Sex:Male | Race:White | Study_Diet:Vegan Age:24 | Sex:Male | Race:White | Study_Diet:Vegan Age:23 | Sex:Female | Race:White | Study_Diet:Western Age:23 | Sex:Female | Race:White | Study_Diet:Western Age:23 | Sex:Female | Race:White | Study_Diet:Western Age:23 | Sex:Female | Race:White | Study_Diet:Western Age:23 | Sex:Female | Race:White | Study_Diet:Western Age:23 | Sex:Male | Race:White | Study_Diet:Vegan Age:23 | Sex:Male | Race:White | Study_Diet:Vegan Age:23 | Sex:Male | Race:White | Study_Diet:Vegan Age:23 | Sex:Male | Race:White | Study_Diet:Vegan Age:23 | Sex:Male | Race:White | Study_Diet:Vegan Age:23 | Sex:Male | Race:White | Study_Diet:Western Age:23 | Sex:Male | Race:White | Study_Diet:Western Age:23 | Sex:Male | Race:White | Study_Diet:Western Age:23 | Sex:Male | Race:White | Study_Diet:Western Age:NA | Sex:NA | Race:NA | Study_Diet:NA Age:23 | Sex:Male | Race:White | Study_Diet:Western Age:53 | Sex:Male | Race:White | Study_Diet:Modulen Age:53 | Sex:Male | Race:White | Study_Diet:Modulen Age:53 | Sex:Male | Race:White | Study_Diet:Modulen Age:53 | Sex:Male | Race:White | Study_Diet:Modulen Age:53 | Sex:Male | Race:White | Study_Diet:Modulen Age:22 | Sex:Male | Race:White | Study_Diet:Western Age:22 | Sex:Male | Race:White | Study_Diet:Western Age:22 | Sex:Male | Race:White | Study_Diet:Western Age:22 | Sex:Male | Race:White | Study_Diet:Western Age:22 | Sex:Male | Race:White | Study_Diet:Western Age:29 | Sex:Male | Race:Black/African American; White | Study_Diet:Western Age:29 | Sex:Male | Race:Black/African American; White | Study_Diet:Western Age:29 | Sex:Male | Race:Black/African American; White | Study_Diet:Western Age:29 | Sex:Male | Race:Black/African American; White | Study_Diet:Western Age:29 | Sex:Male | Race:Black/African American; White | Study_Diet:Western Age:26 | Sex:Male | Race:White | Study_Diet:Modulen Age:26 | Sex:Male | Race:White | Study_Diet:Modulen Age:26 | Sex:Male | Race:White | Study_Diet:Modulen Age:26 | Sex:Male | Race:White | Study_Diet:Modulen Age:NA | Sex:NA | Race:NA | Study_Diet:NA Age:26 | Sex:Male | Race:White | Study_Diet:Modulen Age:23 | Sex:Male | Race:White | Study_Diet:Modulen Age:23 | Sex:Male | Race:White | Study_Diet:Modulen Age:23 | Sex:Male | Race:White | Study_Diet:Modulen Age:23 | Sex:Male | Race:White | Study_Diet:Modulen Age:23 | Sex:Male | Race:White | Study_Diet:Modulen Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:25 | Sex:Male | Race:White | Study_Diet:Vegan Age:20 | Sex:Male | Race:White | Study_Diet:Modulen Age:20 | Sex:Male | Race:White | Study_Diet:Modulen Age:20 | Sex:Male | Race:White | Study_Diet:Modulen Age:20 | Sex:Male | Race:White | Study_Diet:Modulen Age:24 | Sex:Female | Race:White | Study_Diet:Western Age:24 | Sex:Female | Race:White | Study_Diet:Western Age:24 | Sex:Female | Race:White | Study_Diet:Western Age:24 | Sex:Female | Race:White | Study_Diet:Western Age:24 | Sex:Female | Race:White | Study_Diet:Western Age:NA | Sex:NA | Race:NA | Study_Diet:NA valine-d8 [iSTD] 354400 348669 366275 370699 308482 471317 308580 294935 325943 355778 396027 376540 425780 428311 421376 398092 373694 405709 382710 436564 396110 387322 466223 453444 430123 409990 356377 379682 442129 378494 385369 384158 437046 392751 405995 344491 345903 430512 385112 367008 357659 379115 415832 302052 414462 401378 411425 431191 379696 377286 454263 413092 388664 291359 366841 395046 362688 412164 434858 364683 357189 393936 384498 368064 450727 344746 420061 400430 369840 334882 363681 419851 389044 410408 383220 433140 415626 406705 350098 362481 489040 429963 437313 406532 431860 452789 414759 468828 460950 488417 465159 389948 453607 354294 386116 410346 431553 511098 403497 425932 427850 346420 382095 360372 320173 327807 343073 336860 385043 361720 402773 362223 371929 362377 395415 446674 341509 376419 389961 381216 424335 418923 484938 469810 444018 417214 402604 386446 403203 437978 432849 401769 449093 380982 429429 292156 396581 414168 373337 343849 355171 403781 336685 376535 325896 440348 429023 388510 353125 365138 402534 383568 356540 393748 360206 phenylalanine-d8 [iSTD] 635393 616868 648259 706116 533088 697422 609607 630645 638553 605169 667936 625146 627550 675221 618021 607841 626716 713095 618284 773108 591736 568179 691027 679028 652885 622926 442842 595850 728203 625243 634050 621887 645746 711329 694249 655251 567618 701984 614548 650054 584933 629048 760147 614025 664718 674826 673693 751620 632191 638118 559825 704634 672176 663379 655436 733898 624451 670331 832676 683452 614822 736178 619685 693833 743838 541368 653038 650831 572018 592005 601937 672259 585487 705401 615175 723824 653970 673817 579168 617794 909607 707361 707356 681999 811098 807270 705408 759621 715799 753698 734181 657335 738638 702996 634420 638896 678682 913211 687532 723084 695257 597396 700023 715439 564274 552720 564617 563258 662882 633126 643967 608198 640806 626245 601088 621269 402427 663216 576891 678160 663441 667772 806722 704376 719874 712588 690768 680325 644611 671321 671534 669827 700579 613444 691816 601459 634761 674928 629362 618164 646743 699731 557744 606626 617009 714506 699271 668811 523647 593269 681194 658522 650275 589745 629490 Glycine 4448 3160 8958 56281 3165 19220 17632 30772 8465 52002 57630 4396 115802 134756 13415 3660 3612 86977 27848 51065 2234 2736 105444 94180 128381 8470 4275 25543 67740 54555 52928 10120 7368 94993 16670 5475 4816 49988 15217 7577 3815 3593 81893 4327 126423 6749 12043 35045 6072 52871 58102 12790 15560 10214 11079 63425 47551 3828 60653 5080 7997 5260 7800 94626 44315 4059 98003 94744 11306 4196 54279 92367 27020 70321 10959 82984 104977 15667 5257 16223 66758 10143 4866 6803 70540 87593 22192 123051 26822 112080 9550 55709 110329 9869 7109 3125 9607 112305 10516 19953 17279 6663 58231 59250 5602 3937 4332 21022 106274 15367 75881 57275 55058 15240 144952 115815 3845 137302 5510 4910 7487 2815 78222 1638 47883 18043 22450 8884 33893 168993 7667 80397 18520 52208 116449 25607 100361 63809 23266 4002 8037 65340 38931 6788 11552 85943 84793 127296 6459 12942 68760 85140 5993 9566 52805 Alanine 90381 63997 101748 257705 51891 67116 279870 175329 145793 318938 62837 34453 522065 543521 253898 47258 61088 381049 205780 268815 62605 93383 404770 538096 513617 112372 71254 66136 317266 339493 52316 155180 81413 344026 252021 91715 79518 294547 41726 30434 48632 78147 372088 92384 667093 111785 73352 347371 114998 339422 236647 189318 173501 170721 110466 209236 93149 38609 275778 132087 159721 275072 185916 442904 84724 80681 431936 647538 241858 68867 334519 373852 414693 315561 167324 370450 608449 237022 87338 69248 379616 150561 113539 127650 318527 377698 314880 519285 415276 441619 276251 356287 467211 104356 59828 59256 166856 398335 115847 137155 221529 124899 207369 275789 80920 44063 54881 75926 607804 134804 170484 158175 334146 405323 943431 407940 71234 612382 80537 77255 146142 94941 324965 57814 203478 180160 107355 152591 62373 1171522 191328 354994 318486 330443 492109 600724 917983 290535 396765 70191 132650 255834 52688 87445 235420 338093 415138 645930 128717 235630 194065 313033 86709 187847 336527 Serine 10231 7803 27668 218221 7989 112501 29525 22229 19301 82941 10576 9499 28459 31531 43789 8901 11826 4282 15503 182409 8286 8231 484965 22722 495121 18125 11085 5854 171196 89279 11678 27011 18600 298656 44677 14125 14598 158157 9460 2532 11318 8408 281105 8736 19612 12489 21416 12003 14174 87027 186539 38220 38860 34123 26021 169700 11921 10394 162791 9556 29842 16978 18214 12769 232378 10526 20510 17183 30356 15414 84320 339905 52608 234532 35561 343598 12734 8377 13690 14648 225057 20378 24174 23042 15275 231955 53379 27901 67966 385777 32497 92516 414020 22181 15390 11902 21804 201140 26841 44405 48252 21834 162630 190399 14168 8760 10840 10053 9646 20510 220019 17705 85411 40397 17301 496684 8208 143431 13662 11742 15162 10876 169855 10617 96921 26010 16339 16922 14278 15645 16094 31939 43345 87641 355374 54636 23891 276659 55887 17743 18599 203712 9678 10743 30606 341733 378146 20171 17620 31411 203423 7521 15637 35144 84781 Threonine 25052 16232 39626 422640 32327 261155 89041 36786 47382 161019 22788 20109 53182 81180 83374 17322 23079 71279 30022 400195 15590 26188 1161543 52150 1094207 35389 24427 15120 338739 169021 22536 68022 32597 561535 57407 42063 31641 339171 21893 7647 13996 27772 399612 25356 44253 24496 27997 22073 35021 168651 357225 60072 61777 53481 44359 281073 36627 24816 298591 51094 65924 49877 67957 23856 495371 31500 52313 36320 68226 29530 160870 644479 80929 404911 76635 716194 60743 15775 34867 22893 372329 54127 46686 40646 24909 397187 110523 675887 135018 786890 71216 169576 784250 39973 22234 21067 53161 280636 46595 71279 99134 39073 289371 352709 36858 17638 18886 21221 22910 39647 416515 40757 165572 92075 34549 798232 21522 739664 31402 21705 39473 33366 297793 22400 185845 86368 39593 54586 27780 37475 71734 56107 127962 169415 617485 229842 65461 416235 168803 34855 48774 403487 18027 44460 60765 737908 769525 336514 39560 60705 345088 35931 31371 75091 163342 Methionine 164699 129884 465977 719395 142234 115687 799958 283472 409347 941434 212312 112549 1279248 1205731 1017847 194245 227690 637219 183020 800048 160237 253248 549668 747326 1327929 328615 127000 97320 543868 1007242 148513 701623 248995 823880 1177173 234316 256985 762622 100909 19475 124797 241263 1516679 363358 1815749 389943 275040 175216 365167 991079 491996 775078 664915 615468 382732 300933 136157 113081 794006 178506 507624 186964 382365 594978 272000 256466 791769 1235911 1034693 284935 971247 724413 1798123 724241 662459 444052 937766 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14265974 13707833 5002721 5054929 96098904 18878609 5799957 90678864 12015483 10291189 3165939 7503419 3666919 21978999 1354234 517063 421451 428900 1796562 19981978 66618674 1778564 23375060 3254772 63510345 1236216 5436502 2187074 5870068 108403741 3340463 3835518 10106982 5237710 64412664 8250755 59785211 16271892 56135927 488545 22001198 64391075 8791453 4880145 5760806 2370439 85158130 9369213 9508484 4831115 6115849 99894017 33158078 4061730 12098651 6253513 10197155 3559046 4059909 41167743 17139607 20853515 2870094 1118370 27933748 270708 45531704 3523278 2635327 4797960 2334154 38937600 3563945 128941213 4916623 6358998 2943437 4939033 1795018 169224 2543624 3172747 20797258 45572347 989313 652460 97449668 768035 5603884 4757886 21842139 9319582 7002460 5796553 99593977 39068353 4676624 2193978 13553692 86522511 8756396 8346463 3254695 20735849 Glutamic acid 298723 185211 99519 676770 201108 471149 506975 840156 322987 536813 446929 64348 1765908 1524954 156868 201081 482051 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248912572 1851545 1971950 4680600 2644010 1530582 638073 6971242 6169074 4036935 5264794 218949993 1534596 2389785 1429463 1095786 1377209 5722961 11075361 Citrulline 130549 89855 63729 23558 184115 31282 462968 117878 260298 591031 149324 70923 52932 165084 124321 101387 320325 66614 20110 23754 71554 117965 30874 76436 33640 251440 184440 41033 58918 607158 108128 422215 65879 34381 502584 24639 87540 24198 55025 5520 727817 90093 27570 158725 688154 266055 51643 559166 193201 576685 45008 563141 600536 195724 38218 15573 46894 118714 13655 275268 328256 283456 265351 91868 47519 134571 8096 33287 63385 202982 585312 30082 701037 25420 547184 55307 140252 52294 203725 86941 31290 418825 105949 580762 29997 14523 1291175 45090 1402164 229383 60560 636714 25241 40002 32995 80570 170217 23673 38177 69637 537038 373031 47184 26411 309878 187664 188584 21525 101094 125724 51253 75985 595775 313739 140542 77043 122030 53421 167036 44962 335032 144002 22301 90188 12247 279647 126467 323207 62424 187116 175673 56070 917659 586234 27774 159003 101889 23905 107706 223724 152492 23051 57001 192263 263964 266695 94287 342191 220481 707588 79855 291941 171057 361282 588477 Taurine 7903 5387 920758 88794 29278 50609 49085 1750103 14729 938419 796448 399112 86733 47757 1577422 5366 6828 135893 901686 68635 2123 2971 43553 26925 64302 14276 79559 569789 8236 925257 459400 3288095 993198 41595 2696603 766640 39110 29436 361505 145119 19642 5278 40300 7141 617943 14810 18636 39736 24269 945905 38076 31209 19576 12165 36530 78258 861164 1086843 21968 1507697 1664937 438805 5483 182084 144588 6568 43436 103319 13176 231625 925641 25250 248793 44844 41961 57970 93191 445504 5396 574123 8468 13469 17589 15038 16692 42628 17851 33972 10540 139437 7502 950362 40388 587887 378006 10478 8085 24408 1821090 3012936 2001692 4042580 26935 29336 15018 638332 6512 461257 1573837 534878 139227 1351698 950846 40998 352324 73793 34613 95267 4864 24453 12758 55448 45041 8429 100584 1636026 1259050 414657 722601 58804 51893 989449 8017 956930 25847 39815 923499 34904 15722 93250 101283 99145 841152 1495279 24100 62136 150688 1276562 4261 19005 36286 750140 1561384 10966 933623 5-Hydroxyindoleacetic acid 22599 42169 3213 429 12733 17405 12108 8638 13565 603 14873 73 20213 126182 91 9248 104 45365 104043 21196 5548 2940 67 14691 667 45852 896 29 881 8928 322 116 202 5053 7408 489 4224 240 365 38033 13817 7687 43101 1401 248 20 2943 3493 156 1290 4791 1499 419 145 2200 38 44755 14539 3809 2974 1601 2854 1261 122402 256 29 3699 2261 14055 5411 2045 42535 12171 250 467 1414 14472 1372 887 44450 145 117482 5092 204 24 12551 7147 56 6434 1113 8032 6563 495 8662 1303 211307 864 30 28481 16331 167 130 28417 22714 218 480 2707 3763 120 12699 4933 432 1647 31341 14227 3-Amino-isobutanoic acid 7206602 535012 7903658 13468666 2142662 3482399 16840885 2587435 4035134 155040 399584 208748 265913 815882 178769 286096 8295038 362057 2869598 825834 657424 2821390 311364 2657254 3192980 5244446 175491 3125680 659154 2628378 311601 315963 14985622 5092343 543745 4485517 3037472 8933501 477960 2312445 6838804 2661694 982534 16027073 463053 851456 2626513 410319 221589 2465724 4088294 3103135 839628 1593254 5742860 2628664 9660860 337936 2658057 6727162 2590261 21876934 531148 278030 3930202 1009793 776483 9736617 592917 3249292 6011277 4575169 1455502 2349580 636819 380457 267475 9940891 705695 5812280 238028 1674505 gamma-Aminobutyric acid 3949 2474 30595 2147 22696 2426 42832 113644 14011 36943 69830 12472 41118 60191 69594 1656 2766 10839 27757 1271 2942 6482 2031 105733 1875 8545 6353 40670 3646 37692 7031 6032 22422 3202 66295 35838 3928 1921 28219 9594 24112 9682 461 10916 276604 22700 18524 58241 7675 39382 3260 19512 7351 82938 26715 4413 17759 7004 2833 20386 15985 102406 7215 37322 1272 3223 20106 27782 50832 66611 37836 1678 155385 1479 12436 3893 116535 37821 4408 141005 3848 9323 11404 7441 131516 4328 34096 4314 42822 12362 61509 38485 2856 45904 27186 3040 24094 7859 22272 66823 51316 8480 4000 3532 7038 39077 2580 3379 40300 29348 5406 48012 37743 219209 58566 3009 12378 3856 3856 41881 18010 7968 3560 98768 6552 32581 55637 9199 23386 133854 25938 45471 26351 38664 1771 187173 120916 1333 40545 7045 5936 2544 19240 112768 14698 2719 3115 145545 11593 28933 2464 52283 75906 7339 36197 Dimethylarginine 4068669 3629520 60597272 88531652 13862686 34631039 6433197 64317410 2515859 37889318 39109514 10585889 50659097 87504834 1362497 204298 2824333 94575948 53553217 64299962 856729 742794 66893212 50601448 131531040 2489769 4048479 27297049 61298592 32771721 44444350 2517409 10338358 117392047 10960999 14973306 2659723 49711273 4864700 11483569 38620525 613829 60120749 402146 68060498 4656673 38648911 40248126 5173019 33253621 68530478 11086287 4542453 22929246 5587018 57440724 53559279 41411487 89464051 22631993 32221754 7369922 1462943 86929509 107814359 1446092 28290823 21626289 761253 5299634 29717574 66435400 2734216 75220848 7278691 85904286 62453999 64827293 2852392 6079699 79419126 4751815 44112975 10137896 120429249 106181037 8898718 58758882 11255604 85148443 3793990 40039136 54060277 30825840 50756846 8325084 5809220 120189576 12991165 19998664 12985352 8484172 64757401 86224019 5788188 27616939 1546352 37596412 70613696 9633451 107584942 40348250 34394932 9209869 87326929 166816545 742847 155793460 3634979 2018935 7646943 8521530 86241453 77007798 87738670 10010732 67023257 6722386 56220406 98317160 464908 34343692 2124328 33744479 59578507 72266416 76242370 46083854 2042625 5644062 6215048 68502052 57588270 78451794 11347115 74114369 94619599 88290436 5963196 2331014 89961090 85680008 51820 4627732 33480288 Symmetric dimethyl-arginine 1977484 1165873 12869901 31680520 12259466 20833664 2422876 45210122 929371 20780934 14570361 11929741 30788974 53167621 7198211 113823 1050148 35698269 20993478 30285867 496717 267969 26531492 18425140 58007056 737206 2889549 13078508 20508973 18420304 21875812 1500662 23916639 54731451 5788724 3247331 835879 24900695 18082134 18384518 36052376 447209 32649237 278999 42035309 1200939 12856164 23158175 1162374 18688054 38443305 4471695 2192432 19784691 28110253 28567597 26396021 17126565 27548548 18995821 26051851 39990418 498439 52224643 52404681 1064680 18013231 11274807 182732 7145102 16987028 29287003 22040288 36719215 19287116 51329686 56059602 23234604 1191363 38965708 17681539 2065119 11588341 5979115 43136813 42812670 8290619 19157447 3818778 36346364 1020813 21609073 18426778 30218102 43234207 30351386 29756248 45527349 5057067 30400883 24640236 26697923 35933521 35683606 1890966 30129564 507274 10666043 32251038 11415744 68972957 21993234 18448485 16039658 35942059 58907159 625629 56405643 1182419 57501397 932036 2652986 47396797 38944510 32423487 4916821 39529580 3310667 34155178 33481920 440026 13386503 3321076 17717174 12566386 29013672 52706702 14449290 16413671 17371128 25950336 47869711 25802456 32145353 9931031 42115553 62621916 61077868 15615068 207572 45280846 45841967 44751800 2083581 20043914 Targinine 13569 9094 61553 37384 14851 41436 49095 23981 30035 89771 48267 12047 23121 29455 13110 2251 5822 82675 20193 43894 9319 5338 21274 22262 27765 21867 19731 64542 61533 71475 12696 8985 41270 66480 29068 41392 12007 72615 5810 1861 17737 5171 11732 4708 23855 29727 60594 8081 20326 70113 57442 45716 19125 75462 15818 18571 45173 19397 54237 97885 101628 26148 4158 60436 42679 5843 13871 11887 5027 83300 62310 24002 10845 26400 25148 25584 20462 13901 11438 24389 68814 22736 104586 28149 58943 56429 114119 32196 44230 21280 9000 68863 25260 60408 31930 17756 59358 120460 14183 38848 73945 45797 36436 49092 44075 22825 7057 24322 58127 36333 49747 8149 66486 42345 83236 51221 3781 57049 8962 11309 58746 67871 72361 110931 25975 49984 96487 107839 21882 53637 6392 27022 8791 69105 32084 83707 23971 15412 8595 19230 27453 35922 28223 88493 37561 32753 55270 39831 4225 24265 55230 35148 14862 16574 68583 Allantoin 2132 2690327 133573 644048 637206 221873 5936 376164 28564 24238 1944 2683 1463494 1473579 5182 140891 245303 107093 289633 693184 214554 1022650 2551080 1737 1930 2678375 5763 127658 172958 253850 10 6781 1555742 169286 596750 1238 939290 262405 1331 1832682 1790 714103 1012191 14269 606 1964 1177 187409 105581 31349 252304 261863 1061140 875030 996820 1102662 1611465 11608 140164 69960 223571 141795 681993 21336 1346936 12471 696 1713848 545316 967 979 1132329 4692 3109028 69110 186983 20829 195308 41416 24634 1384 3260253 2899 863214 573671 318976 109585 59445 1483 221606 33535 7843 69150 121769 770103 186917 745494 221845 334870 174011 8299 2116 1989850 575070 185684 2-Aminobenzoic acid 15132 13459 2972 1337 10717 228 24801 6942 2987 8822 615 7303 2508 2312 166 20313 16202 902 2517 257 14946 30933 959 567 470 6710 9244 1470 561 8440 4186 3221 410 328 305 2047 6988 948 2896 3954 8985 17245 248 16725 3405 4181 1678 4456 7757 8361 531 6919 12773 8699 5201 913 2222 1426 562 2334 2075 2177 23773 2708 500 48468 379 447 1687 8291 9104 189 7459 727 13151 1311 2800 1933 2108 1048 242 11154 695 9280 2726 252 11527 365 11207 72 8915 381 596 3968 23493 24870 1211 3603 2179 2109 2584 453 1765 18536 1313 5946 810 1271 4198 308 1337 7891 1523 810 109 83215 647 12092 900 8188 3352 617 2061 398 5631 4202 17892 3017 1962 22088 1156 6239 8407 1155 637 1081 598 841 657 22186 264 221 10485 32479 2537 1548 2095 16502 58948 1064 6334 5301 79075 8739 Kynurenic acid 230312 147327 192110 79554 162687 19064 120444 351946 173940 152469 107595 182451 147181 86144 4342 52749 68518 57501 116092 36251 217 1760 77505 56488 54868 144988 186585 129886 514489 157521 86158 229808 88855 110234 3981 113668 196412 51534 168202 151692 163986 119581 91661 145997 112579 90950 55982 88846 114435 152868 58927 36325 46199 107232 133925 41767 127816 46715 157443 25903 67623 89064 457 420395 69802 52 51682 70467 4515 34903 151715 98370 12672 55045 32722 284010 75092 55087 2637 102273 31737 14919 107104 12777 59318 37662 5390 48276 4228 42061 4802 147331 64748 167346 144588 22121 9302 69610 109053 117019 22077 19113 86182 90761 159312 149949 149967 96385 58482 3636 74026 68096 156482 6546 21845 28094 3396 48190 10213 222296 43243 128355 265133 203591 51819 128995 217014 122040 80004 21340 6560 11039 4457 150706 20070 53583 34930 34684 8915 29986 241676 148958 89367 170281 201298 92649 33723 163503 3840 2224 95766 209891 158761 12406 147409 Histamine 35796 3951 22284 35473 74700 1747 42047 7086 8375 154106 3445 7341 14588 50131 7041 86 13 28776 77300 7062 2583 1037 3525 2088 4855 3193 41335 90347 15832 141699 266176 30722 38963 26896 4177 127730 21339 50324 58892 136104 5234 153336 4360 279 6311 603 3384 130654 2417 134871 12817 60708 335573 15149 36667 38236 204420 45269 135169 39199 48391 38724 1307 271819 10016 10766 45332 116406 7509 74424 142724 5439 5473 4734 36281 11179 15462 20985 45565 54735 8124 122481 5333 3856 419550 83601 6742 3092 1106 7926 749 141832 4112 10503 57621 15122 213378 19897 10521 17830 34026 11327 27298 7300 15558 45327 6492 50851 870640 15001 18686 10998 151712 80870 159003 6339 23718 17033 54016 69697 7589 22801 40176 32089 92360 295301 197165 723365 194839 14579 12263 5147 41129 138363 6025 1146 73313 5010 12829 17667 487497 91925 68965 75654 279034 12342 7971 14903 67032 102784 65004 684267 369120 144812 148039 3-Hydroxyanthranilic acid 4610 2934 1459 2118 835 5718 4350 2425 1704 3744 1185 67 944 2779 2945 2054 2120 34 2772 4324 1913 1658 457 1010 1824 644 922 474 605 1632 2742 75 20179 1241 3373 5255 2055 89 1124 5221 1659 1827 1577 3270 2899 900 79 467 562 292 866 4442 1864 1472 15 2578 1482 12 550 1516 529 413 320 1072 1782 2813 2076 106 3967 55 7826 16 1822 1117 1631 1110 659 632 700 592 676 1762 31 1046 885 1076 1069 633 163 382 221 474 1736 1605 1455 3047 1985 3464 2692 16 5115 497 851 333 1391 181 2554 1634 41 1451 1670 1107 1197 1317 1525 43 4150 2972 735 980 1508 3670 1632 Ureidopropionic acid 7700 9777 28389 3838 11777 1796 14440 77108 5474 22360 44535 4314 1034 1318 2075 2407 1058 656 91220 771 1793 2582 104 149 262 1500 1266 12164 2185 21524 19405 827 11788 1716 2084 4362 2533 7030 18545 8524 4087 5791 253 1323 1784 431 17161 41761 2911 21303 1813 779 1128 434 374190 2872 8706 8619 1871 22673 33579 613071 1780 6585 986 667 180 1808 12 4602 21973 116 204 3487 168 417 3235 2735 6557 1783 5423 12031 811 3912 2505 814 76 5862 1888 511 21574 72 12231 8539 801 2832 3042 96874 9050 15757 626 3174 4046 1853 15510 1128 13195 23885 4833 1694 13722 21757 36636 116 404 183 359 1247 31259 1711 16549 2509 92894 3662 1642 21000 1013 26941 479 207 192 2065 21778 323 338308 760 207 1484 3325 2589 5278 3360 30538 13765 120 408 1330 717 839 17081 21297 102132 1185 21158 Niacinamide 22704 82157 11072 19436 42059 106708 30980 25674 12469 7433 5269 143651 6951 10604 7819 9860 17577 11251 3357 21493 6170 4407 11503 6562 15418 22397 21877 27963 11999 7960 9269 7280 6271 7205 4479 9380 30478 19067 6407 3022 3798 7277 11517 6543 5561 32329 3091 2917 21755 9196 6877 7302 17883 5794 3496 9059 1936 6543 3911 10480 6063 8457 8506 1761 11229 4541 2813 2948 8870 4875 8444 16869 7709 12715 4712 4400 2579 2659 12538 5404 12247 7570 11826 27586 9987 12827 5801 13876 8964 8517 4630 7525 23736 6771 7387 9502 5479 15130 7442 9500 10099 23329 8177 19212 16103 5613 29485 7645 5226 7213 24665 12401 7820 12149 3455 25969 13129 48474 10413 8477 22332 34601 20278 7896 36359 17894 7291 24231 7567 5700 12824 7226 12500 7860 49474 12377 7216 22828 907364 9826 32671 7091 4013 20258 48491 29386 85771 6736 17683 9510 5030 6500 7587 7879 7164 Betaine 160107 126983 4594632 1686424 229684 806023 332678 2564553 152113 2121691 1966355 654759 2501592 2416297 153466 78557 137745 2537509 3700141 4419635 184542 228523 3304924 3854826 5124598 209018 175171 1811704 1142434 2071353 1957629 106763 185242 3297639 143523 252435 113418 1070103 1043348 1135573 883145 166623 2465344 201562 2919273 218986 340570 2906875 134014 2052701 1495518 142719 120320 389159 3982053 2893411 2147759 1936421 2131706 661238 374882 463827 171983 2856533 743195 183273 1048516 1549490 113469 199390 2184656 2040466 369808 4916351 150331 4391581 6124093 3214428 176530 3780218 3054789 213363 378238 144991 3748915 4576320 152001 3379320 145749 4193463 137049 2062231 2629209 4286426 2626364 123145 138224 4282459 300903 535237 167720 123247 1265372 2501233 107453 719625 84996 3784932 5053420 454914 1913119 4602134 2143975 749288 5029619 3072623 210548 4915773 153177 3752455 174704 181358 2606094 170477 1039343 190449 2457403 197769 2350571 3341851 106761 2047305 295531 2007677 2639854 8081512 5443564 1551276 265350 238156 201235 2585224 2721562 4033703 199672 1861231 1428168 2067970 20638170 236786 2837722 2742732 5883712 488085 2337607 Choline 3276360 2652800 1335146 5213550 868201 1608912 9272483 2066653 2464816 4589377 2429918 2050265 5827451 4947720 2795244 363763 1258858 1539213 524816 5964030 956903 583252 3214741 3121737 11675762 2022905 5580389 3586511 2964517 5260266 1726876 852407 1850806 6753171 2687660 3997703 2173047 11002149 787059 655513 1603725 1025276 4523467 659442 1636988 1192865 1770064 2403094 2378543 5155261 2589611 1984302 1456524 4399579 5093046 3491150 3442429 2903798 3858770 3166054 3323255 1624654 1025194 6589428 1261099 524619 2486173 2409940 2083771 1752940 5192278 3908464 4491159 12306768 3912882 4587698 4768897 764237 1373570 1329215 4239749 1397860 2880560 2786952 4588952 11550239 4347108 5766409 1527530 12429533 2246309 5901066 4356674 1584802 1998859 1107758 4329683 9961720 2935625 3208115 3503603 1351525 2718323 4401899 842081 664001 862703 2170261 4518037 880236 3194982 2256784 5054969 2482053 5708686 16398823 823799 10048098 388132 3502715 1318546 3553433 7237197 1501052 3850018 4372606 1673509 3250301 2491328 3136420 592492 4307232 952437 5246261 9871606 3782924 3036018 6291644 2075414 1742530 2725829 6466510 967562 1164334 3575664 4014107 2546943 4147587 874498 919348 2268289 1168253 1609827 1697753 4801639 Choline phosphate 567948 464661 180267 356699 533370 44309 1065992 424991 393077 1490506 15291349 1829855 209193 220045 21951 16060 3136754 355926 388417 105239 71279 7385 150419 156013 56434 21023 10957294 228205 1341764 1229770 543581 55342 223928 52047 116182 10789442 131627 447260 108086 13524 8176 9212 144284 4898 10052 12152 383279 1001019 82197 1259139 12047 4054 4141 5997 416669 321368 90408 4138205 1306873 20916434 8011521 241428 80765 559130 49880 2790 3824 1259 2240 79863 1039932 5395 270649 512026 970225 628604 333103 583431 1968416 4371141 229359 513601 826996 2352186 4374767 18881 291545 19139 9610 6146 1367020 11157 135897 1572649 60172 13672 4408971 1443856 1720650 78605 30867 21839 821570 54387 540471 105477 824430 2209626 459524 167149 2388876 1275051 441089 701501 287932 1691 2151565 18700 1804213 24681 11346631 639649 2527681 453822 1486609 1397816 299080 1467399 36361 16100 204000 62404 1199376 18216 1956 21082 73547 2064 559231 51016 94836 4751 6921 266892 13742 12094 5834 5673 3313 124302 9958 29128 966422 sn-Glycero-3-phosphocholine 7627 3251 6609 519068 17735 76003 18463 12498 19849 8705 26081 4238 50445 41154 1334 1271 8646 59060 5828 988890 11564 3230 27824 10364 1359410 2528 21428 28245 24488 11980 2836 1091 8900 1731858 1664 77256 4641 2631251 21108 12167 5661 3129 1536497 3133 4612 712 10640 10560 2080 12401 165245 1268 2361 22042 6636 381399 90456 24277 635806 472604 143012 5998 4367 51397 26283 2015 171 1518 10699 9217 435218 175 1024914 2055 97637 35596 2991 16252 12567 808335 25867 96041 7313 64695 3170986 4713 217034 3228 968921 1192 10553 49301 13709 20178 2655 1097 853151 7897 25421 47874 23479 470851 392445 8270 4814 3768 6131 1228 14164 333891 28163 14115 73090 3584 1912764 15451 224773 4637 27966 7661 10891 541573 14663 104807 28964 15382 8995 19384 1705 816 8822 888 12751 1369969 12511 4208 1031158 20516 8906 3651 338746 4107 23038 4929 22122 828194 3772 134048 17379 456084 2475 6097 20813 8093 Acetylcholine 22071 114107 14501 3644 7784 241 31822 1412 7300 21709 6232 5849 116610 18292 9759 4344 6643 165477 530909 31444 11202 901 917 21552 6744 17128 5105 5162 5363 3523 20316 12648 13637 12177 12292 17531 87757 1390 3723 44909 20954 1174 9257 3360 6932 3773 429 6741 955 20279 12549 9260 10135 270282 9722 4103 125494 2997 21225 314 6646 7724 9352 13916 10495 13137 4793 97770 7516 5572 62661 148256 1531 22448 11060 4264 13415 339891 6010 7667 3802 20172 3911 4253 3633 50876 4210 9101 3434 5227 2347 3568 3748 21935 15869 32363 26061 14491 113964 133692 4711 8096 4427 4840 5837 11118 6028 124 24 12500 20573 6156 11389 4609 8194 8283 16367 5733 15655 5113 6520 7968 73948 20278 Spermidine 177882867 25136276 59288923 28145697 165627969 17391771 33488371 10848999 62616375 328693781 66098172 9395110 95807569 246635178 1077797169 2362224 13515014 10381953 23135382 20648722 99638774 44539759 5199895 25474690 22969392 289718297 137693447 12598593 21974939 391533335 11981346 235646806 46467289 136676914 450559521 33176757 62015726 28982831 28504542 2259439 81770401 62126976 33097232 66278800 56254047 466288894 34794383 3331934 74089124 383675449 79943582 453791511 242540442 382714014 128730106 83762026 24038278 10828541 13321522 66932635 80185784 233970480 14598089 16525549 21408025 69509859 54292758 754300449 135777624 328957445 20341761 1114845638 95252195 215462955 10386065 33633878 4504913 76591407 18042330 16489065 314065391 434852759 56118198 12190325 114080669 894319726 30663840 838282513 34338136 1532471623 456915768 10963843 159633938 48834433 481182787 395233303 26302404 33357633 290381853 525805676 192278959 25486356 11678540 38828556 20766765 5530600 6783027 5133029 306109250 57855079 5800640 391310532 328403700 78360856 15322125 21537626 14138538 16685489 70810020 687616670 85343098 29833277 186131568 23187847 385066017 78088154 697283303 24797346 147838662 1083351148 451848872 517026534 387052856 23399689 1036610668 223064600 12452472 1152388873 94829018 30370023 127652323 6055215 125766421 223029102 10602925 15621971 240108524 22330553 47689140 134927601 12580370 78299346 86848306 312757270 Creatine 11718 4425 4497027 2594243 262313 1496921 6197 3180170 5458 2900931 2651350 1547350 4164842 4006068 5303 1163 4489 4171264 5665347 3712397 32355 6864 6635582 6230021 4265587 1857 45291 4131247 3532899 3053713 2119395 3294 196859 3602772 12331 1276706 2838 1619576 3471103 3796365 6380382 4364 4088599 7040 6777290 9137 4955993 6279755 3293 2956802 3626866 19607 10609 3388889 3143197 3886228 2902076 2014621 2151365 572575 115552 4048761 17715 2976143 3532789 2391 3937528 4755853 12000 325361 2966847 4087511 12909 2645208 17372 5632993 6463407 2928654 5232 3544378 3546606 7063 4536840 24152 4069256 3445478 10272 5616823 7232 4148567 1473 3156322 5246035 3367720 2853945 12189 1801 2276252 2169622 4049089 81291 156867 4336388 2666150 3960 5025401 3996 3577204 5122620 1370911 4768904 3612501 2993631 723631 6240415 3618434 182984 5825510 46997 2677924 7539 9721 2893497 4614972 4237070 145986 2743377 4451 3381773 5970308 7415 2666965 13524 3032893 2922062 8495620 6526384 2961579 16060 6252 10097 3115527 3161549 4334735 6740 6386144 5800942 6921116 3568 13515 4510619 5177421 6261482 11061 2939238 Creatinine 5481 4436 4362209 4353648 1546515 7215814 3381779 19424765 426767 4949788 2829328 3427666 6942937 9112571 7732 3284 4371 4800479 3482672 3779011 8791 15453 5789553 6284670 5534554 7263 191551 3079225 2736680 5020807 4636288 15347 7265879 11503595 13084 3396707 3626 3091123 2830814 3259408 8684552 23761 6299846 12826 10064377 30706 7220243 12206372 46938 5129733 8428697 17277 5048 10997419 9713632 7010186 2690162 2329335 3814052 2324130 2208658 286833 9710 8746769 8181003 14896 6273163 7712561 7752 2346533 4849324 5615560 5109 4887353 417057 7562124 9762792 2211043 4549 2750488 3466809 8678 4791992 37179 11677123 10815945 13666 4916168 16518 5370905 5277 4925144 5380292 853322 2411891 7827 3603 3797298 3879296 4868619 1905650 130707 9217228 4179428 31103 5659736 8635 2786459 6034827 4141342 12175456 5704077 4993284 3470867 6245159 6235567 99980 6376469 163143 6428736 8678 68287 10922021 10550287 5943000 1926447 9903784 21786 7071891 7133216 8255 4148516 27698 5008071 3901922 6708849 9946151 4665572 36376 935861 155401 4320068 1989427 5370569 14756 8472442 5833442 10785640 11871 906605 8321373 8845785 6091017 105712 4959013 Trimethylamine N-oxide 5915 5911 7111 9260 1004 11859 6968 6813 5979 7911 5844 9780 8820 28005 8370 5131 7619 7599 8145 8646 7382 7713 12239 9509 13083 7733 6526 8762 9936 8869 7678 4682 8092 28773 7054 7214 6921 8614 7189 8394 8213 7909 12867 6278 6880 7379 8809 7311 6845 8802 27712 8145 6898 7494 4599 21659 7111 8686 9692 6921 2145 6492 6560 8092 30094 5191 7292 5198 6492 6304 8458 11878 8077 8597 7179 9797 7612 9659 3951 7386 11465 5463 7118 6798 8823 26130 7792 10700 7644 11069 9101 8804 8718 7828 7566 7822 7909 11292 8502 9168 7843 7739 30693 10018 6386 8562 6716 7842 6901 8898 16311 8349 8393 7133 5648 7681 6815 7035 6409 7028 7231 6177 31944 8639 21713 8307 7994 7170 8564 6658 8071 6790 6506 8398 9049 5991 6713 11602 7578 13121 7518 9071 7915 6987 6857 10532 9329 8197 7502 6493 12529 7015 5536 6959 8026 Adenosine 543610 484294 108204 2548 96198 2742 35028 36437 28493 39075 12503 19988 4998 273379 44127 8794 10917 8147 20689 4332 17455 12000 3758 49425 5117 89001 27727 27041 4440 38982 20740 45903 10059 8258 209775 116291 390413 33893 52453 151530 43635 13576 6072 18879 17835 51716 24253 18680 19337 40400 9179 56586 28659 66348 94096 6537 175064 19904 3601 74883 40681 53848 2254 7665 7539 3183 7376 22886 76756 31152 41156 3830 83471 336 19425 1986 6493 26997 82928 17779 2851 57581 472838 21088 43846 655 34175 34832 52304 9661 70256 40196 7336 36268 23780 125429 31865 8579 26653 18439 32436 37230 1378 21631 162116 38313 66063 95953 10792 31951 2721 20631 38576 56921 6346 13482 13139 9760 19645 29894 80055 64678 4134 83560 4045 323163 93406 360138 36095 6151 17505 12856 66940 41535 1031 57642 28874 1589 96791 78128 193454 11086 14232 123056 568744 2346 1482 9518 41630 41521 6540 12920 22075 34220 38753 Cytosine 8543 2113 13401 16252 840 4369 7088 97271 24333 15892 158561 4718 237 53837 4943 1775 10515 6384 3280 16274 1468 1616 8672 6297 19680 12911 15541 95779 42900 14277 2371 7465 2728 49817 2800 12765 12633 60369 3242 24322 2635 3866 17480 659 9603 3401 1176 1617 12627 14594 27597 6580 6884 883 2133 29766 38557 17969 30630 37185 25320 1700 259 1958 44555 747 2332 479 2024 11446 15100 17372 1875 8162 8796 12088 76368 2733 8680 2352 31655 9831 1196 5292 11007 46990 3090 5279 20734 7751 5774 15203 3178 4258 1560 104101 7953 41329 2810 2074 20720 2915 45396 8761 16590 57774 13873 4543 279 1958 113808 1314 14785 3519 21321 14395 2072 80460 6006 1268 10314 56252 33790 9349 26956 75874 27540 32237 1417 1186 1845 638 2815 15798 7400 9093 1026 9529 4722 8374 26429 44133 14508 68241 39573 7292 17934 7510 7615 7647 49711 17314 4592 8195 15272 Thymidine 898433 895212 1190499 1000173 1777332 130068 1023643 360249 877094 2128428 799869 1221066 135256 82226 888980 908079 425136 215633 560146 1150275 3024513 6100611 964339 70967 3040730 1198978 1241784 269488 1629788 2170856 552131 2423267 1142841 2959890 3408885 1104190 3251415 637208 1933315 449510 222742 840333 1129427 5862162 194539 1568477 1207641 438268 2536411 2295822 570990 2584794 1226451 1887334 2038427 972085 1399099 465191 1692570 1647054 1283916 789055 1146119 570718 2355562 1563704 103284 78711 154233 774224 2206051 810406 1576538 2468220 795774 3156183 1817179 164911 1169953 875442 1745321 1914914 2384890 2004012 1142566 1819072 3636124 22028 5654002 1191755 1091711 2174106 697350 1537160 1048756 785042 1216742 1636186 2433354 1766381 819607 2965539 822481 1358954 1871590 560957 929552 390982 352344 1928001 2481335 1647702 2175838 3204507 228738 2955836 734440 365159 1044199 1376071 2363131 1982824 2097877 3767932 865032 4836926 2367096 2711771 703045 53591 442252 852341 3376089 2167850 494278 2754537 215656 530666 293430 1614894 1165990 1032549 325194 2044688 2042127 440950 1547501 139035 2326072 2164142 767564 413785 1686287 2771906 2093896 Xanthosine 6206890 4145970 2682385 2226700 1936286 797138 5520331 1042166 6131574 1070328 457412 2375927 305398 543278 500315 118492 28206 886935 1621277 238742 578317 718644 150434 225983 186006 2450978 1802034 50394 1728054 1168699 212613 4106020 25811 1645699 4187528 1286154 4606575 1029907 335357 316705 239474 108975 531197 262045 468867 3865466 1751251 734466 1418902 1244815 839733 1619893 1983705 2023639 1238608 1766367 894010 73970 5292781 63259 79662 2375783 32606 750425 1726576 103861 408899 24936 467279 664834 1274313 169423 665978 226576 1478761 889189 852361 659216 1582973 48244 697204 761817 768730 2890029 160513 362433 2606088 173077 7528818 375085 526780 1014878 129587 604690 134638 1963261 2989396 1449438 644774 78521 1127436 1508627 719452 2074409 1014523 64703 1429633 3013773 447782 913489 610125 791658 1154203 1539073 1583583 180123 77152 504302 460620 309641 3467856 581199 850440 15946 1494609 5886273 373930 5085764 267209 208177 11225895 254901 1859641 1062637 73612 169054 183995 73736 771251 1089534 3201058 2398017 553878 32092 4365750 472076 343914 3749986 3214709 188854 1308108 1850864 87848 162631 1091190 Deoxyadenosine 529125 468927 66195 7078 109553 12186 10935 16256 23916 13246 3767 127383 50969 2733 5229 382 8025 931 38588 30954 1122 4975 15785 9448 5975 417 22062 6369 65815 7379 464 89878 130954 395979 1507 43058 11851 11133 39388 5859 5254 15470 7078 2326 19912 23264 30 39328 9015 39276 31818 16568 5181 3207 19326 21445 15767 1472 1226 656 4525 453 1664 54524 9555 24078 96609 194 14093 249 275 1721 77774 2344 1627 91947 206244 9621 12624 1937 70283 10588 61427 15932 24766 2371 19758 16753 26787 22981 4169 18860 10106 9094 47778 769 3819 45748 4422 28180 6628 8619 21730 789 7653 22570 38609 6199 344 319 6476 3187 24825 62584 24822 109887 5570 361687 47842 780859 18288 1268 2682 10888 92101 24638 82768 8043 157516 28963 79261 136 5500 84951 264968 1531 66612 148967 5843 19492 71875 22831 Deoxycytidine 32929 19121 11913 101630 40206 1461 12771 7360 27190 27945 37147 27722 870 2689 31640 6485 11146 7388 5795 134594 13048 15187 24794 275 141103 35464 27675 17294 58017 27578 6104 25064 14148 143356 35443 88611 50051 31831 21625 24900 497 18698 143839 5650 751 20758 6094 3180 21536 26430 55472 19870 15551 17135 15271 155160 19621 5192 227941 31371 25688 6851 4461 7400 3140 4356 550 120 5401 34300 27269 74191 28518 58088 12005 9648 818 4406 15714 6714 135127 3232 16703 11205 11480 206645 31194 10164 59817 70350 17156 27700 32070 33049 11758 10140 19320 216117 20022 17825 38736 42319 61884 92111 23312 10825 38619 5320 7204 94291 146960 40667 29343 46411 2528 88597 3120 11007 5794 27288 41658 38501 30984 73392 145619 250055 126705 99201 25674 680 3274 18653 30576 27670 99714 12459 1332 87441 22503 37444 49383 59402 4538 56698 25136 36781 5411 2820 34895 15296 86657 6917 16635 28891 26337 Cotinine 92669 60552 93199 92036 83144 356 900 1387 928 4150 94 31395 35 1253 585 807 10 17 2262 1430 59 497 55 545 1324 119 23 3962 83 226 504 19 40185 12256 13463 31923 36888 174 1237 2456 14 964 24 2811 3672 1089 2030 2835 25 54 1090 19 15 30350 16 1970 2740 4076 271 8551 26 413 248 127 1278 20 563 2530 2823 4539 120598 55534 49670 56274 15162 20 95 724 16 12657 22779 5300 21922 6897 35 3732 279 653 2003 1391 2853 63 54 1007 29 841 48 1433 3763 28 18 264 14 31 594 9148 6022 26 2129 4138 Pipecolic acid 232313 245386 212539 8913 66111 3196 702584 49932 780333 172493 87186 29233 23765 13338 164327 659142 533575 14038 51883 8303 10971 9700 5882 10368 5957 23606 88130 52412 11762 197353 85182 441932 93344 8821 265044 103539 687902 13951 316337 98512 212142 21589 4255 30770 33716 785447 58812 84044 712846 198972 6525 218573 186167 182263 45730 4979 67042 63072 11715 168873 104782 260184 556507 27830 8157 834210 13064 16620 285935 108379 194707 7047 293295 4869 173579 7281 16571 32407 17791 154726 15645 33277 276887 793663 46114 10757 504581 9314 498448 11786 404546 225838 8078 160210 107443 422846 212361 13544 102355 97331 177425 162803 13993 13381 200873 107894 236128 44827 85183 53357 9819 93893 198235 122410 15232 8400 481052 10322 614192 288606 146662 430327 10348 169030 7809 169971 124166 419963 62153 24147 335921 11978 904437 193797 6436 397175 17609 6839 140669 81518 318264 8334 84540 302851 638197 8574 8758 11253 562167 1221091 14980 119138 453385 659623 186006 1-Methyl nicotinamide 2141 1747 154501 15670 171786 292983 90594 1498492 12330 25755 29001 27581 45604 96801 5337 1906 2594 33917 42880 15715 2740 3157 53638 57544 23661 2416 5797 23576 29395 29447 43301 65350 48361 25963 80275 23882 16990 8311 31596 28166 174751 2322 49810 1843 143240 4614 3951 52864 5320 29857 39665 10037 31574 2043 31318 22643 17301 13725 30412 2017 46890 2207 37873 39519 3364 51290 50800 4476 6031 30246 63475 3008 16798 29058 80307 90736 26437 417 35431 39087 396 2140 5075 81210 21755 4012 65968 72173 32847 8095 32891 50246 76952 25906 2788 1933 12426 82562 69162 38546 76103 34732 18359 4479 44495 2178 39913 29651 34968 56449 45231 29018 38421 32598 14541 7613 37392 45010 58266 4797 15035 36780 55585 21380 10760 59328 2169 46256 68709 82868 22627 3473 30131 17028 140153 109226 27510 43713 22069 78414 30820 35822 44476 54747 133412 94530 152587 2424 9368 22229 29845 41875 3628 27159 Putrescine 37072 28257 248790 28263 263004 3250 26057 326070 59140 173191 223957 25578 349449 138930 10991 1410 21093 69654 288961 14361 3599 3141 340 162773 12544 48496 36143 263849 28632 162024 205782 7125 101176 21011 5165 38232 26960 19904 138548 111395 693687 31211 25927 3287 221993 14915 62064 152513 30623 158621 15187 8462 7264 59652 292825 28671 169128 216070 25494 423169 394812 379581 5900 419528 14082 4365 85519 397248 9563 136273 155688 12218 9278 9056 59635 845 163952 111107 28806 506673 21910 40769 180906 7831 49311 29696 14231 71106 38923 5532 14914 177996 187 115822 255534 11353 12578 57097 273271 170410 200801 49529 24571 34849 31424 413645 24054 147139 91005 64284 8327 46882 165588 175996 591883 1086 5536 30520 53145 239228 13313 37495 21105 254957 31535 79234 128979 55172 116555 195389 13941 128897 12899 162014 4801 134234 316522 9897 34673 133005 39900 98844 208688 540466 49783 4186 1985 505617 6181 2994 26128 173840 449732 19633 173267 Methionine sulfoxide 7337 6901 13184 73950 3939 16662 32652 16736 14704 38092 11265 8454 16616 13403 24346 21062 17220 36088 13888 73284 11791 10022 23347 19830 26700 29201 9715 5060 104370 40014 4063 35592 8960 87901 52901 19987 18317 88352 6526 1274 3099 9934 48344 26790 38333 17416 15624 7679 20730 38466 20431 30543 35713 18677 7067 23940 7862 6161 100556 11778 32114 5528 17419 22376 47789 8289 3582 10004 23057 9082 38123 14947 44799 11710 29174 15775 18200 4133 16734 10090 74464 22238 6675 47721 10581 52115 53395 10364 51160 30768 25269 41423 21354 108130 9913 7827 37944 114773 13379 11626 32052 19905 46910 113409 16176 6742 10583 3954 42839 6628 40227 12425 40028 30567 3939 18768 16496 23538 10418 4897 14582 13000 60973 7466 41744 26874 12454 14014 6298 17716 7737 13118 50781 36494 17032 38869 14471 16248 38631 13406 21589 39586 3782 9975 65345 22652 22544 13402 17577 60961 48661 14254 9870 16261 41772 Anserine 253 196 10 1 14358 1 1 7 6 1 1 17319 6739 1694 69100 177439 14197 2427 919 599 1299 7703 11731 9293 16329 30507 2983 284 7705 72725 96855 41 381 1 20974 374 49159 76816 1391 915 13926 5682 13736 16293 101355 192844 34245 2895 14726 317 3379 47609 2231 7042 50835 14405 11459 73102 2238 16159 13788 939 122251 1930 52836 42888 368145 66645 6354 48426 19317 47838 38038 16013 1191 4315 81304 27881 80562 13079 Carnitine 167062 112720 792982 1814197 1354635 1916364 612445 1728646 249604 3421547 1062753 1130725 403350 4121960 394713 199269 305942 1173661 393661 1847034 310220 230178 4798777 5035804 4057209 199793 332006 11381115 905920 3613466 644962 206042 1431017 9078161 679524 518441 161825 1808437 1012795 1208840 2519310 163948 3188017 280848 7726616 353418 852781 981211 1712045 3619918 6195481 114243 168649 2411411 1006417 3692863 1933527 848647 2011482 1185202 885933 1314984 134997 2916108 8939338 334329 693118 429214 2775345 480913 3639391 2970549 1316342 2726638 302217 5567652 7945459 1658143 146963 3171787 1738675 198222 2155695 354223 8726196 16759113 392439 5461714 297856 4115947 2882093 3695117 3909990 2292683 1342460 125034 98220 2275069 1256614 614515 1873648 202244 6773447 2619996 79527 1964048 51876 977825 594311 449131 12595521 860952 3583840 166817 766712 3573550 714018 3373182 198346 748255 137960 731732 12126367 486065 4256667 672027 1019594 216011 617212 3662906 1653800 1195892 282486 3446269 3316925 3743183 4153706 1460464 1866687 378570 132075 3728156 1519264 4653108 88842 3781150 4160283 7639615 288512 988047 11598002 3352883 781862 965096 3905245 CAR(2:0) 5322 3686 31027 653674 111235 433445 5050 449475 1261 301548 3110 12237 325268 436287 663 2078 2356 482473 4423 532835 8047 4732 270878 242252 684309 4194 174419 21242976 239796 321701 14044760 3941 117085 4926248 1647 2473 11131 674591 40618 37233 98 733 396083 2447 226391 3642 41807 25465 3395 322076 2550285 2027 3515 23614 3530 2968845 139105 21939 787357 25261 18385 8293 2188 1182983 4268123 8063 25357 60 46815 1664 317416 278451 648 537319 5349 542151 503503 247666 2375 455531 440383 6715 44776 2130 3884713 11015631 151 203659 2274 579777 53571 340825 187123 4933 191 1434589 3081 980 392565 10468 4898246 886382 2551 113 409 1716 22809 880 7930206 365649 324004 472 83981 577047 9371 702539 38627 48928 3139 29307 9357696 46170 3381724 2165 204664 2921 29876 538210 353 131787 2259 319461 454985 83341 280384 260316 30470 12889 1743 1219748 69914 51255 1915 193625 344300 226890 8085 10763 6382777 1492881 36566 69400 336928 CAR(3:0) 148 296 29499 35364 23192 39258 39988 341 18860 69 72 32924 67130 298 1117 355175 7732 40927 1658 912 39277 38907 119265 99 39018 11182 20993 830758 121 15865 497513 50 454 37347 7656 11432 239 95363 71561 15660 10794 21009 339428 509 1172 5630 285688 37449 4724 77337 149 973 2188 774516 592218 3148 15000 8288 19626 70661 57305 86 64073 97256 246645 21736 41350 9928 123 789951 844534 45966 173 72696 22876 36582 250 70515 811 332 9612 77 448575 60454 101 81 11077 744569 30775 21672 15186 111389 277 111194 357 14029 55 678823 10967 258996 10894 7767 95429 33113 17622 82100 16010 48648 43616 553 215 92 149155 10160 570 30809 53216 43908 464 164 537648 178571 6835 2953 19770 CAR(DC3:0(2Me)) 3 8 1145 10806 918 3926 9069 24182 395 13080 6795 381 14 27 7365 6671 7916 2392 11099 9261 4936 4 1402 3256 26751 533907 2087 225024 18737 9274 17 4 11875 9422 8166 26761 4 6853 65 22301 9768 13944 131145 9766 25993 15486 8060 30403 50815 14920 9049 62 747 5449 77595 5 46613 9188 4168 5598 9574 26307 8180 5726 3086 17958 19382 902 3516 62545 64600 202606 2555 7615 9926 4185 28554 6064 3667 25296 1 43 5808 43570 12200 25529 3576 17570 17082 15 8287 4828 185108 4838 28238 564846 25866 2502 9003 5217 43 12617 418 643178 92 48084 90774 17623 288 59003 2 67620 6317 3446 3702 25541 972 17929 11031 2884 1532 17515 6829 8909 10141 48 20924 8350 21909 459692 3 104256 118631 153039 28653 CAR(4:0) 1717 1643 5637 32787 48865 40230 1068 431991 593 79513 3474 360 110134 117974 53 256 1068 25738 2837 21330 9016 7326 51338 47749 77827 1604 918 241033 24733 87567 2103393 2110 31096 816769 86 43 1500 62188 45288 43274 32 477 128310 63 248842 299859 1355 463 80569 779960 50 751 157117 13792 540944 83840 21739 66966 1258 229 2186 2539 125167 593746 10751 31663 5460 1644 39 88552 77222 2 85182 1377 115521 145256 56304 715 27158 27547 454 89913 441 881196 2407750 14 76738 168 80201 973 91249 78089 43 37587 1603 49 56349 480 768266 24306 148 7168 992247 1269520 85418 18619 95237 31 109631 3762 64517 48 169 1315447 353953 478870 508347 276105 116823 6 33058 82256 108630 194934 198145 87132 2968 1487 87364 8933 2330 89337 94723 162255 900 938 1326132 666325 111086 2703 83208 CAR(4:0(OH)) 156 8906 8009 14012 8347 5321 25 32077 3636 14088 9830 7636 5969 6695 291 4482 2681 12047 96 165 14882 4503 32887 345755 18191 58211 13138 7863 10941 11892 8450 8073 22580 164338 32588 47905 54704 31901 36318 9596 4562 8150 89 25513 64069 43673 370 310 321 34583 6023 5781 7371 6872 7830 13907 5336 104318 88125 217998 3777 10900 32656 3257 10024 12972 17382 46389 15038 53167 11592 44 9766 7785 181119 112706 832514 33579 22913 13126 23445 465073 108426 179391 55470 94491 84048 11772 2119 32308 7886 10689 7922 5807 18089 20781 19706 4822 6398 5764 201598 205515 269297 35928 CAR(5:0) 169 94 28029 13024 27316 23341 169 56271 51076 1104 85967 88904 120 14066 15903 9417 781 851 33873 36631 25012 36 56872 11099 57052 307406 37 15776 292756 20457 57961 57713 174750 46407 169 326031 164071 60864 76 58709 269070 587 3958 211516 48871 293652 34410 27442 26752 19864 938 351812 372229 759 18270 21604 3074 59979 37709 14455 85988 150841 31025 19684 14624 403603 313168 326338 41678 24830 1166 63520 36870 4971 14087 2429 18134 29374 12762 340502 16044 2181 33 1427 196316 584702 701222 55305 65951 34916 65371 121 390800 303 701940 593066 243441 288070 204011 74533 32631 54711 34816 433756 107194 32109 2669 147 57519 24153 18264 82114 46893 183166 3169 246629 176785 181765 59718 CAR(5:1) 9266 6417 1924 4582 2003 4829 1263 79302 333 4325 2526 9232 11976 1889 3735 1025 518 209 6480 3401 4513 4378 3355 2298 2881 2248 408 4805 39927 1328 311 14521 633 2145 5078 3521 3243 7523 2260 3444 1695 11881 12371 4842 10894 4113 14060 1704 11287 10977 268 1914 3372 13291 11118 11034 3296 2601 5732 5042 5973 1114 14413 18717 1659 5590 960 424 849 30307 144 31775 22894 5842 229 4069 5321 5681 910 2605 2831 3798 142 6050 12218 298 306 819 65 1682 4989 18608 42432 5013 4184 6333 9306 647 18319 199 23036 24303 9576 25518 20124 7113 2317 4896 3664 13585 10605 3220 3577 3531 355 10548 6773 17204 2740 291 17957 22014 18165 1309 5184 CAR(DC5:0) 1017 2605 16832 4410 182886 4457 406 580 5862 1045 4348 551 5377 865 4175 2960 4630 12377 9804 11272 4543 2030 1848 10887 149 4902 258 13784 5250 18347 4079 2663 12294 6354 4968 6071 698 3339 593 9203 526 8061 4055 537 4330 10270 8730 3087 15374 6782 204 630 3166 22697 15150 13127 15304 15915 5108 13207 2077 2881 2702 8292 11074 5085 9781 5017 21121 455 15353 27986 5319 59 6305 7129 10962 17560 10958 11443 6390 190 9359 11536 2964 1608 1211 5099 4293 1851 574 5364 2652 4158 3966 50926 23790 42365 23421 36573 35191 2152 7571 CAR(8:0) 8354 60075 49144 58608 70294 1375 3240 220328 163972 37011 192 26831 155228 152156 158734 43966 39088 2102 199974 362 175139 44179 56863 17411 12942 30858 63521 26005 5407 1378 65022 27223 19125 42551 19840 4799 38507 6652 201038 19192 1299 1592 49138 62919 92553 114336 9806 4402 21207 108101 204177 172479 134348 164971 1761 116666 2380 6045 139278 16823 61283 21995 3892 14135 22181 243711 115134 1390 20453 184656 111231 110173 146569 83767 59237 46824 15666 179243 23688 965 95798 62563 89746 42591 132874 13412 19057 71290 112305 103344 154514 147218 139306 1674 CAR(9:0) 192970 73123 226816 12092 70687 31946 111897 1281440 740535 24275 46559 15547 659577 1108554 168368 21621 4875 32795 98908 18390 34994 13545 91566 55551 842168 92576 760388 2750 430395 247573 231 32712 171383 65 237513 72847 13924 39046 23944 21189 213 3857 1253 47 38031 2328 485048 608030 33559 112663 42 156073 694447 1488675 20650 32742 7646 156140 144493 29863 626103 55 146025 32151 381577 25357 59969 17193 171750 27 5740 313 38280 15873 107434 51487 679467 927 397505 669111 31809 8564 690717 291199 423536 316862 208 165 75198 498537 19645 242289 172097 690606 315088 32345 122232 2609789 1420465 104642 65883 96025 259073 817504 228372 2053137 33063 98623 214561 170 31494 CAR(10:0) 30005 124993 61737 57355 155 84849 3911 27027 702343 665683 59691 2325 65015 705831 492413 555006 97831 88549 5126 298188 2771 446405 228305 56316 26864 184391 155886 164541 30749 11817 4463 173640 23 14462 7059 84190 60455 22853 132175 1059 13340 2088 60744 122303 80713 35542 3686 222210 336311 8 335993 460537 18574 7 18379 59388 20 84216 298639 445322 337471 449525 4696 440767 7239 33418 280533 35714 404 173100 77350 57816 28 40646 95764 398632 215957 3808 23 271389 1646701 749051 61280 208 372746 123479 235496 20 135026 99933 664363 124294 4839 852116 372792 376326 259603 955461 57993 54526 444690 466737 759014 499217 266423 81735 3216 CAR(10:2) 3482 658 120455 64127 77876 39488 75782 23708 118799 134482 138138 60 471 464 115644 26231 61369 1734 643 103327 72980 82627 779 656 42613 27195 25772 127288 10145 113042 270 223 65794 116340 106292 113470 376 51743 494 99865 833 48680 47784 301 22484 143990 246776 60693 33315 40591 34069 64179 7110 20073 1908 407 29715 8823 589 18430 27908 14 290 23808 44555 127168 440 384479 486127 20862 28100 44389 324799 389 189773 114208 82810 588 103465 40 24671 76825 52479 565297 112 151 179993 80634 121690 54825 89789 79 505935 8 98110 98446 158832 99434 24247 1720 151802 175517 8 114805 178513 637 1859 98680 103169 36101 74654 2975 42695 73419 50 11105 15243 21933 132625 64189 54879 23320 451 105496 45784 120696 71 54627 20518 147548 433 48463 80885 90014 21915 CAR(12:0) 45797 186845 89510 34991 80204 81128 26028 542112 603315 66050 9554 88182 798639 289555 477978 54676 99251 87633 217316 12885 440396 363460 54628 38036 187456 205584 130517 33304 113395 92259 433700 67161 46645 82865 49076 41374 126046 22397 45052 8332 52268 48892 168597 141708 794 1868 84578 405430 477679 44 673675 551348 18915 31763 88169 229817 485309 440317 447879 506024 959 92828 772850 15633 13334 685041 59574 12911 127094 49101 112644 27858 178098 64 271870 161158 86383 527193 1593419 1151602 60536 175370 61861 141454 110128 171974 1295250 178335 84465 969546 277796 177700 261147 4637 1030358 42553 49133 1381320 1535969 801939 183278 141579 60140 80352 CAR(12:1) 44115 139061 114238 43564 50446 10441 49515 396557 292897 54018 7900 61461 312723 140440 236552 91531 55544 6316 243904 14544 448359 215026 86243 79578 91899 81060 60252 34139 41530 9585 235511 103281 45480 111779 47248 40801 105821 3134 28519 6199 20074 22850 23149 11349 77 8677 81353 150803 187638 166756 11642 21776 75611 238009 346696 427310 165750 220038 7536 246622 21471 55745 129338 109305 5091 171352 65444 60368 60185 99181 226957 157526 6894 162603 492310 503390 121969 226326 145113 186252 204186 185450 258461 56902 277 7075 337777 127670 79087 79299 269810 33919 36489 250482 296240 191808 268 266146 138573 108955 7176 CAR(14:0) 719 27305 106177 53993 17804 28261 136518 6626 9605 410724 561228 77685 42350 4453 20813 4223 129 700845 174407 365325 56 21191 62822 148743 146383 3935 34595 335554 27826 188332 30619 19934 125758 136819 132746 20016 104047 149495 324119 58373 80198 98542 19913 30384 93315 18729 51337 9898 74325 18891 105828 137022 83807 11464 151506 287400 59256 482537 1147 808478 495991 22572 34285 30864 139570 493006 408094 135 294255 13420 296093 270180 159504 550690 6771 7892 101 242283 31123 2085 37394 578 55065 18374 25185 8020 172235 17978 231211 67516 160171 22051 437918 1391387 4296 1618466 5935 68003 111097 52140 113874 10916 60604 791 121589 1696579 86967 248228 1326 148536 555244 394775 181290 157998 109153 3197 3053 412349 20287 25300 1554 1547512 1344786 581536 318 65 96937 108712 47747 74 147390 CAR(14:1) 59152 227592 102251 27220 61880 54492 18048 308 167993 177062 403 68896 13159 42034 373457 104970 221993 38952 122070 58654 141534 22968 628744 4382 539034 73013 58153 65730 72761 69180 12799 45682 56188 314445 58635 47696 152658 73909 99294 175939 24502 155584 9858 36706 17030 32620 41811 2405 6293 59886 123792 8719 290901 408854 262381 41286 56755 153506 158439 434860 677648 168524 1675 201524 5110 61589 319747 12027 30737 280312 40134 104 24818 293 93048 55529 46137 25547 146392 3416 268373 80621 59602 975 176946 827762 50 859285 60216 174070 62028 253914 5473 95969 96093 471323 802 89101 55676 401107 189103 74128 81642 8037 1499 1467 319285 44163 60426 522066 554969 236612 201682 125129 40937 58626 CAR(14:2) 97109 466673 167770 57320 125000 9787 37987 126841 104483 63322 7095 65838 360399 69792 336113 76806 123874 10841 180603 10767 1062356 481045 99928 68606 61749 74670 43411 11835 12401 10250 361056 31497 12748 171679 96254 110029 251246 17112 104797 2793 7932 15898 13636 13559 2000 10730 123034 827 232517 343081 197564 40432 49715 185079 92299 357842 657301 67826 144938 10050 140437 11806 40874 254247 24705 3149 168382 144626 81487 79537 85687 338890 103364 11639 53 135044 569393 664600 47433 279436 51941 289478 48 120142 78728 326795 59373 11247 375510 117667 37031 86284 334382 49896 83638 392922 719658 106736 926 405177 124255 36917 11096 CAR(16:0) 23919 6017 107470 241125 236191 97434 2098 22834 82 266458 26784 331711 568387 871231 608766 804 276 132063 26411 71423 15812 2789 1076859 564679 437205 245 100797 151365 277915 446753 50207 91524 424541 138610 4545 241757 73592 50417 294066 177 264715 842 375778 637 12841 326348 342 280967 270797 6941 15534 43784 300260 249884 93060 117406 457994 18120 117020 24067 302 497312 132557 226 334928 283006 298843 61390 276509 237790 649077 703285 49516 1198764 1062631 79931 5 65307 230438 55 141196 625 738019 582955 127876 787915 70002 337379 1044711 268108 1122790 1699 35566 12049 434 308501 42303 51533 91972 2565 211985 172199 1441 30138 503 16021 520732 96080 281186 73092 294547 254279 1200068 568435 1336626 18931 126573 3927 9876 287081 104855 284066 75204 192438 23816 409394 2255619 929499 359739 6639 276795 703766 377827 369435 141776 325022 11337 40555 385331 78455 28677 10299 1329284 522252 1164347 9258 423 222935 438041 59110 221 286220 CAR(16:0(OH)) 1700 4088 1857 4004 1045 42 8570 5537 2983 3092 16912 26933 3968 3586 1596 1943 19458 16192 8503 2714 5485 15551 739 4858 11742 3384 49 5373 4269 2346 10395 6583 16792 1509 12866 6289 7827 882 7509 10903 2619 3152 2937 5265 581 2941 3642 23290 1662 4809 3711 1689 269 5768 3778 4634 8475 17530 30859 7941 12678 1919 16721 32609 13289 28909 2373 16313 13523 5180 32642 5855 724 5308 5595 976 2041 296 4209 2248 10975 1334 20136 1335 14203 8940 5565 1088 31740 19248 26827 10935 9428 9408 5909 1020 12504 750 16405 43893 3985 6097 5963 25644 20493 12621 3639 4218 378 19598 2878 738 25134 11996 47153 96 8934 18272 11826 4337 CAR(18:0) 637 14390 21146 36028 49436 4220 10829 1656 47616 10062 60958 130554 179026 112624 18253 9025 20638 196386 74558 108031 5136 1405 50022 42512 45423 183890 36322 39186 94162 49940 459 6254 47418 62612 23949 71658 81178 221 78101 2382 7535 115665 4771 47090 81727 32482 6070 30370 128724 62706 32544 27669 56418 7404 18580 24540 189825 59275 83889 70567 51093 45025 46645 69294 84852 147539 36291 207573 186649 38463 987 22567 41642 70755 21575 219515 170293 50734 113356 163481 100074 179203 51559 212396 9889 643 36393 18653 41664 34609 6084 50512 21087 11346 1974 7939 197216 20499 85450 36688 48023 41990 293871 118830 16584 197346 44002 86867 27446 69022 75016 46323 71765 18218 44824 16119 142495 241748 120609 49970 14925 43808 135525 86856 80914 27921 33372 6360 18024 101640 65792 27589 20934 175881 73107 178650 91069 791 83343 158476 50390 375 51786 CAR(18:1) 106398 33768 1989511 5923224 2623867 1043537 6987 1587665 54586 2467060 663850 1628352 5906562 5712650 3071616 1775361 712863 1843239 18754 24824 8398266 1567360 5914961 220642 278460 2376304 4666996 2396154 6989554 871599 930200 12798060 1235214 13770 4887 25012631 1417480 1748193 1147612 4530 1752255 10373 1076068 29488 207426 2530726 7219 2508139 6712736 355627 225305 391712 2442577 7293791 4869450 8030432 12047469 1066501 5755939 283761 3209970 1544674 2003908 1802330 1423722 799404 2329957 2995157 3518583 10098943 1010999 13373149 7236789 3841159 73470 1439668 8917455 10593 1387533 170128 14560470 21493812 1559879 2760248 1283585 3528809 5908458 2499404 6182684 53413 766988 76411 44186 13362007 355808 506240 1312848 152674 3116402 3818358 4970 434286 130487 419794 7029097 1129852 7046182 772815 2492450 2484896 11138076 13512121 130857 23712314 760507 1927804 96312 293813 7998629 1239761 10229570 1003742 2495980 261752 5148332 22665164 7117887 3899735 82029 2337052 7771279 2225889 1176089 1454418 1076791 156214 1869405 20285291 2210262 673962 857316 11274455 5412404 5288519 354684 28739 6148846 5782789 447191 23564 2321154 CAR(18:1(OH)) 467 13851 7055 17906 4185 7628 2538 17447 1341 2455 5202 1560 8145 6712 3491 12808 8931 318 2907 32957 4820 8372 10844 7094 147 25615 22114 22073 6084 1394 7801 4570 10269 1717 9893 22165 7021 14945 9729 16897 10984 28768 3748 16399 1174 1014 6009 14328 7815 12823 10204 8528 21843 11461 32495 72754 16320 12653 2667 7568 18809 4796 20754 2805 10469 16179 13108 856 7573 7304 10677 17049 24635 11865 47206 9110 24174 24253 5717 4641 36206 21240 390 34153 22907 9466 16333 20678 6945 24756 4323 28995 18041 2785 940 5663 7308 8682 2403 4388 73637 19109 12258 17893 7475 10393 6028 227 20687 30540 20045 5409 CAR(18:2) 304 90708 516356 76009 42995 51218 89038 13152 11979 113284 145508 27384 70255 17150 38485 1712 234981 23934 172783 2413 890 44737 155926 93922 170623 14420 12662 793988 11429 596785 19765 21419 53154 47124 38989 2102 62700 93970 340664 605 2120 1063 43256 267626 110881 170330 613330 13283 181704 2996 41938 23450 25401 28513 20101 12978 87992 110870 61961 276455 1060 512437 227820 60932 164 26674 321652 39560 307126 793233 4012 64793 4693 117401 108502 95001 157976 8499 169 582269 4843 2354 25047 155104 243380 22063 1348 24661 277666 37740 255422 22186 100867 102934 349766 632370 966567 20467 23329 306064 15256 365662 30470 66461 153 103115 768018 113124 105302 96729 339164 51194 11842 69026 19045 1123 27546 332273 31599 14031 6304 490216 688403 161582 2143 318704 197334 3496 99062 CAR(20:0) 132 290 4391 317 11334 4100 1889 5023 14733 357 2865 10581 32566 6423 6856 3290 220 172 676 2275 117 7751 17973 17369 1158 8419 1007 19236 15405 11065 124 8551 432 18315 22683 1198 142 959 325 132 5625 2411 6762 741 48242 2624 4002 19521 11797 7275 899 4141 898 3032 3032 2114 1482 238 9290 33023 13004 22782 13712 21029 13979 9084 325 216 683 5269 5194 5398 2182 364 308 19820 400 8920 10069 4118 26051 409 49781 29698 13014 49496 520 4329 2320 3084 5165 1059 21174 6966 23885 8267 557 4334 4686 2765 6739 3826 5300 1022 10833 97526 9902 4176 18102 18515 8798 CAR(20:4) 408252 379630 16045 951882 144032 624113 37352 693100 620057 292847 1337482 3213313 1602355 69701 115 621056 1465884 17700 144760 554171 744497 1842948 610306 1729251 3288 665819 669823 3718976 867400 545497 23317 28341 7079 338729 1196188 121854 377063 1600587 634230 93745 1497073 1018891 649105 2829468 293299 1125808 78536 595877 89 13147 4379 2035 614754 40050 345709 315843 1055120 7237 877 618905 3212454 50987 3941914 50823 4721097 1677358 2569 3249736 410402 160899 762 1055923 645128 231033 153710 81447 830099 698 307568 1289774 2841 152615 610164 LPC(14:0) 731 24471 308 2237 284 10867 968 274525 189981 368 2211 1442 3771 396 62230 157831 60342 917740 1728 6404 5216 15755 44505 653 66703 3997 15411 645 21102 391 492293 6 52611 100 26825 1372 14752 14162 17321 24011 111 17496 16101 1839 278 23027 76183 45693 6675 194 13894 180335 1021 1140780 107 89929 89930 213 152 38044 6138 10681 7132 71808 108065 2091 54682 430 491182 1140 18851 92836 19293 8640 60543 5370 367 14587 16024 2098 159 6424 10170 9852 2740 12366 2541 91891 537728 116 165318 1202 24739 7787 1807 9620 136 6481 935 967 684 2193 45097 1629 54290 301 15694 373714 351 49897 109558 882 6853 291089 408 8621 106591 93569 145854 2966 314 11643 9131 1670 90484 14086 LPC(0:0/16:0) 584460 163534 582487 8282935 81359 2845982 985985 423376 140125 4292758 1157193 1927582 35405643 20023858 1446518 20534 288844 1420386 634616 11451362 103057 38439 7470276 4232236 38541953 111797 760824 4706263 3120460 4150254 7369767 16767 1252326 16505657 627311 894412 117422 8484852 310287 1726750 2433095 358335 25935459 40144 5818603 19110 128966 3762496 87833 4087157 6323065 74006 81966 573317 6704767 6396935 448113 884258 7874391 1750086 1542779 536944 63878 2055777 946422 7508175 7393803 1554726 580503 3824838 12156008 1568469 49692126 620344 7842342 11229494 1085105 21540 175761 5406095 8782 1724468 187625 4793798 15305431 81775 3594903 124908 28490894 297702 3493078 4720241 84530 596063 87249 37345 5053283 1272295 580913 447252 518083 4598110 4755666 115634 134241 207033 506347 3908783 453292 5374032 373530 3468300 1092601 11010327 30616640 59484 10978749 31264 4903199 63421 532037 5386492 619210 3987838 201694 176565 92227 1702346 5045569 185426 5020203 46913 3740517 26437757 734497 5911589 11334395 655582 104285 514995 11884820 778435 43523 469122 4577862 6042946 10245398 23039 45950 1884971 1339102 943769 161532 2903888 LPC(16:1) 99459 24176 16469 226 13989 346681 215385 451 6297 339 231596 163594 58346 1321754 1654 32413 68808 16398 73122 2178 214327 325 147521 5423 12976 101 603223 54566 33870 14644 37083 204 28858 53893 1635 107166 440 7652 17935 3445 97232 89728 3468 206 13859 246637 916 1397727 66476 108867 606 113205 9475 29227 188492 34507 737751 578 13281 42071 2196 89522 3683 43800 30023 334 27822 4393 51334 141 10864 2708 160234 831526 177235 25018 26066 18271 3213 39486 38694 14583 314863 45960 124504 501 125825 348 49485 62071 128971 13040 4666 617 8242 LPC(P-16:0)/LPC(O-16:1) 379 1376 22866 13193 2380 2699 1000 19768 106 11077 62229 97754 5009 3111 3351 22573 9986 153 394 86780 85052 114 21290 58607 8836 123151 6990 42730 1767 7017 8211 95 20869 21222 3349 57713 21263 59207 414 229 7022 51013 41998 5631 26674 1181 2887 10059 395 29369 10169 7473 6209 3610 15899 27108 5214 103443 453 9142 2898 30897 1411 10840 28132 8473 22641 181223 98 341 1062 21847 1920 13478 27136 1936 19127 1999 21052 4147 2954 13196 1996 327 118 92288 5397 31140 17829 13574 1316 29429 42432 406 16433 50764 47899 13538 125938 2712 2709 577 42513 2905 4191 4028 140 18329 105146 17298 4090 2278 36478 40933 4366 33678 4436 392 15273 19272 14275 3173 11668 LPC(18:0) 69529 20878 83202 844738 15314 466680 338259 101685 58598 636320 356952 561488 6351803 2802212 236678 5154 16351 120854 68386 1482167 29888 11974 784546 418043 6833225 38896 356482 827899 317508 716677 1387323 4137 222575 2352443 144177 113255 51885 932816 70990 254737 798689 9269 5830725 4006 1031527 5781 66176 611328 9409 735991 1129568 41020 15156 221960 962857 903639 188721 155048 1355455 141202 185270 255523 38257 383502 287043 1058715 762164 176230 307794 650412 2236259 194713 14156159 372537 872137 988598 204192 52201 112472 976691 43481 422847 162781 786634 3390223 50080 591399 59368 6883762 106007 764126 848098 48847 178144 23948 19387 512276 256244 192446 124131 129436 739245 655517 52229 45280 63085 181592 674733 150055 845865 256870 694401 99639 1277111 5766003 25921 1492381 13535 1147542 7297 96763 864403 202664 693759 176465 84087 45701 570578 417770 36747 575822 14488 711714 4955495 157126 536505 1670529 111387 42365 131867 1400609 244033 37801 86330 651794 1149093 1222218 4735 28869 365940 238938 327136 52173 654838 LPC(18:1) 433106 209857 70956 327673 29737 160144 371473 112256 105435 285646 1743606 139431 877529 557213 26565 7689 313530 223567 187204 1592781 14010 4389 267177 106354 2685175 78660 2039869 1459156 265430 248743 257365 38833 663988 8255 270141 62004 464260 2145 72396 69434 64066 1663206 6875 164568 974 4222 188298 57647 221056 244091 2135 15488 13860 175382 152233 54527 2117407 1148721 1022854 387196 18912 7007 132512 31602 298476 240471 52407 217156 202310 649618 37040 4876581 816933 141311 239055 255605 10785 173878 2164368 1046 56347 46123 143770 753918 6084 75703 17572 1153681 9905 178804 93700 19746 231791 29960 4079 841137 28643 27650 18874 24887 203212 474300 31166 53924 168897 43416 113883 50510 306334 29626 168697 431837 392106 1664140 3555 414841 1150 157343 8255 379031 168801 23152 261697 18365 17561 24990 68558 100139 3512 100499 466 205193 1045122 9184 136336 552923 6288 36312 410331 2298813 75315 33737 73878 103967 353464 286329 448 78494 43523 22574 8818 140556 LPC(P-18:0)/LPC(O-18:1)_A 2301 3984 941 1818 653 1021 986 19153 22485 89 7048 22944 73040 1920 20901 426 20540 1513 6436 611 2878 37731 2790 276 21461 1563 8126 95 1948 13180 11721 7380 8162 854 7212 1119 472 1225 1335 2601 18878 1592 63156 3325 887 13068 764 6667 5237 785 4047 27174 2205 434 3646 4985 1397 1852 339 390 208 15907 515 4461 2389 1042 8152 13286 609 8399 12536 4622 2519 33545 294 136 6682 714 1726 9989 1820 277 1329 14101 7755 1644 1142 2599 2267 100 5923 3209 581 LPC(P-18:0)/LPC(O-18:1)_B 1392 347 942 2241 7738 13821 180 3985 382 299 16020 15780 686 3938 9349 7503 380 1559 2693 1848 117 4220 603 7242 3498 5057 423 3321 96 707 127 2516 459 533 5055 24454 2193 426 4542 791 954 124 19612 3040 192 2140 1531 2347 1363 105 12754 1205 2265 239 296 514 2358 834 2173 3018 180 7714 462 2227 13065 2245 613 4278 1775 1793 626 125 LPC(0:0/18:2) 3977730 700910 2152759 3921105 100210 1102005 8224210 1080823 628084 1758543 6449088 630436 2638337 2121078 4904 387658 1889116 2013987 1558192 35615271 108969 126987 2186394 1114603 17152306 1071307 6547256 27444943 6287767 1999283 2579617 118007 5184285 2873615 1123271 13313525 1140887 532107 5385640 30243154 215674 1692317 312708 2108783 2365681 1939343 1282826 112630 224994 684870 1428508 1278278 3348835 7655960 22793952 27812283 12588638 27260 92625 1085613 56375 4293247 3901595 314562 1767245 2022275 7117027 28649 46001072 3931868 645323 1513652 2839831 11461 1151504 35666822 60714 225276 557288 1006163 14288488 823120 665778 398607 8982094 32184 1691339 645222 1664624 1961324 552351 808531 24526181 486216 642218 249215 799074 8724987 14483653 947364 534782 1027714 790950 1404629 1310430 8653504 763125 1755329 9440025 4408935 19248821 2004804 3808141 13778 3258602 1534613 3406804 2774507 290046 10802387 444875 862443 98310 1526828 1075535 613439 142436 1730600 9633588 1137344 5219664 401565 4754693 110514936 503579 553552 871878 5093979 3349056 319702 94415 859881 768769 101413 116283 1781098 LPC(18:3) 10732 3682 176140 625196 23662 2500 2928 227390 30856 48286 1307849 1065339 115884 2011 58601 34186 884682 385 362028 126357 1417021 10481 45942 597952 244170 227519 250984 67249 1104271 5298 26056 664 629582 296 80610 47767 19517 962771 188 437631 3331 193715 318 233270 615218 158 9 38094 174933 608611 11511 23491 256557 71336 140552 38470 188112 138173 550492 665349 117931 36851 198388 1026665 139710 1253057 35241 546431 551109 114021 225369 2776 1481 213846 877484 5064 366314 7169 1214457 36754 199645 386491 11870 15943 1797 1979 230743 39944 81141 26809 35583 463152 214428 4457 156 4820 6560 229997 82731 464415 2071 190125 86572 807357 1039614 983893 170990 2906 14793 422528 12108 150542 16479 11351 106309 308918 15840 861251 490 215551 1170512 51330 193652 921637 84996 2343 22727 719902 25986 16861 442662 702465 715649 406 231229 81885 9755 5366 202588 LPC(20:1) 3808 914 4069 478 504 599 988 21641 2419 10842 2430 11902 3095 1436 18734 30553 683 14762 53286 435 2200 1987 92 5814 10441 1386 16336 899 8435 1924 1117 406 2018 290 1860 1320 2577 8906 11926 27075 184 1821 2007 779 1243 53268 5360 5409 2059 9483 140 368 10051 2891 527 9694 472 103 5401 736 455 2189 1083 804 4177 383 13002 362 1367 6757 849 215 3871 449 2396 389 922 12332 927 2448 35217 2764 531 627 LPC(20:3) 207 386 23674 6946 58953 326 7741 15189 2794 8622 147065 64190 2472 11059 110308 15179 7684 202773 1666 30107 4754 16238 17431 3134 119470 3088 1241 48779 5267 8974 1575 173 136181 19253 13607 12978 43951 135 71 1805 6719 61141 231368 46762 28241 25895 57753 4067 11153 9426 19250 26184 604 5780 11014 54402 857 369530 4000 13241 19665 7733 347 2389 22412 3705 8923 100228 8817 136926 8718 11172 181 3708 122 6692 207 3444 248 2615 28180 14096 2932 149 70158 4912 21862 10120 28934 29256 158261 893 36096 12348 2147 20590 604 20407 2217 9475 6648 29267 11213 123594 18361 23407 42868 12479 4138 35653 3893 281 9186 6599 27493 48340 11368 1351 6964 LPC(20:4) 157857 32920 4747 103005 511192 52287 39274 22455 287932 620248 40505 776060 631985 1572 2839 37831 107066 125332 3362895 252003 33403 3130072 7602 919617 1262253 261152 171531 140274 5119 1725018 137741 844996 53596 6149 2677448 124168 137108 152775 502918 95583 349852 245264 1213226 745375 623639 246244 13370 171056 57815 421765 352827 22413 87652 144681 1247069 12740 7609903 635253 133622 225714 384807 1815489 13715 73119 1477702 144387 1631640 4368 109771 168582 38464 3385 695578 20031 399394 224410 2245 4942 38934 10521 123706 95228 756005 122730 367299 628279 3412557 2648 742503 14598 3150 43350 271177 244786 2506 3386 8606 75385 327557 22921 118602 2004037 4751 41414 978036 2117 1993 166102 2229262 139891 731297 386125 38452 189998 3334 108913 LPE(16:0) 394039 187885 365412 66441 434194 90998 269832 272460 230579 613960 282598 105420 217664 247253 614761 50573 115343 67452 1295175 169335 60314 88029 9761 39525 437503 154719 200377 582345 61399 630755 833471 339094 35132 107441 753322 995948 611276 66119 157290 215364 137444 30270 246110 11171 314225 52697 94045 358633 99444 642248 55108 134420 271354 147604 665579 71225 167939 147213 136384 346564 626031 132677 14764 400611 3101 1670 270630 167265 591466 205203 639392 129549 767576 1270539 475919 13728 66608 351287 165552 130337 225951 18318 537985 424326 409393 192152 226679 17291 318679 172581 266395 625684 6240 5548 283631 315487 131467 133038 288444 92650 98953 153254 141483 92293 1015727 224583 941569 512160 539724 453577 219887 93072 620254 655852 180388 317340 47948 90820 189161 185298 487055 403188 76739 188733 129532 1004049 259644 1058018 310746 320356 67751 301840 112815 614924 397306 444423 149827 142486 575806 311116 754018 557249 282635 226505 750830 15703 121256 308677 193731 145059 20445 432609 753048 109073 626008 LPE(18:0)_A 27952 11194 15652 87583 9868 131501 59954 38132 11105 114256 74997 71552 176966 108744 9625 3237 3985 14741 29448 263845 17918 7682 27595 14315 867372 16041 18844 130241 41552 108278 235517 1291 25840 306464 17683 62757 114691 66405 10446 35474 25984 992 402633 1193 37196 4355 22949 88112 5549 121216 117295 15086 11810 41386 135151 143450 37294 7516 116193 13384 22192 26939 13750 35200 47203 338 82178 64576 27009 83211 112227 282847 17504 3037544 36474 55448 51488 30170 17877 21779 69556 8482 20870 46592 35758 192765 8394 12336 10250 259754 7021 97837 16296 6230 17989 6007 5787 49126 38117 46396 19998 20717 140211 84535 99298 13705 76300 50042 58838 29813 128920 29506 96490 11089 75916 286958 1725 75199 15632 107577 8391 14031 94122 15731 110381 134400 25610 45021 105093 20519 1097 23967 4678 94525 470584 20297 31128 167684 12064 11442 76603 157836 33576 12651 32370 28985 112527 51523 4574 4411 51438 32252 46763 10908 82341 LPE(18:0)_B 16523 340 194 24561 10290 828 712 5223 24638 3183 2745 534535 264093 28050 1707 19110 5006 6693 49884 979 162484 82333 889141 543 8227 8168 15623 24083 38158 4471 127328 5824 2277 12353 24771 2974 7368 19035 367835 70594 241 23980 175 23439 36751 276 131 28404 43846 1560 1369 30173 7375 559 12705 1972 103727 74284 12145 919 21917 225007 13706 907634 228 127429 155982 3097 499 698 12866 534 4676 619 38855 101987 50663 5681 290184 12713 16576 61181 640 192 5294 373 12660 5545 598 821 28453 14425 4376 1070 10221 543 21898 670 31512 1879 17836 3101 137985 517631 3411 163633 17979 2710 529 14647 540 11785 633 323 5446 60665 15504 53197 19932 324075 4493 67127 119477 25065 37972 28820 2163 229 39079 77928 81762 125708 5543 9529 5061 1112 5268 10792 LPE(18:1) 126133 72408 68357 9467 68713 20572 70271 56550 21668 68808 429051 23502 37678 52598 65072 3891 39070 20480 147016 91486 27753 18670 3278 5452 176654 35316 206907 172926 8726 67546 124670 59453 11564 38102 89247 99942 134092 12494 111864 80005 35107 883 99719 1721 67907 6213 13551 42951 30900 70673 18938 33556 61737 48124 96590 4604 42193 211327 74056 164677 100827 17353 8434 57816 730 1240 40853 56606 134466 68336 70954 57777 89379 749399 134791 2578 7917 94613 58115 102144 147455 3259 106527 86080 23780 34889 28357 3100 33747 40611 94619 70996 3946 59429 104997 13808 72358 22174 29989 29176 40750 18606 27905 160867 47308 185200 133310 51071 32196 36137 22347 69422 137325 24810 78120 100548 16387 54579 32923 43633 131597 9572 35956 15366 109240 18991 100980 52685 34041 22958 18754 27090 68061 107710 35670 34124 35919 94983 44697 188416 205381 54864 103993 82412 2960 60898 67078 13585 19854 2257 34905 48822 66326 70861 LPE(18:2) 45923 17427 50534 20190 37744 22031 117434 43622 1231 1651 69275 1833 3323 1345 1091 1527 1464 1447 13336 81972 1342 137 2881 2340 54296 2990 59389 189877 11573 1434 10182 267 18 6591 11440 48728 27123 15649 1696 15411 969 714 197424 95 1742 10831 976 3341 40966 6137 261 2432 16421 13264 33283 3518 74597 174671 201784 79724 76160 28 208 89 157 129 381 261 5080 7245 3436 5729 3939 81694 12005 52 42 4343 3360 3178 862352 10728 38973 25546 6001 725576 76582 19 56244 110322 158407 10444 1 13 189425 258425 24974 894759 1164 11691 7771 7208 79932 61158 55307 17899 68371 61958 279 19534 260203 1259 2105 131002 7800 14319 42266 3155 1080 17987 11847 30546 2090 110 12820 3067 200 6737 6313 21 230 17 1135 2794 35221 274 409 11553 10799 6819 40294 307082 5593 32093 10495 486 64741 4739 9166 14380 5125 2771 5189 12651 12745 LPE(18:3) 1591 6843 3 1594 1261 3033 5563 8218 900 3803 1818 1881 690 7834 1604 1258 1328 40846 1689 1012 480 754 3779 1598 66158 43948 2856 2485 24596 333 19 1324 18775 31674 16566 284 966 1058 178 7891 94 639 2983 6453 3017 701 1552 5450 2200 17201 340 1000 1580 1155 1322 148 3960 1973 17488 2257 3625 1738 26192 51458 10802 471 7662 4985 135 294 9548 7865 1146 8 3439 1945 4 5 6 5361 7850 4052 3392 5401 301 3716 2174 2486 27840 3395 22276 13118 10030 14677 22024 7 677 18012 129 15412 21352 1868 1550 2753 9572 1121 527 1068 27999 5078 31090 6107 6868 12671 283 3721 8417 6611 872 2904 13144 9230 27075 20530 1415 2030 9813 4 443 6825 300 227 336 913 1621 343 805 SM(d18:1/16:0) 2152 14801 59330 145686 27395 12148 16503 62925 9854 33530 185777 232834 6905 52725 5235 86720 899 4 28619 10422 421731 9504 460 52183 40169 74583 195423 266 60011 297524 41254 40492 15048 226914 25341 21126 34080 275 305609 88045 9299 25052 144557 7129 70084 332427 50519 12298 135868 164963 311490 6423 142 45851 24746 1076 16570 31100 127883 175795 47225 18457 9639 98646 75362 177664 8108 467801 122671 140462 57689 39187 4725 43004 61677 5483 13596 13729 91672 289066 4638 13449 9481 354781 2515 77923 19375 7138 12421 6913 1309 69104 54597 23753 36076 26321 93915 105815 22683 29847 39531 53105 122578 9599 387452 15354 67631 15257 34669 302544 19426 4507 111840 961 8986 226767 11812 277598 18777 27860 24139 84048 4737 942 47418 887 66980 435355 1944 20257 192293 2992 5961 38038 801305 95323 19005 42291 58899 310371 45615 302 13994 186977 93499 91192 48091 69878 1-Carboxymethylmetronidazole 2021 90 2163 2263 190386 1132 25144 1045 140412 1993 2540 1781 2067 1904 1-Methyladenosine 4927 6198 781 452956 625 140540 30767 92087 2481 4169 146 83212 2797 14121 989 68 488 51721 6631 126607 2103 438 218867 41090 192599 1760 3963 2529 482314 5652 3606 3729 112680 7551 24073 4647 348634 2188 4782 311 9389 102 420 146 155 1252 4836 16511 2361 271 3720 2287 230078 9751 68 469158 532 1997 774 2967 44362 248 4890 410 92 4610 46743 2475 26389 353 125676 3926 36 528 813994 31 689 1999 2557 226206 1002 20880 64 45313 1033 5528 125008 4377 833 605 432012 2808 87 1804 1901 189008 970430 1997 2659 884 2912 1470 51167 27136 4775 2452 217445 121656 376 5246 4143 157088 3501 712663 6670 1327 3177 245 490 146 7171 2371 5409 81589 8600 61204 2021 7578 154721 2401 1597 9328 81658 44967 4571 878 32 63051 1251 33 1459 4710 2-Methylguanosine 21820 19922 18151 921491 19054 192542 31765 81522 12039 74396 3453 122353 34189 31404 6404 5458 9626 205997 21810 790402 17954 10680 1071155 318959 911008 15479 17892 10169 941023 75453 43887 18143 2031 2375530 41682 43388 25830 1412888 36015 62742 3400 4864 814348 12314 15745 9870 4437 2364 12753 74058 1124357 14832 15425 27828 24406 1111756 59906 95398 995258 19855 3557 16553 8839 103634 1588203 10719 193046 2082 5932 6603 71411 691395 18166 604418 5913 1229603 56503 21033 14109 7841 1595786 18094 17467 12151 28888 817173 15823 701355 52651 847325 15671 73308 863320 4900 17955 11956 26760 1388529 10098 4273 8516 22133 1166894 1607877 13668 10387 10113 2464 967 9781 2199924 46618 70371 10166 58093 1179778 6888 797627 10084 3390 20283 12689 2068125 4995 665119 93339 8486 14774 8353 31164 3474 151074 9069 78066 477765 13645 75564 512877 11163 14090 25453 1025823 10079 25158 30481 1070238 450158 124322 18413 3492 1723136 54904 2561 8916 75480 3-Methylhistidine 1026 379 1773 3841 1401 5653 1474 5059 24 29354 848 97 1739 6611 725 23 1200 5926 1286 2910 180 53 3743 3509 4450 154 1519 884 1659 27158 7990 3034 45314 72724 18881 997 13 1205 605 1276 594 3685 1478 53 4208 4555 6532 19176 25542 27400 28161 83020 8912 71450 67821 24546 2321 1990 1966 6050 11675 18844 1055 30295 45595 1028 1969 165 4 1816 22749 3127 568 2609 10262 6820 4339 1388 697 7064 10490 807 2310 6271 139676 39367 110475 5384 6369 3413 678 31568 2929 47 156 8441 899 14092 5757 35848 8156 23781 38515 4153 2483 3625 424 520 30219 78110 80234 42984 28861 32298 3612 6441 10 6567 1130 45535 10800 226531 39723 95444 50518 85659 15951 129373 45105 5425 1703 1255 24097 25259 3485 2466 3624 1726 853 12812 1150 799 2920 18780 1198 3907 3428 4593 5300 55530 60808 46428 3516 25782 Methylguanidine 1263 1836 1275 18 457 297 2151 4377 924 2975 732 1131 1222 1776 4341 1331 1816 516 710 36 4010 7851 761 1114 167 1217 123 461 224 2717 1588 4775 2548 1463 3681 655 1185 83 851 774 7232 4683 208 7174 3623 5565 2224 3275 8371 2905 669 2846 3704 5298 2058 802 585 708 65 1143 792 1959 5593 2457 918 8182 755 1622 4945 2375 2944 433 3918 358 3608 1281 2207 389 1101 865 151 2503 2548 11243 3030 1439 4912 930 5346 498 6056 2767 924 875 403 733 2113 156 1926 2026 2389 2936 660 66 1109 1705 1603 389 1590 1357 1404 1547 3146 2203 1256 915 1304 890 2826 2228 5616 9733 1483 5021 405 2146 2606 7473 1357 666 6099 443 10531 2733 253 4990 2072 289 4883 868 1674 76 346 1777 1854 1241 396 4580 3316 3073 304 1936 3187 1401 2701 1-Methylguanine 28214 35726 26855 104185 31677 33637 19785 112723 17360 250415 5641 53491 61890 104116 7815 7030 23516 285381 26040 41814 16893 18158 81062 196706 65172 45341 43124 53362 288415 260096 130817 43503 6536 367869 25657 93326 50618 158787 63357 34276 69673 18467 89295 5841 103111 39441 79084 19644 50244 249159 371134 47588 52056 15306 16805 72559 101136 10700 363563 20151 8936 20283 6654 335726 319554 4738 67030 36 1754 42481 250124 58664 6863 56989 25564 239989 327964 152570 14836 53928 94195 21305 32306 22736 46086 89358 51382 85194 88438 65372 4133 238796 46911 18626 131228 16870 45460 183280 36839 157571 23256 18553 161081 132827 79516 24659 53358 45356 9107 26837 507967 66682 248861 41606 202825 91325 15073 271344 17023 26912 50950 33612 363287 54072 282614 126105 97640 120637 176876 130731 875 32224 17150 253096 33113 7044 90613 87101 4746 55435 112901 432808 34637 19349 101652 150772 40604 280073 26812 14618 694856 468078 44904 25558 241539 Trimethylbenzene 31904 48710 15100 10171 14258 6161 51482 16174 72360 24430 13568 17155 16947 14587 30446 32004 33695 8335 14610 9675 51139 45785 14173 11634 9276 23769 28570 21775 5322 23939 13353 27329 12413 10769 22967 28944 38520 29351 16759 10621 27901 33237 10805 44343 19526 27527 5785 16103 26177 24650 12559 20283 24033 16529 16704 5004 12028 14212 22826 23965 60582 10633 48776 9375 3389 40080 15323 15343 26595 24572 23876 9717 24720 12073 22847 15092 15494 15892 64182 19184 21003 38895 14538 31664 11128 8053 29945 12038 25163 10146 33657 24757 15520 16267 40657 59443 26154 12839 12730 6872 18044 18839 6739 7543 25844 16759 45940 11542 8410 9437 8468 8656 24445 19672 15822 14019 52486 14017 31864 22787 39118 37913 8467 11579 8262 19120 11117 28653 8371 12992 35322 10514 28062 24602 14848 17752 12625 6878 24337 15469 45496 12765 13789 15126 44072 13930 8867 14101 63924 27959 5461 9802 16276 25104 23556 1,7-Dimethyluric acid 108306 2282 88637 23067 52655 20573 111037 220596 64068 20750 50374 35968 98873 49165 23429 50887 28330 10076 7933 129621 73739 37163 16799 20372 36288 44223 20260 15066 72305 22705 51021 889 10224 4906 1 744 1037 21390 23316 7359 25426 28284 10533 1840 15347 8445 12199 84445 22486 37425 11761 53655 108 30535 20523 76337 50495 100573 78002 30971 82094 27483 99337 30886 17814 27699 200962 40 1145 20914 114 499 11853 8057 32082 114 4343 37 25082 5514 3712 4858 20604 35905 149100 2 23454 8 14726 37051 20949 24 94527 1380 613 15891 20495 89 470 63049 1859 2981 5755 86668 19880 2'-O-Methyladenosine 9225886 4817125 1982578 632584 2542797 103070 1583343 6232413 1172589 732770 679161 1655278 2726403 454135 744427 1428796 425408 485503 1422714 168141 401479 891055 1698674 898459 308631 634159 897505 721671 14329 391279 8132037 2498998 6183329 391812 3604466 4160587 2335155 28255 339976 1302361 810040 826241 624289 2498264 660568 3248097 2940716 109872 5954593 344255 248364 927719 385933 111858 508287 101879 115896 687611 235631 805571 363431 133211 281200 983129 772980 303565 434586 1797649 592055 35855641 174338 1502062 102770 9184570 140807 557566 711482 1674887 143420 193650 598652 988147 1374266 2088560 254256 740902 1470211 967829 1419442 876692 868413 60768 670485 222266 4308013 556608 1414388 282550 327231 8336 559652 133325 121514 1922075 319206 255148 10079261 414286 4652040 622474 223834 308373 943423 1887525 617771 101148 621055 2078247 201581 288004 1117813 3668011 1951918 3939047 5348 346071 1200969 568153 290071 1175444 295444 426355 618627 3-Dehydroxycarnitine 1046844823 445288745 875267647 17891143 524581852 5794483 2523294043 34000020 1316400569 1171722175 70364576 1425083796 685798279 17417568 917512922 487586043 703345027 137238120 400441053 17141761 394758713 379263566 9503680 9388061 11658506 580005610 850858199 4798330426 7616296 1241759430 3110970247 2708880334 2526138599 49981775 2477914467 1961993821 669777255 8086395 379710819 401805239 1118514374 880707675 11017042 303713217 22296940 942012749 542917144 2724255854 1211801639 1170208385 28058806 138767413 227821840 1433686545 1062113248 28720441 123880384 182754602 9454496 1670143662 1163598528 2152093107 333454275 1304819171 27193573 537199437 67959836 284827580 1023313251 596145142 1047317028 6817429 1868396338 10107730 1765942073 16892586 29242699 8461585 1141871006 6788193 4672538 1434737834 1210415945 490789982 33294885 73466327 568755010 6205129 1247816011 12213420 1913720587 1037942960 4745490 167710819 149800260 355485334 441492543 7973924 930612804 1884540177 1559510055 2578361350 45151842 11144124 176073899 162400620 209155461 298704224 2038417170 667251367 57796555 3723519967 1054975535 1191731710 803921484 7718893 881874177 9653017 599042500 3753635956 135162487 1251542851 59574447 2472468161 35651967 1010506190 1183639868 772249332 1201026564 9163814 3158403193 4705116 1013606131 1096622281 5673330 459603789 16933816 4245294 1950459837 2137952526 476537087 19304065 215015960 44635054 248961294 5954092 6451594 9810339 3741428391 1304272381 21963693 895940044 1634518818 913039880 842581650 4-Hydroxy-3-methylacetophenone 27823 21990 18475 5056 33868 2497 25739 10898 9059 31651 11595 27126 3049 1883 112432 28874 24811 3959 9107 3108 50652 56036 1671 2178 996 33429 26957 7913 2131 29511 20388 32362 28242 2781 44158 32640 29367 6726 25527 24119 25681 68191 2077 61214 10893 53666 11152 14206 36356 28863 4157 32100 35342 39931 22199 1980 9092 9942 1964 21719 7573 22047 31841 4905 1278 37031 1877 3580 96044 40915 29709 1064 74078 967 22407 962 2490 6068 28054 20476 1213 47966 23828 37621 4223 3233 45386 1564 40643 724 82209 27713 1898 9368 8036 12666 20823 1266 26522 19621 25832 31445 1788 1897 45533 27525 26370 20636 10550 19703 1482 20985 28075 35311 2895 2012 85366 2082 46279 20328 57686 49162 2705 21445 2587 30724 24246 42179 14505 984 111307 1633 46612 28578 724 45452 3022 1551 105046 14052 32280 2235 13484 8097 32260 2506 3598 7209 32116 42459 1509 14525 27478 42824 26117 4-Acetamidobutanoic acid 2975 2363 16082 10025 18545 14974 28148 147133 25248 14968 9340 5941 8964 18433 8265 421 12997 7256 8542 3121 168 1103 9228 6653 12190 2234 9820 14550 9797 11857 6101 403 8396 6858 642 8946 2788 4668 21531 12264 33470 2162 10475 589 14562 1596 6226 5435 2777 10576 2051 10795 5586 12193 10019 6620 10939 6763 5360 11657 7175 18967 116 7346 3031 309 9989 10235 1357 9380 10357 9494 7259 6414 16039 6573 9398 3216 605 36591 4176 1270 28222 1461 7973 5395 1063 3626 1851 5238 146 9277 4473 54888 28070 61613 7191 5222 22186 13108 7609 7008 3578 5826 19885 22471 15838 11894 3072 2173 2861 4545 9518 6031 3759 7151 382 8201 891 13884 11292 12383 3528 15072 5055 5249 10552 3990 5732 5483 8521 2734 17051 8831 4295 15721 13409 7699 16264 11831 4071 4021 10721 34061 1323 3356 3549 4367 14087 1111 3375 5509 38576 2906 7625 5-Methylcytidine 167363 200002 29897 1635504 2335851 158259 20325 56879 39408 379000 119418 10572 144637 13185 8549 6781 11296 134042 6643 692941 144765 25746 177297 98942 656246 116120 17533 63672 3979796 312848 8688 5414 15367 1429742 281565 49871 107796 294717 61024 6999 2702 6121 763742 57004 365915 3870 131597 26665 6682 283804 837488 116519 80156 18297 19842 1092312 7163111 2269585 5835904 1663356 5484267 17124 25003 8781 182317 78040 111549 135574 253232 20082 278949 418840 14487 217371 16766 67566 106024 3357 11307 39838 881237 53883 135218 66672 200220 738805 142331 36196 74698 193962 3471 212202 166476 31029 176513 6805 8751 2227913 65125 56015 116233 10085 319739 942776 9850 8610 8304 13416 11079 7351 711264 37145 258629 93034 101488 687553 122932 11693 89411 8534 8343 396188 355632 194780 1008574 15506 4213 48206 54218 85794 388506 130331 96907 243283 403310 288166 170910 399179 6316 58674 418055 1244896 33854 89064 307827 505572 21405 185988 121814 174292 838003 11010 37682 8287 204059 5-Methylcytosine 670 469 13383 11145 26596 876 3363 88528 1745 8133 171297 3892 5486 4269 6619 24 123 2608 30792 10520 174 590 768 443 68190 17694 7256 8191 4116 16301 12667 8523 5726 2865 22822 10212 25435 3885 138 1026 95 4124 3254 6084 16947 1676 7001 11427 22 335 35019 19252 6382 44684 33921 27804 16785 13183 16466 580 4246 11054 121 339 4296 4280 5493 6502 479 2298 241 3368 290 4677 12130 1122 60825 15480 1325 3129 19 9482 12610 26 190 429 354 438 6529 184 3945 1487 10893 28457 24995 10466 5094 3955 105 13833 5356 351 166276 14 15865 13373 3489 23471 7605 6697 6717 5789 522 1090 14461 152 1264 10372 13088 9823 2390 14863 4367 14554 4110 177 702 145 6834 294 3444 2935 424 509 1915 1262 11373 15092 50367 2518 264 52 1902 96 10254 17897 15120 12 5407 5-Acetylamino-6-amino-3-methyluracil 24315576 23241431 14762698 1883980 14099993 1737180 18636800 46661091 9461146 2577849 8251649 2095373 6489776 4875653 1840475 3939740 866458 15256238 10524613 2882208 1110220 1261744 2725199 2445053 1651232 11972612 1629466 551754 2566719 1571964 4219185 525848 905644 318497 323628 1920144 8675962 2156459 5156125 1823926 10157965 8547415 1086666 369612 4182285 591270 1925215 5573449 7442073 2881809 332335 14714513 1924828 2223655 27412 59843 3662103 7088098 16631511 10985167 3170417 16057044 3477526 9438813 2963382 908159 2614213 5575561 269569 2085856 4464 15538 264813 1824795 973185 541788 938138 885886 290636 662021 670871 2015187 3199422 4018 9212472 4091372 648912 3685120 2113009 8230710 233784 993599 1074176 474722 181040 2509510 88957 94257 268654 4704204 1827730 5-Hydroxylysine 22 2704 19175 3738 329 2869 242 13955 3245 173 87410 760 3759 5050 627 4117 27017 242 29 3249 30961 15 732 308 2561 118 3706 23374 236 118 1846 9048 2152 1146 670 357 569 3476 5471 22 111 1756 769 3483 53409 665 34006 3433 36251 276 5134 408 9020 77 30 570 85217 244 2841 1662 647 17 4229 13964 6424 3470 3749 1366 25626 1044 3448 502 91640 4460 10866 220 84 5140 16310 2962 816 11927 279 4249 215 3526 32585 345 33160 30 14295 3668 27018 377 33 15588 6661 3819 1122 1917 6,8-Dihydroxypurine 370617 156824 43854 52206 34211 21882 378761 28334 341316 127579 9915 64054 3949 9198 29298 30336 65674 17456 25482 6357 21098 101817 2899 3099 4578 377721 119103 4971 37081 119237 1989 183614 3501 37125 187289 50410 196896 20477 2977 3561 2682 33035 20598 788 26349 168393 19654 10044 415883 117109 20032 44339 47108 45396 19415 27176 17694 2909 83984 7243 14999 49966 11984 20351 47271 96431 5377 498 8553 25291 121024 6167 21563 4884 57614 31760 36088 7775 98960 665 13387 199422 25164 86435 3664 9095 336423 2622 550158 15875 9621 107094 2677 21075 3968 43035 223472 25547 16306 8737 32317 35919 28699 34797 54962 31128 68132 42296 4516 15743 51905 16230 111064 95813 23425 7537 2330 8987 15606 6804 298520 92394 20688 10350 25933 457472 60149 895487 5340 7881 279473 3988 246370 108165 2243 7466 2724 2279 18781 40721 119104 66075 9952 28386 133028 13745 8521 73728 396025 31558 27940 28011 9398 21471 93184 7-Methylguanine 107463 57667 1141432 1152606 1274150 493854 511355 2411488 663056 994112 723427 716153 1130520 1305153 742311 35111 64101 1124970 1129649 867641 30352 46254 1076500 1092237 985961 134946 17797 626227 949820 827258 1169253 1070462 1064410 846281 1105948 499723 43684 683442 929312 900034 1945632 30515 796610 6483 1605731 46218 954733 1159678 74302 727923 707027 934878 770212 1116010 1238393 430822 687377 460933 590035 522915 515083 1401785 53792 1454923 665469 41871 807892 759020 718238 580216 710141 646504 1086409 613259 570239 1292769 1436435 838083 591058 726554 624740 875420 814611 595726 1044348 433189 427541 614024 783002 728606 13349 670017 616619 658428 828724 564517 85913 668104 951644 871143 624892 858994 489087 824768 35073 966445 35508 958828 879080 711300 843254 733301 663358 797262 630593 968214 241008 1183349 765125 1358829 104900 36681 966524 1451379 463333 373109 866799 264526 849105 844086 525602 562614 934451 687426 417533 1310916 1213200 552242 855233 686570 84495 965450 630692 875664 101701 1038549 601703 1265047 514714 126814 759526 863296 1184779 190253 605715 Acetaminophen 67774 272198 127420 414605 21456 355572 460076 101584 140766 799865 981471 1205155 20198894 4586986 289034 538559 1048791 270140 462329 403605 300868 308772 620725 709367 482213 746134 388976 353042 281084 541036 1336134 14242 203089 710823 206011 332120 41369 552447 38921 461764 812947 185432 404589 14467 656203 289332 64376 392397 271074 617226 673228 623424 374432 342991 121349 333396 76176 1768918 187869 26101 227061 220049 428231 451240 125898 80787 1330739 1142253 909263 284484 693329 429420 295666 700982 318589 330809 744901 136981 81044 571737 76184 125943 148686 10110052 363356 549395 29270 533182 63421 453760 733383 815003 635983 263295 41148 155170 279989 312165 198164 484592 606585 209800 210476 236869 48281 168275 40535 110536 100407 14674 346223 80582 567873 58553 1512826 612026 2149792 792923 286305 149247 443701 496950 473568 118138 342407 131853 337813 23192 427242 961978 559071 1381806 2835484 685188 3957904 1173178 1061912 434665 397845 150626 266030 497868 121251 167213 369538 540517 613631 866642 329162 817266 290621 289371 278099 129375 610121 Adrenochrome 2396461 2249178 1124327 2482782 2089498 17274 888899 462991 1478814 1264239 852396 1745204 3476 2063 64785 477023 431333 898486 654526 807884 886550 927341 33868 9058 6790 551355 1569685 588609 606565 1174381 456461 763559 812164 876392 578781 1569716 4985661 2384736 3476096 1317702 39635 992262 7423 1335112 28146 786500 402010 608147 1590514 1180512 295109 832968 2467847 650107 536010 313164 2776484 768493 1993080 1539345 1494330 875475 554533 768206 763989 914517 9042 5509 89181 1375480 1208253 13992 654081 6820 1616742 11722 7936 760544 827489 800304 3432132 1081002 620406 782403 811989 508375 852866 5872 1506114 102225 1123161 10754 1232170 1623392 907297 2810268 3878801 739162 755672 1309945 975722 555567 1253455 2551068 668688 712141 616408 336308 727582 917002 483581 996376 1223168 7568 311097 15112 1194253 827523 693468 2053552 410296 1348666 538225 1334944 880787 1645550 536824 8257 257837 4739 1175839 1055601 75729 13258 6131 174041 1238723 1242410 336465 509937 1602869 1830841 12752 9661 13278 987571 998558 589454 355783 888632 1569194 1058836 Agmatine 11327 10794 1351292 1810218 46410 3734 47432 283692 27062 278726 8674 14342 353141 185790 592795 4750 354783 997730 104960 40137 7488 7649 379028 11866 132886 8484 400129 297515 274390 205040 41664 72787 71507 72855 189073 70865 129620 754072 391108 81063 2560 63087 2259 236980 165660 670983 326692 57444 274228 36753 188077 120710 148940 271963 97009 208603 529136 242074 4685 6421 174869 1413 4087233 43933 2367 575315 78155 360206 38519 249361 20989 308515 7164 104552 8545 668117 250113 75228 354156 75099 9258 5950 72140 761284 1323621 196745 212512 1465 10204 177961 233295 4149 998150 1155053 231918 813314 37524 953258 846775 19319 50084 79319 56357 56564 64263 32277 516157 940530 22834 22118 111781 253727 136927 332899 5957 4110 103746 25253 297900 59970 4201 76759 244321 202661 24323 78371 56641 465928 355572 748 576547 69220 265385 8096 587089 434907 20834 62405 33484 33594 240582 443725 79441 70302 15566 4180 335096 76724 4117 76558 340590 190506 5829 198575 Atenolol 20211 7038 390116 3196 7977 1317 316 2876 73377 35753 2371495 1360 773 1226 15919 11561 7005 42389 139 11510 9888 449 485 16 6301 5369 6242 22855 72930 20852 10837 159610 16683 996 172695 4189 7395 436461 9586 2451 12955 43 12998 845 57335 110163 17830 5685 70194 3491 1338 3711 136 10863 9792 5213 1971 32664 491279 272451 23626 7658 7612 351 15220 955 1159 1810 86994 75941 289 1869 136 2107 940 1683 1095 1806 8449 1225 42980 4359 14470 13982 1869 310 5926 13 503 67817 191 60278 18087 1455 3014 16245 38622 17630 2475100 8391 7861 4676 22475 6873 562 40182 3562 95841 2166 27466 75154 170056 186 48 786 127 1062 36951 6236 4435 5480 9207 25256 41305 66581 16084 7619 280 2211 246 302 70161 31 1181 666 66 1325 43205 4898 1333 1042788 4704 502 169 587 1240 1110 6421 8399 376070 1618 66728 3-Guanidinopropanoic acid 3187 3332 2574 1350 349 7301 962 3165 3969 1809 5508 6174 8249 19101 3601 7160 4326 2210 1039 6877 9906 3102 172 149 607 2495 3371 2388 4639 3751 1254 7666 219 3089 644 237 318 2640 183 1157 4869 3707 1622 4282 4327 2975 1744 5455 2947 3235 3309 1260 1817 1205 2945 1006 305 1590 2034 2424 5790 7312 12268 2887 2818 3355 563 993 1962 4815 6184 2625 2520 1790 1276 4841 1301 670 5140 1214 958 4045 77 2214 539 2753 4338 649 697 3347 4825 2035 1606 775 692 2439 698 3370 4182 5909 3595 2983 6686 2119 3347 2745 2783 1638 2325 1530 983 4052 6508 9401 3676 8304 2847 2172 2849 3066 1904 5596 323 268 282 3073 1687 1301 8728 1229 5698 2175 4655 8726 2743 2920 5144 2325 1391 2926 1592 7033 3544 5561 4613 6515 2443 Bilirubin 1287544 157489 1099819 5856255 3323659 3771600 67403 3171742 143563 13627472 272773 8952491 18303578 20803095 5524549 21026 48982 3196752 1915659 4754388 481305 1182969 23753768 18009410 13219820 28468 579852 353759 1215117 11596182 3178259 1361087 700551 8590074 1208509 518649 100964 96203 777251 673646 21593146 416714 9930643 271508 22245624 1806230 2307620 9597955 1559351 11841859 4445787 408519 2756891 204981 2191554 2212020 2877652 2297537 1131813 12572327 1604417 2234224 1030929 5565318 1330894 377699 12921377 19620010 14428820 4094084 11822246 14605286 9454831 22112102 1898182 19916663 22050985 632762 36670 645994 2735147 212199 1254960 577350 7072705 3798224 2838150 18623195 2224941 12064189 16214653 9660716 23602789 30860 160678 95815 3071015 2884297 4459997 4541773 2122090 4526254 4971780 476321 7673184 616098 4288226 6447425 15738323 8978532 2669326 11303648 12940221 8976400 17739609 4859606 21063013 447454 918899 821065 356517 3436128 703945 2689548 5527409 709426 1386864 6759882 23116191 10069297 11491908 155789 9560198 18859708 8095630 26880459 11057868 4083533 3321710 795337 8040263 3410844 2863275 133231 19852241 1556289 18758654 397409 81858 2910506 681044 1288408 79554 8462367 Biotin 130195 146634 78350 83184 119564 11008 233694 184650 89463 179101 78875 67258 284430 52075 44986 135432 84629 135745 55791 54452 354899 405299 8326 12798 14213 79656 82467 163702 43424 156332 127384 336330 39509 125620 176250 76802 133870 43161 458580 143972 64797 214123 3725 323340 133122 59008 125219 167203 78678 154568 63337 112588 99397 89432 33131 40246 606405 188277 74315 97056 53138 127284 214494 154925 58425 291651 24794 72356 64022 160426 152855 9364 902552 505574 102722 1322760 917505 160343 108366 125160 54019 176257 102549 109568 88046 36646 100339 12961 81510 6685 58301 132968 3816 108846 111655 124481 131422 79399 71053 65035 52258 51480 58649 46733 71668 67082 39880 44400 1967072 49895 65050 117727 135792 113832 69373 9161 94450 21479 160314 80663 127035 73158 87988 343823 54803 81395 77162 93448 168202 126004 181302 75332 245214 133895 4577 64131 52614 3584 69771 43384 146794 28215 268744 130043 146706 5827 12550 147903 211369 107120 62350 256025 90663 185396 111841 Cadaverine 382465 72497 560323 15867 1963865 5809 18494 1400509 6171 583386 660919 121074 571834 1378320 126211 6893 5697 808344 468728 8553 4473 8990 332 36054 5905 12483 10811 397584 18045 559143 235362 64967 68745 5520 568286 220971 5074 4212 628750 480128 999944 122148 42781 12385 1462883 6657 122266 1083595 12091 528742 5887 662608 441945 25790 556774 5481 388080 635536 17086 300601 276794 728600 14851 1275026 1988 102088 226820 434071 27645 76132 429486 4924 2829 2463 13146 11003 1246471 329452 10372 729814 3448 17119 595538 381816 1234452 51166 997846 46137 25760 1952 2233 411359 127 5813 509475 13988 308421 3805 701172 638963 17792 12065 3614 8045 7638 415737 5534 228137 1981795 15977 1207 42715 489128 125561 1348845 3602 23629 812305 18380 171032 1456 19768 2184 310883 7350 514348 76097 1411185 1007422 4086746 50661 1126884 55177 503874 2624 3125018 688217 7244 3170 18693 308712 2022 502214 615960 276365 4759 2254 50356 32253 65257 1876 552084 506873 41270 346195 Cytidine 146561 126824 90678 257569 47060 96329 47172 221657 79352 137692 36920 99975 15862 25122 56807 8092 38545 21331 77927 208257 7093 8761 16121 26531 144550 69060 52568 128862 218988 117997 5580 53274 29638 192785 123939 190632 166144 74260 33523 21763 28569 13794 310425 5317 8192 44204 30804 3297 55769 103596 117970 60932 44696 11673 42075 272834 86324 23509 682882 66610 56258 22704 4439 19505 23750 10930 16049 22906 24126 44687 99378 97082 39156 27327 26100 10137 10174 6546 28861 9344 220903 21775 39524 35642 43500 218892 37616 31715 99953 66130 52385 84902 19625 29901 19183 16964 13105 557948 88573 31820 83562 47189 36661 106032 113542 15096 65523 7513 6147 118104 112419 93358 85342 71718 5876 71702 20149 14820 26330 65266 18543 43570 107569 131373 369521 249620 111986 59305 12752 15628 74848 50308 87304 127982 23916 6222 102430 77025 55527 253468 119657 9343 43088 125352 83482 25988 8610 32240 16598 103871 13570 26841 18267 74845 Ala-Ala 65108 35498 8125 19995 46291 826 85997 30677 62516 45593 57488 22633 108699 45202 25142 7400 34492 15787 35193 4550 10337 3651 1853 50923 1316 33394 79368 31300 19735 50879 20917 68405 38980 23139 58212 95596 50438 7461 24795 34387 6821 22577 207 4115 108488 43894 11330 60667 72413 46145 16181 60253 50766 39033 59523 22373 40623 17702 20574 276212 184409 30605 6364 68406 11028 9828 26716 95028 18595 30388 43748 1554 24441 1019 47908 5500 63244 38295 20002 17000 6476 18741 51645 71969 56433 16714 68509 1512 54603 642 86330 40166 400 36853 10978 28867 20367 2817 26152 29880 115777 38908 14825 4455 70846 30131 31209 40225 99893 21504 10490 42203 44773 203526 46222 785 7528 12364 19659 45637 97381 142190 21060 79627 9616 44929 57432 98094 20703 146080 51519 86444 84532 43242 153 308651 153446 557 44140 54466 37044 13429 6761 40834 51561 3339 1505 48545 26647 10646 16620 27817 29119 16597 32117 Deoxyguanosine 136409 79613 172554 199470 132997 3252 68427 50875 46091 101477 66987 116851 7066 3983 284407 2542 16884 15655 339000 200287 608420 1016437 101979 348038 49482 55796 47745 426756 96192 57570 75714 21858 27769 480941 242245 61609 304682 58010 39073 6722 10530 157828 6557 18238 64321 47815 18208 107034 90787 372943 101026 251465 444334 271729 23650 9247 414593 34952 48852 44611 6562 32670 646758 8997 157 36802 34380 89946 86178 362668 200896 42320 124596 1901 1344 11397 10016 302088 21835 122557 11232 48341 303598 210270 1627 489623 124274 155010 83587 72468 42219 106529 19271 33807 444491 196816 136391 88320 178621 80125 244996 16751 17421 19649 16720 13019 163043 40760 46141 82775 159592 13601 156682 16697 50163 33040 72281 207821 34411 136323 303994 402744 400245 152354 94076 79931 665 13532 98380 192859 83762 69398 139045 4183 49000 61765 87577 36007 630114 28746 132923 29153 51296 120449 23914 35573 158368 45805 71742 91750 70507 Dethiobiotin 96 192 31390 1635 42 634 469 25977 870 4905 855 212 25698 2218 1157 260 1444 9995 388 11079 10591 47 1435 82 688 199 3769 700 4308 45875 1659 1629 1007 5658 293 149 1521 1176 8906 126537 8313 98 6013 70303 342 2720 21424 65 4080 395 1786 2955 146 20571 2077 2769 724 386 219 156 16875 6615 2315 581 8109 151 3816 988 4853 212 151 2515 191 150 4069 311 4481 693 1736 415 4164 1151 1098 955 131 677 3490 249 330 11206 1657 280 990 6625 3214 1538 461 873 1997 57076 333 70717 2792 1575 790 414 4632 3925 3768 358 1421 1598 787 12925 1280 426 1165 570 2617 5640 115 5969 3039 7907 27 2735 353 4269 146 344 332 2495 1854 6156 3622 869 154 52 23837 126 1072 2690 23171 13479 3017 3456 Ectoine 21917 19477 11560 8329 11214 7440 22000 87101 6461 18015 19995 1079 271 1037 9484 11780 7744 5154 15133 14416 7617 235 1432 13330 8693 4934 8202 16714 6302 3977 10784 89731 13805 476 10171 5955 12861 3249 251 16280 221 10630 33514 32643 31777 36261 14941 25567 14963 4721 10348 5933 26269 19394 15625 18343 6841 10259 7911 6825 11946 25908 9073 142 2100 1354 13362 1356 1427 208 2233 63 4575 5950 22944 7282 8919 15692 11173 15976 8352 36511 9 6682 16 1866 11974 3098 3104 8019 25031 8769 6834 4675 49269 33170 48324 3678 14063 12356 22164 9542 2958 8528 19166 7074 11786 1761 123 3231 5754 38658 39807 26791 46142 91738 73086 26579 17750 42977 21649 2407 79 37432 13739 103 424 203 178 3108 46808 11137 13717 7128 8060 6208 45 35 13422 9581 7083 5299 2506 10413 Gly-Gly 26588 18697 15784 106802396 42909 46065243 593770 10188052 875332 3604422 1990058 2086156 143237 15464223 18066085 87471 269888 920666 87541 86502111 259490 297764 241691221 238165495 263338754 236852 83391 257872 70879878 3821230 102015 197466 1434193 171860424 11576669 1653115 187506 89557161 333786 102756 3909499 83943 189937849 236190 8678513 190236 770676 102992 65564 4971861 89381418 3304550 768385 344199 112471 96967397 1556004 249322 103573502 489902 363238 49784 400314 213642 116953481 33345 1677020 23537 11795198 1829028 5564430 213722496 25857060 121823492 9401677 188754341 95671623 158582 43877 638776 134850304 128333 455423 428967 523586 130957069 722097 216081954 15575243 148896439 889812 5243334 189288019 1166594 1373294 942059 102826 112933276 96897 618345 19802557 10945888 102650805 100098785 2570253 439417 664860 263827 278553 7387235 127035782 572033 4871759 14126645 228618 235778532 245950 258391343 481053 93184 441300 156054 86807725 410690 63867071 360175 1324918 111820 226739 46140133 2345724 288911 4492180 4795196 238159262 3331863 28285556 148828341 24249069 2704804 87669 102167540 154013 31834 73348 152830897 129548154 7423227 99666 1831617 69879172 2422598 115803 168512 3408793 Guanidoacetic acid 29753 31601 1164 30314 12978 75732 1278 11610 15837 12963 33803 57625 477 54799 48837 94676 53479 74459 46666 9247 24973 11801 5391 22963 83 4915 2452 5118 5078 40661 58722 88794 14 12059 11865 485 10847 13401 10473 14334 60617 39672 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402 14156 1657 198 1542 26317 95 3486 9621 6896 14611 10729 101 167 7030 7181 1707 100 1843 2573 468 1657 1237 5476 5205 2865 7226 501 4088 3049 4150 11715 28955 103 6175 392 23738 26 4798 9669 919 3231 2130 2101 5831 885 6540 7508 3275 3265 2086 1700 858 13003 4343 81 4117 2971 1543 2955 2731 446 21 7492 8077 7039 202 9925 2883 302 256 5415 147 21 1640 2964 891 3143 5509 17 76 2001 6106 8651 7600 15 3946 8028 84 10897 62 8304 4658 2192 396 471 2797 1386 313 373 10186 24 1610 1809 35 3033 1124 5843 6380 479 622 4717 2854 836 4167 2589 132 745 6415 10163 1837 1248 4538 314 11499 2350 165 795 6014 4692 4598 2823 L-Urobilin 68443205 46651175 6144600 51214 1195516 4716 45703862 8575 9158273 18120401 12065 26807 87 1923778 36809987 55109546 7718 1089 7385 75300136 61875141 4931 133 1431 22138896 43940608 32789 57047 17723686 31255 1046270 97735 457173 5623814 29021001 564 16949 90132 41619977 20196 42295652 1869 66940773 1665145 285 86347135 16360634 272830 18086510 88503607 4073475 71056 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625081 53943 1710892 45392 5891882 98473 99642 657609 147836 870064 1435524 55359 86747 23936 378923 577334 97624 321964 103585 481798 303270 403349 66558 517627 389514 121349 1157252 2196420 1436355 230398 770557 2639473 1802830 2895298 374009 3430466 2544294 263858 18833 7481 481391 20279 355312 200680 1424060 2142214 279073 1691605 293317 2988230 596893 842366 3189916 64026 64658 13883 45869 945880 253959 339543 315415 319234 323351 940968 62429 82136 384486 59493 539021 364471 703705 146598 859277 606180 8115940 9455948 4446860 3170203 708712 343868 43923 70284 820593 258583 505721 151193 81213 43447 233837 11131511 5850787 1117963 161196 727949 6454431 3127852 2738476 1682454 784583 176473 77761 1012543 211679 73421 91571 2205298 3409511 2150828 289471 102311 538764 888781 214759 169191 727373 Myristoleic acid 841677 568062 480225 134947 738908 251926 987656 1439516 435177 777630 379826 265794 49631 71877 795013 2936245 988109 139549 816166 141980 732299 654032 68735 96286 173124 700231 976553 288138 127060 645946 152406 1495175 164497 120931 815080 231502 189906 154187 915069 246782 126591 731580 191815 944314 105387 379706 311219 82299 664562 657520 181708 334130 448531 116323 61245 106375 363122 516348 44429 576142 316812 254712 345279 48709 194623 537663 36636 33414 264181 337589 733325 103356 82888 158410 497326 37485 11533 271289 829577 1919780 93880 653327 271959 3441576 45809 111969 450487 14842 464874 82882 120116 691830 22745 213554 341222 297045 101881 38182 104410 88170 268892 205332 110762 117978 820221 698965 2009924 226411 130748 31487 61059 72094 521104 502207 32196 794066 1622687 128393 3895553 475065 976810 740853 144679 549382 161674 419501 299584 509413 253866 95131 3883150 59115 812153 657161 253940 73154 64566 178498 181474 505016 1272284 253104 502389 376115 1027158 45645 157650 77902 723317 236004 113633 150717 388580 1309763 592836 N-Acetylglutamine 13565 21929 6485 6435 7763 2912 20245 53377 3669 6241 26896 1200 5238 2716 3507 6690 10748 4760 1585 1671 20516 26461 1705 2389 1824 5148 5258 2056 1122 6515 3378 9931 5511 2328 6041 1895 6261 1018 1842 3011 257 11023 1511 6176 2565 5627 1127 479 8919 5771 508 7532 10832 4289 1081 852 6004 7675 6148 9200 9798 7766 13108 10171 4876 32895 949 1572 6757 2023 6322 1375 5757 492 10245 1194 2808 1064 6748 6780 1806 5949 6003 11851 7179 3898 5765 1539 4772 1439 9222 5472 1523 1954 3883 4170 4674 1100 1628 2217 3350 2224 2159 751 2360 2048 1562 5548 2782 3045 868 10189 6215 4891 3468 1488 900 1931 8306 10291 16061 8051 369 957 670 2746 2808 4001 2054 2876 3732 459 5474 6038 980 12883 3404 769 5271 4719 4529 570 3740 1028 10354 1134 734 4503 7664 7718 982 2476 2845 12081 4541 N-Acetylleucine 77931 58805 12772 1986 4248 2986 56696 21442 37918 34797 15663 3969 26622 13516 27879 36090 28073 3411 6394 998 63596 55680 1765 7898 1836 31751 18897 18183 2790 32723 3901 30040 8256 2870 65665 13134 40126 3156 9936 5333 12288 68647 1973 102965 22426 39483 14108 7305 38578 31435 1341 38384 62507 73710 14834 700 2949 4121 1259 4210 5311 33534 41368 8625 1291 61299 3734 21050 30852 5543 31792 955 14537 3300 12709 5903 13470 5496 17593 3575 2252 18617 20406 856416 3221 937 67879 3472 12733 667 22521 27185 1302 7154 4015 36392 31947 693 7334 6091 6506 4426 582 681 14946 7184 15582 4545 27008 5160 333 4278 28271 13055 29785 811 48697 4886 19601 4287 22131 22725 1176 12873 914 116717 5777 141031 2501 33580 19714 9055 49248 27654 532 21123 20502 382 67375 4497 35991 756 3778 38550 61793 479 461 11247 21829 64457 977 5895 18618 40837 24639 N-Acetylputrescine 185903 156537 4924562 274468 6766533 80837 590949 8809895 661257 2261711 4906230 2069499 825366 524972 91984 7677 223595 388890 2843406 64796 7854 11402 131280 151590 130073 402213 583150 3339177 358705 2204382 2356526 63415 2476261 105219 20178 678131 273109 96549 2642187 1299721 6343468 119063 111300 7621 2290351 225142 1381706 1282363 318909 1968077 98316 82921 100596 5505095 3863396 108050 3753437 4315495 141796 6613992 7345347 9056500 14873 1791008 76279 6053 188101 2374934 21086 2013187 1896867 136934 42262 73109 589341 193064 718760 848469 282258 6979843 206420 173989 10586432 65906 408107 64055 50901 72153 125635 73484 37964 1823606 76004 3157422 3278392 72934 49216 181465 3244995 2281153 2310727 2947114 109641 109230 266053 5667375 150575 7672528 1395106 937016 95824 2898412 1934949 1569945 536404 135480 16737 203057 128469 5244686 254227 457746 98494 4867421 111580 501868 3079929 260745 1682921 250916 57570 200970 42815 1896714 78492 5727888 1958126 100835 99668 3754965 248856 169483 2386680 6001439 116672 189716 174588 1718780 114631 10688 80030 1004197 5813293 57119 1484323 N-Acetylserotonin 8134 2570 37 1134 126 6091 2579 2019 2324 2394 12795 459 1689 2061 53 186939 15 173 1904 2604 4644 1587 30 2169 165 11025 1130 1207 556 1320 39 382 102 627 2360 7616 3181 1091 745 240 583 1870 13425 4903 4536 634 51 22 55 3401 611 55 3399 723 6423 1860 575 2753 314 2237 142 119 1201 364 801 8 295 254 1507 1480 1573 3433 2823 14 752 118 86 47 10 2963 560 2812 5478 298 116 1667 144 60 700 1172 2049 926 2344 204 117 995 47 464 2215 1887 1063 287 1070 2508 39114 6851 1506 1111 3214 202 178 9868 1249 N-Acetylarginine 36751 23568 143251 92789 35992 120954 447363 564556 80142 132522 157925 42060 76735 233533 37131 17329 106045 119050 61032 22842 24731 40916 26710 103857 10858 102924 41997 218787 216076 131276 464001 41512 205474 73866 84090 29631 47153 37904 42313 20228 901141 7732 12157 3699 1212544 45626 163632 23893 46686 120541 74458 110208 55748 55881 58568 55118 240428 191105 224226 43568 37253 141874 14271 107912 64656 14382 158664 7258 104950 14290 111853 30088 57565 5136 38740 18648 143799 79874 39431 200464 103532 54234 514229 46902 247616 52088 74132 56224 68887 14059 116391 105953 23987 65552 92732 109577 39741 104880 91842 141580 24391 63403 69244 67502 22835 180970 36660 191592 180458 17799 94069 201772 116864 12675 4419 10076 2594 89223 16539 92777 70418 22956 81254 365588 79120 18956 112451 31199 128713 35916 85181 13153 287854 117479 6262 34142 24797 10766 103257 21565 27344 48174 110325 265822 20971 19640 12043 210412 46530 20824 82012 271092 200760 30871 84375 N-Acetyl-D-galactosamine 55160406 16771614 9718904 2422006 35777682 8772457 23203842 14487539 9364396 78241960 6187773 57167023 878177 3611929 33098487 3282569 3290875 2320611 5106322 4400627 13584656 15005254 3817802 1806320 9897186 21266921 15323201 17793300 10906156 82289540 14788367 17873895 6962866 59016640 37573655 60163188 20122130 27412373 11210957 29434426 4550016 7550086 8819743 6103442 1331590 16202430 18316031 2028064 9819780 71744968 83787136 10936700 11020143 14093060 26595441 79373401 55156298 22660637 10951193 55624015 41210590 6496652 16574404 3038494 73713354 6366245 665323 323735 52961002 44322971 76016462 3834953 30766379 8547450 21161128 13237187 6310206 10434671 5305850 11513793 3855504 11166706 28609521 5196756 12077689 40015956 11213630 1018818 13278597 19787922 16228086 71061774 2620615 17728384 35572740 7093991 18925088 3746220 24829596 62740022 20449477 14027553 55781156 4542592 16457507 19065031 8013936 11079156 21838538 28299763 47578693 51746057 72152467 23470161 1074334 9370310 10971813 2196208 9956640 13996079 13756037 14006691 87950974 24505200 61572475 102239661 68606129 22784674 34973301 519908 86317558 3896163 7566967 72794774 1822076 11078208 3821015 6666131 50817991 40212516 44431308 38670099 23765690 26475387 25374126 23900141 50686426 22747838 12286466 11980983 59660259 24191419 18313136 10093151 65659681 N-Acetylhistamine 8627 7804 511400 2012 443964 384 473685 248902 261293 464348 198243 49601 220 8569 169011 173 1882 3006 745453 651 769 63 4875 257366 521736 1208 484062 1726554 429441 279971 2510 208821 488452 661442 635 2176300 295744 13352 100179 657 3144 68523 65608 65518 31756 468281 466 1538216 2322566 458257 455507 8579 1589273 209930 2872 175732 387556 1084405 2251 48778 1369 3023 1724 142806 131238 581078 442670 165266 459165 66 20622 333955 1353983 215 392388 332348 226024 486442 914 308035 29758 16373 434445 466981 797374 350114 488923 342 433139 294512 236327 200199 333 5855 529919 573907 201223 636998 1000881 109992 371 892239 438745 423615 1530 58393 44 294547 1703426 576455 1150214 916 208761 6673 529421 1926972 1775103 1653640 147 220891 2212 488022 466051 53 335781 7255 697319 314789 1328591 404 369054 642969 47483 2766 439480 161977 750 1022881 4462572 291101 382969 N-Acetyl-D-tryptophan 11588 19017 14947 28618 28465 14965 35460 542859 18282 33728 57757 7981 25649 38798 184 3748 6522 16829 9974 6994 17042 19034 5776 12333 5418 14983 13054 413536 11220 30420 10363 22428 20982 124906 39230 2237 14066 7154 17745 40444 35357 6254 3506 11352 111747 17307 11149 18703 12804 29415 73062 10171 9164 8562 82422 2044 45057 17232 22921 63170 55807 16549 10128 73908 165532 36903 14170 9361 2610 9109 30725 6840 7895 3113 23738 7378 9395 16589 7005 135876 46827 1657 10531 7662 29846 59357 4600 5583 5343 3679 5556 26014 4426 33528 89071 2630 4750 79696 15900 26328 19748 3902 57703 4142 5775 1521 1024 9647 7259 9298 66104 10131 26365 18014 2694 6795 2224 7440 9060 4638 5367 11788 147639 50110 48709 4784 12595 4569 10422 35861 5741 42206 4547 26272 3564 39476 61797 4651 6976 12171 7238 2617 24595 117560 11579 6230 5040 33806 15839 8713 68839 70592 303255 25339 21824 N-Methyl-proline 850245 265012 66419 3732 74724 7621 2037776 209666 5252763 517835 568254 86386 706 974 37358 19315 255438 82507 12841 5113 11448 25794 1307 1628 2460 295363 282795 27830 4342 556922 6144 522497 9455 7061 325604 1871821 11137018 9311 72231 8632 4785 87192 1510 53456 2705 578195 7225725 8463 27180 525040 13328 4735839 4212015 448090 4493 6426 49767 282373 2453 1491591 2870444 11337 23285 3394 3187 107455 398 1338 29418 177654 461036 2168 8492 2356 327073 2662 2404 16686 101865 18080 7194 243325 434038 1506992 6895 4415 625002 1779 2687302 2264 15560 459573 1874 258747 248906 2336422 385457 213230 6856 2966 286737 4094671 4952 19742 276432 69151 49079 6704 5536 10376 3650 7027 458080 16934 2746 5678 218256 4766 1381521 14489 2216815 1935446 7052 15180 6924 668055 12363 2471426 6117 2580 34764 2332 605852 483234 2886 11343 3713 4681 28911 61203 679841 9828 7752 640409 539374 1527 2380 1888 490992 413003 4843 7294 14227 224734 343383 N-Methylserotonin 4337 1554 33 142 282 238344 53060 416678 40943 23740 766 1786 386298 278 3922 17196 595 12619 3409 23 36638 136 128 58 23 136 74 28 25 165 29 201 33355 24 660 18482 38272 381 280249 385683 27 34538 15 18354 451 193 24 1268 330842 30647 3091 288262 1476 21 145 253519 3033 4116 267 309 28 31293 2770 63690 1916 127 3096 33727 25869 64 29 1234 66405 90 21 56 2177 2343 11097 228350 29121 N1-Methyl-2-pyridone-5-carboxamide 17422 10093 66915 30594 87408 145151 214975 759099 113565 86468 76954 88959 90535 182833 82389 11668 23712 22421 51319 26211 26782 13247 65825 96635 89744 21289 28509 46015 76241 78296 92494 60811 74548 75119 124286 36433 31449 29260 6234 16849 122276 1223 138823 2338 95195 2441 101124 274934 9523 72651 41225 8136 8555 990200 1141569 128312 14752 15357 24568 23386 7904 130524 3198 43508 39352 3585 84332 94622 59470 87380 72353 64352 150631 84211 94466 96251 99453 43050 52303 6678 55020 75962 67188 8969 67447 53002 5777 89671 70522 71388 75421 65177 65407 69787 54409 60055 71011 29740 107639 141131 28369 74980 58320 35131 35212 58502 7543 115075 52497 58024 56743 94692 67820 32053 67157 28908 13029 92052 5259 74064 42819 62102 42913 70803 98492 12882 392812 3979 135823 59558 36062 75348 79727 66446 54458 67381 134587 80675 94367 89932 25003 75159 37449 25539 20832 92834 29409 66981 21440 33482 36535 142981 100485 40324 57339 N1-Acetylspermidine 4476663 1097658 1515428 538998 1457562 164480 2814080 5397484 2587941 2403457 2458110 1695444 551276 1167520 1296126 33257 557817 737053 2187479 651550 285055 394620 277262 328920 887432 2181159 6196799 3022667 859003 2424595 878639 799363 2153191 510860 793006 2999282 2665488 618290 5029399 1421942 2425408 1002223 629453 141627 1924966 1438505 1298342 1454242 1414112 2422010 451527 959764 1083692 2536078 1878697 550404 2566995 887815 712977 6925576 4286076 5678843 25276 3203907 957505 230497 245026 234006 433981 3160359 1619269 517997 995959 1180894 1872664 730557 2249503 548960 824802 4576050 473812 992423 2680961 1433314 637514 376659 1372730 158874 1829863 309568 950458 2136176 142870 4142717 4558580 903632 1387458 352468 3122752 2424761 3274072 505691 478989 378109 2780807 2212589 190692 2481357 1921221 2204064 806893 1592373 2173314 3905941 850215 433041 57737 484690 137020 3658436 1797118 6420914 616581 2343651 339338 3614883 2905514 2864092 2232924 624999 3353569 240747 4380155 2246120 236538 1815759 1702876 532338 955688 2808108 1102211 2259822 1095087 3736216 1428687 466223 468231 950621 211798 105835 547421 1662645 4003137 267380 1447151 N1-Acetylspermine 16977 57 10810 6403 64963 54798 22813 331 53 97089 3030 156 33313 53674 12635 46 27 3363 9692 24 10 17851 10093 55669 23825 60807 19366 1439 127904 3878 47578 16814 32805 124900 22833 4782 6827 48099 321 51795 813 30719 182 95102 49746 5738 66 9366 130110 55456 74499 12724 287017 39322 7357 103636 698 949 71282 97143 554999 5120 24399 18169 16 2856 28316 19597 40509 107966 36577 39413 64556 41506 17516 29634 297 28190 81 10123 80059 5348 619 14887 93505 7063 20235 28102 31380 112682 4014 76530 90099 17096 37328 4369 31827 70024 309690 19023 2792 77 7444 349 935 15132 266015 90319 4898 139010 191680 224292 84844 52 87582 355 140008 94019 276123 21803 96479 1077 157903 26730 111114 4230 88160 118346 14658 246062 132945 32075 113925 94960 21663 40548 40986 295 98484 552 96558 3301 10181 33116 41800 4905 54535 38082 818810 34024 68004 N1,N12-Diacetylspermine 184634 16031 126510 24409 453931 73464 270892 272677 230959 330296 94255 336969 113360 104083 2227 22 44310 37312 127515 39016 13145 9053 80456 66228 55475 197694 1885654 391260 17435 508936 86540 152823 254151 29461 92990 1596831 423492 70317 629181 280659 141346 69347 31882 2020 107396 97848 206224 46452 180213 512202 50886 179486 63545 1699854 127988 11283 76636 49504 72050 2625226 1526886 2158831 3327 339366 120311 45272 25071 423193 6016 592119 356096 57513 9309 131130 449220 158233 190482 28874 29424 2090134 29420 33854 180628 159085 39305 20551 107684 57450 86317 35890 12639 345079 17824 337525 279681 38060 28509 14760 151136 235800 1130995 71799 19833 23027 960127 130473 250039 329781 139329 760217 121648 675852 533781 1385269 169149 84755 11037 55965 10478 388492 83658 6203047 64246 373868 8224 612771 606708 304904 357396 38734 55671 18791 3116284 499241 33456 536732 225393 41973 4249 499659 90462 223959 118008 685122 36007 63659 91132 163694 8633 11102 70744 209417 1026322 58501 234838 N2,N2-Dimethylguanosine 11804 12479 6324 1061672 5176 205575 7373 472285 995 45490 3989 648492 2285 17891 730 2532 932 299610 5398 462697 10657 6837 488131 310456 3906 4803 322 969588 42403 2639 10026 481 474220 76 4173 14308 813588 10259 24182 39 6968 346149 12134 195 4223 309 13346 17241 43666 398389 2393 6146 960 4011 311439 23197 471 683674 3808 1160 4685 4450 21308 493953 7903 255 314 2558 43820 261021 1276 228980 1953 831587 773 1333 3438 2546 454868 2499 3270 220 34381 201496 153 221372 1427 256482 30 43762 403779 4868 7494 3151 3455 548272 2295 178 1240 161 427881 724501 4474 2918 1623 1906 13954 20 356029 29531 41107 1018 232811 1851 224526 4474 4297 6135 16056 418890 1954 524065 824 2713 1633 1201 465 42570 124682 48 192853 91 1416 6201 1029535 4030 4232 4872 502217 272859 11160 16076 1238 451797 20081 5775 11938 37309 N6-Acetyllysine 75852 49740 24995 23128 22558 10772 590993 250443 150969 99799 265916 35268 7121 3097 14657 80136 165281 25857 34842 10418 16806 37775 4679 2626 13801 226674 87962 101755 20752 103874 33444 118811 50613 19691 132816 75010 73389 12668 55015 27741 37152 49980 7647 26912 43139 90912 85379 12898 82295 100504 10861 194893 120263 40683 18742 6807 63168 80912 24328 354697 240933 43312 62307 59891 16682 58079 8297 26633 64219 86690 6384 99210 5567 125775 7294 7771 9338 151310 76251 23878 246182 99641 138510 46760 15194 350496 4737 91758 8145 12229 88917 2685 135883 91672 154531 115980 14268 51273 75368 87148 116538 15258 12854 95213 96735 111023 43899 82709 22018 18078 94045 92120 74365 47188 12374 17099 12781 56417 74599 137781 73986 19825 539780 23772 40106 91903 88011 82035 18198 65892 15222 263299 103705 4172 161246 24809 8938 20445 28467 56425 11405 36316 397668 100781 6243 10292 12239 126917 41773 12047 46680 44870 44282 70621 N-6-Trimethyllysine 81106 53256 310687 2983692 350078 393278 358627 449420 43648 873924 54785 448448 267228 537514 32306 3698 28013 1824531 1494787 1157981 39055 29844 341703 249463 812796 66263 102877 221972 1275575 871145 473910 83431 72390 2348610 127232 74964 39998 1160068 59232 594526 208059 33971 516758 26876 473042 60805 570277 683597 267038 769531 819941 55569 51036 83447 1696131 1304160 1135955 998137 1832262 141845 68614 1823054 27705 2044380 1327287 33572 80488 68555 22066 42415 694111 486217 23417 467785 93585 560129 597268 355374 59880 85345 1365739 80578 81034 121175 2616594 1679849 92915 195796 82936 407525 36445 682835 170478 1229618 1353229 70330 97140 1296895 141579 656828 777525 66838 1573674 1140642 72462 1668527 27163 66958 1617434 375889 2073159 274514 766116 414260 292873 988709 28204 859444 56115 2180262 98222 139366 1996377 3401313 2002851 145616 778163 273554 3035237 271200 48274 129790 162503 792662 322199 517852 631039 378205 29504 321788 87932 837420 1370079 880873 91148 334954 422333 391763 89547 42310 1266630 1755522 2385548 122124 552553 Nicotinic acid 3505042 2388869 2292959 121115 3516434 9527 3805137 1436579 4490950 2208983 1814140 1512728 246615 110823 2002727 1087795 3266523 93346 1011563 94822 577154 755720 13498 128515 8587 4430652 3717840 1119635 36430 1943896 813944 2610291 2185315 66064 2638578 1704485 3658994 128551 1354128 586632 276786 1218955 10023 567997 107135 4924765 2676422 589742 5023662 1888401 58797 3494413 3147235 1616011 1994345 51284 955304 1271531 78625 2215409 2555459 843639 364736 197254 33006 491761 82981 205486 1660815 2149734 1929273 13335 2553540 8151 2214294 20904 93925 531355 2635149 1588485 87259 2913702 765850 2325176 616633 38229 3709389 37549 4305399 7933 2478040 1713460 12436 2442112 1441649 1702741 2136093 86325 1358249 1559341 2285932 2128828 113792 48029 2981070 1487031 2675116 1202288 756119 1740855 47965 828278 1742161 3330089 214879 13271 520036 63838 1292450 1550596 5290720 5866408 68310 2149440 56073 2796286 1938806 5295317 1547400 306777 2010964 318980 2787497 1715951 8378 1883474 185223 8364 2143477 2037304 2964972 33587 916378 2760371 2831633 10251 12282 89535 2738033 594155 40058 619381 1895518 662541 1468150 N-Oleoyl glycine 11884 12311 4324 85 6593 586 298 14596 2559 14204 16345 389 2879 4444 19762 2027 9773 1034 11199 991 3927 406 3450 1848 2146 2885 136 3433 301 12040 5811 15701 2101 1585 14398 2199 1790 2630 23834 4984 62272 1780 1499 987 7310 692 1690 3629 2171 11754 1647 3972 3817 2628 4216 605 2149 8804 150 891 11878 1750 1320 198 1762 2927 32840 1023 10868 2060 17501 2409 487 2395 2304 3748 12857 19243 1343 13437 5791 5728 5420 3129 6003 1146 4469 1653 63269 10036 2353 3904 17257 102 58 1437 2777 3148 1118 17 291 1155 9450 20380 37188 6068 2422 400 1174 2580 10286 11710 3476 3365 2993 3501 3342 3798 7945 988 3867 1688 62 4885 1577 4755 5423 474126 4566 32930 10454 3944 75588 3972 3128 18207 2849 10692 3136 19003 13084 4084 2456 3519 6675 1643 1603 2108 5008 5727 1268 9610 Pantothenol 4324 8795 9597 4251 4515 11554 2319 12436 1671 7995 2054 13908 8633 6426 1538 4158 4069 3074 4704 15682 2044 1812 2963 5404 10913 2496 2542 5277 6315 8140 6776 482 8085 7553 291 2862 5800 13086 573 2067 4591 854 8221 1239 16264 1648 3039 5771 2240 10865 11927 798 1412 181 7128 3358 852 4171 1616 368 269 1104 664 3576 5584 4224 6910 9492 2620 1081 7223 64337 81 2616 1077 4003 3433 1510 1367 868 9958 121 65 4506 1819 3890 6394 1428 725 3414 66 5205 5010 1093 3489 50833 1142 879 440 975 782 3514 2489 2553 751 2011 799 4237 1707 3336 29778 1242 7490 10400 3472 9730 14549 16646 8013 2530 2767 3125 10715 4541 12132 22746 9034 16175 18020 10669 8537 16941 15956 4478 44304 2605 4153 3988 162552 2089 5366 3006 18430 7977 2839 5607 36216 7083 7511 10554 77710 14862 19440 13314 3821 Phytosphingosine 3497578 4542474 8691844 5998174 5969748 12705341 1611959 54903470 1175012 9433603 8369982 10185087 16834794 23930483 725482 30230722 3557920 13849208 6860011 7034857 634549 1076890 25688123 14831830 6375120 740664 1533212 3432509 5501600 7943713 9448166 115320337 8261834 4843868 16545621 7085553 2249213 13423253 5936854 4466427 5232932 1796121 2462018 474493 5005907 1062480 2549873 5277830 5190492 6923338 9770564 1951560 3356662 8770602 7836504 1685140 4475565 9798851 4054199 10503105 7276682 2407561 801137 4517970 2814757 1323322 6753246 8165813 8293066 4984177 6925063 4613281 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1115 1435 1117 89 4863 1775 942 3775 556 2200 1218 714 1449 1278 1656 942 99 547 122 1361 4150 1365 1509 83 1956 2562 3803 3614 71 772 34 1167 5007 977 1561 324 26 3108 235 2784 812 1984 1768 4104 1843 2599 3127 1834 2858 241 1463 381 115 1847 1526 729 226 1543 682 338 2052 3009 79 110 3498 1012 1677 1305 359 679 4213 2728 609 536 1564 Pterin 2321711 1967640 2614565 2662258 1981330 251505 8076690 3571173 9993403 9196299 3544998 6413943 1901044 928526 2184097 2158122 1878044 1779003 4355715 2382512 421898 1082747 4624761 967383 1837570 4226154 4937169 2759636 4729886 8136366 1670410 3039863 1360221 6383239 4931482 6617761 4643718 3579603 5047216 4828643 6186290 609752 2296584 843684 2611084 3030795 2808249 837819 4305620 7447656 2228827 4734417 3970135 4427790 4688361 2083330 13337014 10203043 568330 3613415 5774429 6612743 1709007 2786329 1550037 3964013 800170 892528 1161492 4762497 7220279 1626459 2407465 94933 5217271 845610 895063 1848188 3370292 3065921 2802261 3756934 3322164 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6 1537 970 4173 683 23 19435 114 5191 1374 484 3369 2240 7160 17 832 2254 9128 14 14544 7249 16 460 2042 8388 2486 Pyridoxine 9361247 15287663 36459886 4587048 12507216 273744 11467523 26357300 5649093 16617189 21419992 16733615 2610256 2719430 467496 5707775 4798694 3649412 9100147 2176664 21034418 48455075 5340745 10975265 19648777 5109410 4595718 7024680 8895909 15815868 29701314 5070025 12356609 3395833 6516804 3886414 16522335 5575230 23186499 17067858 1622490 39011899 14662923 19032846 374970 2943408 49424422 29034874 5958718 14881951 1733898 3369804 14674405 5314022 53757650 1074764 39075661 15376428 2449716 20293446 6672256 7952160 10595913 9555562 1509875 13946684 2719936 2879176 409948 4348287 14340805 7009524 707779 31478883 3890517 6752912 6663210 29825025 5238508 32540541 3216870 1910417 1385757 5927874 43608246 4065149 5700311 1221981 42181754 9238896 1428773 13429910 2811539 41640757 34350552 3227990 6897690 2610901 6731809 18381329 6543643 8696081 2114297 5046933 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143441 277536 528729 696715 255604 85137 28144 29360 313445 150894 141756 32176 429335 440324 65449 1438535 158132 173447 1545783 310539 542521 83255 1036083 198727 472935 244163 268055 45163 73554 44671 59731 79169 88055 1365658 146612 93424 1631327 284178 329024 97969 418533 486136 554455 18400 24060 265692 448340 131043 49766 38546 252132 905511 67688 85728 494263 39610 626666 36029 207765 421091 90309 28723 469303 1567421 839013 455584 1648978 796763 384389 173705 148725 209607 261995 90723 59765 384132 57529 1275882 52176 710848 2840691 252597 291997 480921 217117 714739 211524 54416 1584335 446906 1273324 82736 61752 313802 1085897 282180 143904 285851 1271444 510069 100538 56356 110374 205821 397233 Uric acid 620 23 390335 92027 26955 27677 1611 100082 21382 1252 932 2891 359 124 76555 1339 3347 385669 476100 85991 11180 171 83 269707 94314 113 6246 1560 210052 5216 91649 1000 108 370316 2966 84148 8935 14 1081 669 94250 159385 3687 543 3564 602 258869 102609 309 6608 430560 1360 2192 97221 217302 1970 266812 293 2670100 1573195 7642 112285 3732 567 44526 7271 785011 8450 201531 5720 83329 717472 78 695 16395 89112 80 8941 74 407 234003 288400 23 207 207 71 505948 14229 88271 202 158 74566 948697 2951 18 36527 144 168064 140231 55 465 1537 11 28971 4134 31033 28120 88348 159546 1060 28 397554 7522 16 40 787410 9 3850 2549453 228082 159164 5399 2441 214964 198 682 82088 Urocanic acid 2296996 1720232 400782 127294 1152811 971120 1846460 1295214 1152170 6009105 500804 262330 5503380 2355986 1071662 711951 955820 144249 925617 207681 441790 677106 726244 817388 286367 3101437 1012011 96373 306166 5537545 692333 841402 1976507 209719 1229966 192484 916860 308590 495422 46087 613782 930738 184527 1113907 1470543 1969274 1202382 808933 1239542 5001049 638390 2810120 853634 1568737 1642450 302958 2305350 1275214 70900 290826 392397 1252998 2291095 1374350 172137 867526 455845 1886430 3142956 411888 4981936 160210 1878625 118317 1459888 40940 259973 722003 2059159 727910 114358 2158926 372202 1012207 1361981 119176 1226337 93107 6624630 2212038 3540866 4610129 138262 679049 779138 783899 2234035 128888 1717350 722664 438421 596264 176890 178870 580716 319396 1074434 575625 528071 338145 138323 628580 4712265 1406000 2568553 109984 1139123 229002 630765 1452953 1670882 1102873 130815 1709459 237402 1914292 1074454 3289198 1896849 2502436 712417 1832455 626431 4596395 372776 2375474 1023674 145038 3624460 641030 1389505 8132119 861664 1374273 1795048 478443 600593 4237751 825156 3545344 393511 3654584 1006180 1730753 3953713 Xanthine 1427983 862693 189147 398748 241710 225276 1015936 303904 986954 628380 59237 165210 8503 9041 267623 274703 562116 101658 149399 78769 222057 376073 36695 507 88135 1373406 450130 134716 185864 556545 24932 1287297 143311 430064 1176878 212882 846383 125640 33216 3332 16096 319182 256590 20706 875621 860051 65163 14433 1117266 535508 254067 398171 515752 317214 127173 214067 67468 21219 136209 136257 295611 134659 168664 22915 427225 342889 3369 12097 89278 181448 556666 110416 261478 12783 211729 259543 669541 19172 602195 43563 43508 714503 163689 581819 47904 332735 1054059 2636 1433835 128948 96698 502552 22705 127018 49442 235050 594360 94077 124720 198722 187200 159601 173193 132807 551783 83850 576320 89125 53187 111869 650518 209457 495782 589520 134948 615066 122063 624631 351089 72006 1007362 627002 358072 165562 221143 1006113 304079 2281047 73675 476035 401621 26071 736445 494744 42267 154609 19572 39883 71033 309704 785035 200895 45631 212597 1256167 192715 149175 699180 752317 365516 522679 73424 167639 211542 424748 alpha-Hydroxymetoprolol 3669 539 8244 38 1101 1897 1167 35 69 31 8573 5264 4821 51 49 97 465 715 883 1756 405 4365 4067 9827 11296 1765 89 109 43 282 293 44 628 761 1276 1517 3900 56 114 34 54 1186 810 2508 29 834 64 5 459 614 2339 33 44 308 50 297 551 2958 132 6591 878 1286 744 3316 6 5 3320 940 6141 1699 969 1653 863 52 25418 639 2579 2988 4634 1597 1829 63 1613 776 Biliverdin 242177 251327 154142 2025500 435097 887258 340604 2015735 267138 2563849 717054 1725261 2566498 1556233 3264402 155517 125660 371430 1067939 1075523 428524 563450 1406831 1670617 972429 87054 164011 487458 536454 2397929 874598 694486 317752 1694289 518880 740247 273293 1180206 610814 2362407 2517720 108506 1206658 100056 2633756 356758 431470 1223862 324350 2268932 1689598 564835 586798 1228252 754597 419851 634533 208738 1270395 911649 2236281 441377 675831 463091 1178365 127070 1471280 2375214 1776626 864858 2278604 859351 863972 2460877 322000 2153695 2118428 331472 105339 429308 1846241 115081 477193 478553 694662 1056451 419711 1303519 565864 654950 1076311 2040418 1401862 181459 375705 146524 390786 670461 297914 583966 510334 547169 962831 1174780 193912 2526363 131688 839801 801091 1756754 1190119 474418 1999229 2261833 3606437 1413535 167624 1559462 129650 495178 626301 797020 1036193 416843 1119286 765712 1338683 368736 669152 2002639 605928 1648438 1399965 1986743 1105143 1997659 2165090 761029 1099318 581377 732683 1787282 963578 793658 143627 984379 1004028 1844265 299072 361694 790981 1116601 681600 130510 1846424 Biopterin 342 511 5389 9364 524 2569 1674 31196 247 13651 10312 5661 19211 35074 6 327 450 22085 11940 8026 873 634 12671 14144 6411 373 143 9778 37658 12505 26675 687 770 21915 153 1064 626 23129 20206 32774 71694 394 8692 773 43698 509 795 19528 1149 11036 10414 263 550 1232 27557 264 8786 9462 23378 17508 21445 15589 285 27124 15531 826 22001 26486 22 966 12044 9402 4 5981 864 15020 21799 13266 628 2765 14684 451 4654 18843 6570 264 10926 1466 5489 10 11466 12131 983 7193 245 461 7192 19438 10809 2703 160 8310 12657 446 3695 131 6264 18634 269 20900 3547 10863 153 18880 13852 14826 303 15585 468 331 24033 17334 3367 2064 19266 107 17440 12405 17 7719 6372 11977 4229 40142 32934 7714 22 571 804 30352 19299 14056 433 16792 10555 39631 523 481 16776 18979 19201 261 10301 Caffeine 54993 39574 163673 165726 97747 9839 209942 541220 162351 19375 245969 98804 24 152 6 402527 372820 272195 49670 62362 3994 367815 1688 292 337 452891 450487 583410 336292 16248 17712 18831 157793 37726 88987 15505 41916 9755 36001 33974 417 98 18 22 10 13576 16146 43 4479 3520 5829 841 182 24357 64937 9955 10448 11131 10072 45374 96161 9079 58769 1 19 177 18777 15740 102 406 1 40644 42509 75131 94683 3968 21832 6414 27016 2419 2777 2859 88827 84 14225 176 22 138 12408 1360 7524 1 24 27579 18646 2385 27335 2061 7975 1034 12 14064 1651 37 347 47 67 75292 34 12211 107 4 56 1 2920 77 151 87 36286 13483 237 1 17 52 174 120243 7397 108 25743 10490 2993 9 36 42 64842 124 17498 19078 88199 11992 trans-3-Hydroxycotinine 21907 17825 27117 20764 23714 38 42 2726 360 716 275 14512 42 34 138 102 569 76 59 35 274 132 53 566 75 182 119 13283 6468 6760 6744 8558 42 89 82 199 35 141 460 346 70 170 47 60 26 250 22 7020 21 78 89 87 606 89 397 45 108 22 298 94 64 426 29 10959 12091 10592 9735 2765 267 40 27 216 3032 1775 1384 318 36 21 126 50 55 216 531 201 45 42 19 343 17 20 435 20 782 143 17 64 171 123 20 166 17 18 162 511 34 476 Imidazolepropionic acid 25287 38134 2911863 13928 2327036 9382 1303878 3481852 344091 617948 39677 491715 8282 8145 1662541 12353 44575 22379 955933 5942 2752 72722 1963 2347 2146 55114 137006 58626 10076 573426 163985 34358 632834 6472 76362 385795 85212 4954 1801253 1017556 4814 119464 2967 13396 4253 77921 1878565 250234 213711 544280 3929 8117 14687 2729866 1848233 15139 302129 16001 14608 1670634 1565073 249625 62676 5470 6646 13364 1760 6313 29372 1444526 508932 2492 84053 1874 1339723 2462 2471 8442 18805 2690660 5064 37684 1065252 45220 4817 5735 17008 5328 37740 51397 7990 474791 2371 112712 292753 60843 124177 13049 2564725 1249960 1288046 79135 3810 8816 15211 38698 29619 2322742 6571 401351 12138 889571 484582 1848663 4215 1840 10100 777 41444 2826197 212483 323477 9995 1514091 7327 254358 1325123 17538 1252566 3744 247379 1347 284453 526608 2767 28374 3928 2110 1072639 1253246 15725 12377 3141013 4582254 236874 2111 4421 2554 84748 20765 8076 808226 1455773 70275 406072 Leu-Gly 16604 7997 26864 76805 40743 5372 160320 57188 86330 79872 46953 24550 21320 64141 171965 21087 23065 22562 12789 10760 52341 24648 3481 14249 5842 19585 19825 22013 10305 80810 16937 53413 38493 9804 320975 66716 23732 9715 19513 4804 272 9050 3946 15975 18546 29353 12053 18869 10499 73652 7527 148858 31844 61587 79602 5173 21956 11305 28431 51142 93271 2576 11047 12717 7321 6897 28659 18539 240877 70174 76057 3944 237211 4132 68279 3883 7761 16209 8981 16172 43278 5698 198296 117407 30258 29006 206253 10288 316410 5614 401023 67854 9028 35129 28261 60142 66314 22948 12017 7743 48909 207550 7886 12882 90515 33069 67831 36409 75280 45476 8288 34714 71928 145223 27186 5293 43524 16023 72891 34755 86894 46254 18559 58542 9232 54769 37177 63763 32285 33244 232875 29692 243570 73614 8065 25814 33624 3276 182891 59519 14784 10880 13044 32169 14819 1748 4883 7834 52646 142512 2127 7774 29915 101348 56074 Metformin 2177 37782 2310 446 193 3440 10399 8953 1267 907 705 1995 756 3760 2586 3732 829 2760 931 585 5291 2351 275 591 1751 764 469 223 602 1035 3211 26 497 159 247 326 320 740 84 259 553 198 532 154 335 268 2696 201 987 664 452 584 241 176 8457 6642 4441 2293 429 1164 597 506 361 20891199 7399 1395 1088 3129 103 1105 485 430 489 473 513 593 801 1116 1129 453 1686 72 204 272 251 296 466 867 1370 1917 845 790 338 456 1049 3098 592 322 1136 314 278 411 764 1701 598 2595 953 1123 584 2217 903 827 1046 1300 216 4969 372 241 415 113 249 100 267 104 38 105 982 90 310 450 20560 160 965 149 24 102 1566 391 101 255 387 318 654 790 404 407 480 958 156 349 218 117 296 680 Methylimidazoleacetic acid 53283793 64381760 5860298 1642972 4058284 3252302 24902420 21032515 5778944 258699608 1257612 3059541 1711388 3433738 4342734 24494633 104129849 838742 6643369 837487 195123255 309773829 909707 1010482 1324893 33837582 40675052 1308411 788892 235650254 5681918 155364194 182675161 6281812 1323021035 9688268 54539069 1090549 5678321 2225272 2577464 628500628 1829108 510578169 1098903 815310963 118894505 15789970 1189938633 212447078 4169178 228521627 120474793 21300791 11571996 8287728 2188284 1003870 1978775 2428497 2319819 6214524 260986981 2081180 1008960 311711123 732306 817602 50743948 48458005 183102013 1097334 25780177 1102324 283483477 1259013 933802 609770 45171666 5375282 630143 146074609 678260590 643781103 12460065 8735317 1057131632 1287763 339533948 2070768 48178510 174735888 725989 1106684 1956279 24661308 29073200 916038 11960812 10673582 19737059 476276173 4787685 1077721 17626232 6681140 14923815 2859023 9883332 109208278 6130588 8131252 173250554 3870724 743684 1769325 55245935 1214151 538720638 26386511 852101761 1107001224 5943989 31697036 12062272 461724820 455541446 1429758010 105115907 1417447 12322358 567177 1791082228 195964644 2644813 1228107 1242342 1105354 3056478 18790169 71019725 608291 3407933 2881107 59344468 687977 539769 271111 66677489 522158828 1860277 2598485 14940759 29973973 144591019 alpha-N-Phenylacetylglutamine 35410 26585 80205 1096775 22823 644145 466858 40564273 14840 271992 1096015 35768 189020 889341 219 16161 7186 196333 43237 248791 16591 15360 870476 454684 595399 23462 30139 14117 347705 264937 18104 13888 16594 313629 5427 23356 40169 197879 84134 34983 50369 10592 585251 15073 91490 15596 31824 26829 24332 243397 680890 6426 58254 11338 28458 296250 1412366 1584011 169389 23590 19125 37893 11003 212706 165550 28012 338231 433380 1052 10161 244058 452726 617 329847 18373 482669 712940 23124 45806 30954 243391 22265 18198 7526 160458 304547 5742 286113 15398 408186 966 242224 460445 51122 565325 6866 22708 240200 63467 166478 8426 8433 400250 197666 26026 15155 3756 27763 211270 46175 340639 1021785 238940 6549 241401 147522 1806 227598 17539 616037 11043 20025 282749 27340 193750 17501 115344 10488 733735 338073 1162 703720 7442 240568 336871 903925 645122 549817 2628 10774 17384 630192 78931 29534 25847 681842 473278 4168 16566 206940 376573 60409 19624 240284 220138 Piperine 798829 70605 133400 214555 67975 21367 460652 61423 250008 274927 530639 291596 13881 23794 22094 2473835 66236 538920 140750 91487 97264 130436 41532 38355 32977 43429 1926570 1487335 703574 288928 152782 3072143 49763 38682 47063 92490 347593 1787931 1059715 2516697 33658 287698 31587 60851 32665 47817 12190 51403 23499 229449 49648 86750 13049 12376052 3098118 60875 861651 292629 94419 498488 4439 127850 423529 63792 6279 629230 30718 29878 13839 1073688 226836 30808 6914 3485 2474593 5014 49158 83902 2165881 78776 69510 69852 32312 771593 93650 93778 142940 39090 422024 20256 27208 212267 43450 1032573 269512 41785 8271 553224 52213 153786 67736 141495 957933 611533 531218 1026426 27884 240772 56367 12787 34308 196889 199881 301538 42582 51558 3503 63895 48023 314254 135876 263177 28098 129049 515131 167885 559285 14665 64576 34419 16344 23770 25015 234058 34009 15861 37300 25487 18834 319061 180597 54672 122780 63213 324337 46027 44300 31204 79236 155370 16749 41485 107198 49767 207012 Quinine 88 37172 181 38357 2938 3780 164 24 42946 670054 41 34844 826 258 228 273 1857 3623 31265 197 123 816446 25488 39 91 84 30472 177858 10 27104 244467 1281766 1087064 485243 23907 1021 29 31289 41 2503 29 417 36421 46 704 183 1425 25944 Sphingosine 598396 229929 812475 326519 1285469 557992 445286 183734 88915 1075615 83042 356314 1334278 3747251 434556 241998 769167 475861 536929 678948 915415 227601 2580658 493679 1074477 81440 244815 206564 152983 856106 945672 5762795 1346237 832886 2519282 565150 223298 457086 345398 121816 2220031 228837 545910 290400 1831028 366861 517045 573245 675166 792679 897537 264820 415320 742357 575582 352715 90227 140427 210781 369162 443532 325558 142443 245931 366133 172561 548983 520431 1962704 589396 777815 486019 1206062 1037328 671133 1557916 1226633 176952 56110 127433 160559 39360 1231511 1086526 1387434 628158 1283573 577084 377816 610117 303941 690568 1619084 45548 70115 122060 384120 237690 268132 208702 226206 365872 230889 350259 338849 604936 740722 172693 761685 632746 520486 153150 666304 2282301 1514066 1611677 329506 2532837 223462 924659 168838 369793 646771 1118573 338275 1246560 664061 1642914 370031 1781532 702272 899574 273395 676318 1283681 1355186 695997 318281 1496379 262648 1016740 472300 280841 568814 344192 1324143 868713 1250319 448698 355968 512653 316313 1100199 107131 558173 Trigonelline 2700014 2628052 137224190 65901688 345623324 61969389 503452043 1811409077 85872887 33751625 82577075 7461374 511621 748172 8518506 408146 2044877 177906573 79562893 493968841 3909258 2812962 451813 560216 1156157 1270881 2721934 17414118 74439944 34241871 11424230 16471589 10348821 45927920 7714628 5877731 141269221 4326485 11686597 6370203 988834 571148 903687 1198018 782635 820904 55889453 32096143 2408577 31886977 29909895 13623302 35748602 7666350 3092803 35027380 89681137 21039311 237386604 35518450 45345162 18941875 491757 33271985 18802561 2465208 346219 445530 10515180 3075772 27008731 470193 392296 792732 12822940 401434 556066 104026981 1601613 55831376 423541603 972843 1413651 6966087 29666515 79472679 10291519 326073 1176946 402643 1322809 25625313 366399 27699673 35694544 716684 19425640 89303855 16715510 4244109 17008507 13247818 105621622 64702409 2486789 73512585 384040 166441259 2615732 2731320 12337067 1984113 25867316 75508953 356181 427304 7896797 504041 48004288 18372828 1531826 3045572 4162383 14220054 87252676 16597641 8320098 8427176 6491754 922908 12287594 410089 40865099 27753392 936445 1169295 839519 537171 15911377 49673185 19435934 59075549 25883888 15832183 9695215 414715 151538 249460 4338330 37405941 3288156 4469287 4801911 59871090 21345878 Tryptamine 13062 8071 1496 180 793359 1255 5609 809432 318 53003 350017 68432 285 59 23927 1072 2867 78 971 163 142 151 167 86 1161 1284 876 1059 41218 730 3888 330247 261 145270 528 1784 235 6078 305 163 1022 58 348 618 111 25830 325 1743 36939 62 1720 31855 37196 2980 255 356162 527711 166 3186 3523 16681 81 82 18 297 31 385 34565 12314 33578 162 13475 31 1592 18 87 9282 255 1152 61 110 2782 438 153 50 666 87 22414 59 36503 31103 8345 14911 859 772 376 2006 329 1909 4709 18 811 214 291652 236 218436 99 83169 2207 30935 259572 41 45 222 115 334 13529 586 424 323239 313 12478 254372 23763 1198 148 316608 148 5032 34284 18 23421 91 28 141205 6915 2296 20 438 44746 3600 26 49 67 43 629 86 155 2590 26234 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name m/z RT (min) valine-d8 [iSTD] 126.1365 7.31 phenylalanine-d8 [iSTD] 174.1362 6.64 Glycine 76.0400 7.79 Alanine 90.0555 7.68 Serine 106.0502 7.53 Threonine 120.0656 7.50 Methionine 150.0581 6.93 Aspartic acid 134.0448 8.15 Glutamic acid 148.0602 7.49 Asparagine 133.0606 7.80 Glutamine 147.0762 7.91 Histidine 156.0768 9.48 Arginine 175.1187 9.07 Lysine 147.1126 9.30 Valine 118.0863 7.27 Leucine 132.1019 6.89 Isoleucine 132.1019 7.02 Phenylalanine 166.0863 6.65 Tyrosine 182.0812 6.73 Tryptophan 205.0972 6.44 Proline 116.0708 7.98 Hydroxyproline 132.0654 7.77 Ornithine 133.0972 9.31 Citrulline 176.1027 8.25 Taurine 126.0219 5.91 5-Hydroxyindoleacetic acid 192.0652 1.86 3-Amino-isobutanoic acid 104.0706 7.67 gamma-Aminobutyric acid 104.0710 7.51 Dimethylarginine 203.1503 9.73 Symmetric dimethyl-arginine 203.1503 9.65 Targinine 189.1343 9.29 Allantoin 159.0513 3.40 2-Aminobenzoic acid 138.0548 1.75 Kynurenic acid 190.0495 5.13 Histamine 112.0872 9.12 3-Hydroxyanthranilic acid 154.0497 1.82 Ureidopropionic acid 133.0607 4.00 Niacinamide 123.0554 3.63 Betaine 118.0864 8.85 Choline 104.1073 8.15 Choline phosphate 184.0733 12.55 sn-Glycero-3-phosphocholine 258.1096 10.35 Acetylcholine 146.1173 8.06 Spermidine 146.1652 10.55 Creatine 132.0766 8.20 Creatinine 114.0664 6.34 Trimethylamine N-oxide 76.0764 8.01 Adenosine 268.1035 4.85 Cytosine 112.0508 6.04 Thymidine 243.0976 2.80 Xanthosine 285.0830 4.20 Deoxyadenosine 252.1086 5.06 Deoxycytidine 228.0974 5.84 Cotinine 177.1020 4.93 Pipecolic acid 130.0862 7.86 1-Methyl nicotinamide 137.0708 8.11 Putrescine 89.1079 9.29 Methionine sulfoxide 166.0530 8.54 Anserine 241.1291 10.43 Carnitine 162.1122 8.73 CAR(2:0) 204.1227 8.58 CAR(3:0) 218.1383 8.23 CAR(DC3:0(2Me)) 262.1280 8.50 CAR(4:0) 232.1539 7.94 CAR(4:0(OH)) 248.1488 8.76 CAR(5:0) 246.1695 7.72 CAR(5:1) 244.1539 7.79 CAR(DC5:0) 276.1438 8.25 CAR(8:0) 288.2162 7.23 CAR(9:0) 302.2320 7.12 CAR(10:0) 316.2475 7.06 CAR(10:2) 312.2162 7.24 CAR(12:0) 344.2789 6.89 CAR(12:1) 342.2631 6.93 CAR(14:0) 372.3102 6.75 CAR(14:1) 370.2945 6.76 CAR(14:2) 368.2787 6.81 CAR(16:0) 400.3414 6.63 CAR(16:0(OH)) 416.3364 7.06 CAR(18:0) 428.3729 6.52 CAR(18:1) 426.3578 9.57 CAR(18:1(OH)) 442.3521 6.99 CAR(18:2) 424.3412 6.60 CAR(20:0) 456.4040 6.45 CAR(20:4) 448.3414 6.23 LPC(14:0) 468.3073 7.83 LPC(0:0/16:0) 496.3389 7.71 LPC(16:1) 494.3230 7.77 LPC(P-16:0)/LPC(O-16:1) 480.3441 7.55 LPC(18:0) 524.3703 7.58 LPC(18:1) 522.3546 7.63 LPC(P-18:0)/LPC(O-18:1)_A 508.3742 7.75 LPC(P-18:0)/LPC(O-18:1)_B 508.3740 7.42 LPC(0:0/18:2) 520.3391 7.71 LPC(18:3) 518.3210 7.70 LPC(20:1) 550.3845 7.54 LPC(20:3) 546.3523 7.60 LPC(20:4) 544.3388 6.65 LPE(16:0) 454.2920 6.21 LPE(18:0)_A 482.3233 6.14 LPE(18:0)_B 482.3231 7.77 LPE(18:1) 480.3073 6.16 LPE(18:2) 478.2915 6.18 LPE(18:3) 476.2765 6.22 SM(d18:1/16:0) 703.5734 7.20 1-Carboxymethylmetronidazole 186.0492 5.86 1-Methyladenosine 282.1191 7.55 2-Methylguanosine 298.1140 4.90 3-Methylhistidine 170.0922 9.85 Methylguanidine 74.0720 6.71 1-Methylguanine 166.0721 5.13 Trimethylbenzene 121.1013 1.65 1,7-Dimethyluric acid 197.0667 3.46 2'-O-Methyladenosine 282.1197 4.47 3-Dehydroxycarnitine 146.1176 8.72 4-Hydroxy-3-methylacetophenone 151.0751 1.65 4-Acetamidobutanoic acid 146.0810 3.36 5-Methylcytidine 258.1085 5.88 5-Methylcytosine 126.0662 6.16 5-Acetylamino-6-amino-3-methyluracil 199.0826 2.13 5-Hydroxylysine 163.1074 9.22 6,8-Dihydroxypurine 153.0405 4.14 7-Methylguanine 166.0721 5.62 Acetaminophen 152.0706 1.88 Adrenochrome 180.0655 9.53 Agmatine 131.1291 9.09 Atenolol 267.1699 6.83 3-Guanidinopropanoic acid 132.0767 7.37 Bilirubin 585.2695 1.58 Biotin 245.0951 3.75 Cadaverine 103.1233 9.25 Cytidine 244.0924 5.68 Ala-Ala 161.0918 7.78 Deoxyguanosine 268.1034 5.21 Dethiobiotin 215.1387 3.62 Ectoine 143.0813 8.81 Gly-Gly 133.0608 8.19 Guanidoacetic acid 118.0613 7.75 Guanine 152.0567 5.25 Guanosine 284.0983 5.10 L-Histidinol 142.0974 8.95 Hypoxanthine 137.0456 4.65 Imidazoleacetic acid 127.0502 8.06 Indole 118.0653 1.66 Inosine 269.0875 4.72 Isoxanthopterin 180.0513 4.09 L-Urobilin 595.3479 6.53 Linoleoyl-EA 324.2891 1.88 Methyl N-methylanthranilate 166.0863 1.69 Myristoleic acid 227.2006 1.60 N-Acetylglutamine 189.0867 6.80 N-Acetylleucine 174.1123 2.56 N-Acetylputrescine 131.1178 7.82 N-Acetylserotonin 219.1125 2.44 N-Acetylarginine 217.1291 8.07 N-Acetyl-D-galactosamine 222.0972 5.25 N-Acetylhistamine 154.0972 7.63 N-Acetyl-D-tryptophan 247.1072 2.78 N-Methyl-proline 130.0862 8.50 N-Methylserotonin 191.1176 6.22 N1-Methyl-2-pyridone-5-carboxamide 153.0656 4.17 N1-Acetylspermidine 188.1755 9.78 N1-Acetylspermine 245.2331 10.98 N1,N12-Diacetylspermine 287.2435 10.34 N2,N2-Dimethylguanosine 312.1295 5.20 N6-Acetyllysine 189.1230 8.27 N-6-Trimethyllysine 189.1594 11.17 Nicotinic acid 124.0394 3.54 N-Oleoyl glycine 340.2841 2.14 Pantothenol 206.1384 3.73 Phytosphingosine 318.3003 5.83 Pseudouridine 245.0763 3.92 Pterin 164.0567 4.62 Pyridoxamine 169.0970 9.26 Pyridoxine 170.0812 6.06 Ribothymidine 259.0925 2.85 Sphinganine 302.3047 5.73 Uric acid 169.0353 4.15 Urocanic acid 139.0500 4.43 Xanthine 153.0405 3.60 alpha-Hydroxymetoprolol 284.1850 6.72 Biliverdin 583.2542 1.88 Biopterin 238.0930 5.00 Caffeine 195.0874 2.77 trans-3-Hydroxycotinine 193.0969 4.84 Imidazolepropionic acid 141.0656 7.34 Leu-Gly 189.1231 7.27 Metformin 130.1087 7.16 Methylimidazoleacetic acid 141.0659 8.78 alpha-N-Phenylacetylglutamine 265.1177 4.48 Piperine 286.1432 1.85 Quinine 325.1904 6.30 Sphingosine 300.2891 5.71 Trigonelline 138.0550 8.73 Tryptamine 161.1071 6.05 METABOLITES_END #END