#METABOLOMICS WORKBENCH KWhytock_20201026_071615_mwtab.txt DATATRACK_ID:2223 STUDY_ID:ST001515 ANALYSIS_ID:AN002513 PROJECT_ID:PR001022 VERSION 1 CREATED_ON November 3, 2020, 4:46 pm #PROJECT PR:PROJECT_TITLE Effects of glucagon infusion on plasma metabolome in individuals with PR:PROJECT_TITLE overweight/obesity PR:PROJECT_SUMMARY Objective: We sought to identify the circulating metabolites that would serve as PR:PROJECT_SUMMARY markers of glucagon action. Design: In this study, we performed a continuous PR:PROJECT_SUMMARY 72-hour glucagon infusion in healthy individuals with overweight/obesity. PR:PROJECT_SUMMARY Participants were randomized to either glucagon (12.5 ng/kg/min) (GCG 12.5) or PR:PROJECT_SUMMARY glucagon (25 ng/kg/min) GCG 25 or a placebo control were included. A PR:PROJECT_SUMMARY comprehensive metabolomics analysis was then performed from plasma isolated at PR:PROJECT_SUMMARY several time points during the infusion to identify markers of glucagon PR:PROJECT_SUMMARY activity. PR:INSTITUTE Translational Research Institute- AdventHealth Orlando PR:LAST_NAME Whytock PR:FIRST_NAME Katie PR:ADDRESS 301 E Princeton St, FL, USA, 32804 PR:EMAIL Katie.Whytock@adventhealth.com PR:PHONE 3219459982 PR:FUNDING_SOURCE Sanofi #STUDY ST:STUDY_TITLE A Metabolomic Signature of Glucagon Action in Healthy Individuals with ST:STUDY_TITLE Overweight/Obesity Humans ST:STUDY_SUMMARY Objective: We sought to identify the circulating metabolites that would serve as ST:STUDY_SUMMARY markers of glucagon action. Design: In this study, we performed a continuous ST:STUDY_SUMMARY 72-hour glucagon infusion in healthy individuals with overweight/obesity. ST:STUDY_SUMMARY Participants were randomized to either glucagon (12.5 ng/kg/min) (GCG 12.5) or ST:STUDY_SUMMARY glucagon (25 ng/kg/min) GCG 25 or a placebo control were included. A ST:STUDY_SUMMARY comprehensive metabolomics analysis was then performed from plasma isolated at ST:STUDY_SUMMARY several time points during the infusion to identify markers of glucagon ST:STUDY_SUMMARY activity. ST:INSTITUTE Translational Research Institute- AdventHealth Orlando ST:LAST_NAME Whytock ST:FIRST_NAME Katie ST:ADDRESS 301 E Princeton St, Orlando, FL, 32804 ST:EMAIL Katie.Whytock@adventhealth.com ST:PHONE 321-945-9982 ST:NUM_GROUPS 3 ST:TOTAL_SUBJECTS 33 #SUBJECT SU:SUBJECT_TYPE Human SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 #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 HD1 FLHP-00006-01 Group:High-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD1 FLHP-00007-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS HD1 FLHP-00008-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD1 FLHP-00009-01 Group:High-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD1 FLHP-00010-01 Group:High-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD1 FLHP-00011-01 Group:High-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD2 FLHP-00012-01 Group:High-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD2 FLHP-00013-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS HD2 FLHP-00014-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD2 FLHP-00015-01 Group:High-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD2 FLHP-00016-01 Group:High-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo1 FLHP-00017-01 Group:Placebo | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo1 FLHP-00018-01 Group:Placebo | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo1 FLHP-00019-01 Group:Placebo | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS Placebo1 FLHP-00020-01 Group:Placebo | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo1 FLHP-00021-01 Group:Placebo | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo1 FLHP-00022-01 Group:Placebo | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD3 FLHP-00023-01 Group:High-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD3 FLHP-00024-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD3 FLHP-00025-01 Group:High-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD3 FLHP-00026-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS HD3 FLHP-00027-01 Group:High-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD3 FLHP-00028-01 Group:High-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD1 FLHP-00029-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD1 FLHP-00030-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD1 FLHP-00031-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD1 FLHP-00032-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD1 FLHP-00033-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD1 FLHP-00034-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD4 FLHP-00035-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS HD4 FLHP-00036-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD4 FLHP-00037-01 Group:High-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD4 FLHP-00038-01 Group:High-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD4 FLHP-00039-01 Group:High-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD4 FLHP-00040-01 Group:High-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo2 FLHP-00041-01 Group:Placebo | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo2 FLHP-00042-01 Group:Placebo | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS Placebo2 FLHP-00043-01 Group:Placebo | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS Placebo2 FLHP-00044-01 Group:Placebo | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo2 FLHP-00045-01 Group:Placebo | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo2 FLHP-00046-01 Group:Placebo | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo3 FLHP-00047-01 Group:Placebo | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo3 FLHP-00048-01 Group:Placebo | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS Placebo3 FLHP-00049-01 Group:Placebo | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo3 FLHP-00050-01 Group:Placebo | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS Placebo3 FLHP-00051-01 Group:Placebo | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo3 FLHP-00052-01 Group:Placebo | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD5 FLHP-00053-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS HD5 FLHP-00054-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD5 FLHP-00055-01 Group:High-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD5 FLHP-00056-01 Group:High-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD5 FLHP-00057-01 Group:High-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD5 FLHP-00058-01 Group:High-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD6 FLHP-00059-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS HD6 FLHP-00060-01 Group:High-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD6 FLHP-00061-01 Group:High-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD6 FLHP-00062-01 Group:High-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD6 FLHP-00063-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD2 FLHP-00064-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD2 FLHP-00065-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD2 FLHP-00066-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD2 FLHP-00067-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD2 FLHP-00068-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD2 FLHP-00069-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo4 FLHP-00070-01 Group:Placebo | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo4 FLHP-00071-01 Group:Placebo | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo4 FLHP-00072-01 Group:Placebo | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS Placebo4 FLHP-00073-01 Group:Placebo | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo4 FLHP-00074-01 Group:Placebo | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD3 FLHP-00075-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD3 FLHP-00076-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD3 FLHP-00077-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD3 FLHP-00078-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD3 FLHP-00079-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD3 FLHP-00080-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS Placebo5 FLHP-00081-01 Group:Placebo | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo5 FLHP-00082-01 Group:Placebo | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo5 FLHP-00083-01 Group:Placebo | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo5 FLHP-00084-01 Group:Placebo | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS Placebo5 FLHP-00085-01 Group:Placebo | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS HD7 FLHP-00086-01 Group:High-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD7 FLHP-00087-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD7 FLHP-00088-01 Group:High-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD7 FLHP-00089-01 Group:High-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD7 FLHP-00090-01 Group:High-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD7 FLHP-00091-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS Placebo6 FLHP-00092-01 Group:Placebo | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo6 FLHP-00093-01 Group:Placebo | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo6 FLHP-00094-01 Group:Placebo | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo6 FLHP-00095-01 Group:Placebo | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo6 FLHP-00096-01 Group:Placebo | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS Placebo6 FLHP-00097-01 Group:Placebo | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD4 FLHP-00098-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD4 FLHP-00099-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD4 FLHP-00100-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD4 FLHP-00101-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD4 FLHP-00102-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo7 FLHP-00103-01 Group:Placebo | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS Placebo7 FLHP-00104-01 Group:Placebo | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo7 FLHP-00105-01 Group:Placebo | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo7 FLHP-00106-01 Group:Placebo | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo7 FLHP-00107-01 Group:Placebo | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo7 FLHP-00108-01 Group:Placebo | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD8 FLHP-00109-01 Group:High-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD8 FLHP-00110-01 Group:High-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD8 FLHP-00111-01 Group:High-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD8 FLHP-00112-01 Group:High-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD8 FLHP-00113-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD8 FLHP-00114-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD5 FLHP-00115-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD5 FLHP-00116-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD5 FLHP-00117-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD5 FLHP-00118-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD5 FLHP-00119-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD5 FLHP-00120-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD6 FLHP-00121-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD6 FLHP-00122-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD6 FLHP-00123-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD6 FLHP-00124-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo8 FLHP-00125-01 Group:Placebo | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS Placebo8 FLHP-00126-01 Group:Placebo | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo8 FLHP-00127-01 Group:Placebo | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo8 FLHP-00128-01 Group:Placebo | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo8 FLHP-00129-01 Group:Placebo | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD7 FLHP-00130-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD7 FLHP-00131-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD7 FLHP-00132-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD7 FLHP-00133-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD7 FLHP-00134-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD8 FLHP-00135-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD8 FLHP-00136-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD8 FLHP-00137-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD8 FLHP-00138-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD8 FLHP-00139-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD8 FLHP-00140-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD9 FLHP-00141-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD9 FLHP-00142-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD9 FLHP-00143-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD9 FLHP-00144-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD9 FLHP-00145-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD9 FLHP-00146-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD9 FLHP-00147-01 Group:High-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD9 FLHP-00148-01 Group:High-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD9 FLHP-00149-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS HD9 FLHP-00150-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD9 FLHP-00151-01 Group:High-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD9 FLHP-00152-01 Group:High-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD10 FLHP-00153-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD10 FLHP-00154-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD10 FLHP-00155-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD10 FLHP-00156-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD10 FLHP-00157-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD10 FLHP-00158-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS Placebo9 FLHP-00159-01 Group:Placebo | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo9 FLHP-00160-01 Group:Placebo | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS Placebo9 FLHP-00161-01 Group:Placebo | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo9 FLHP-00162-01 Group:Placebo | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo9 FLHP-00163-01 Group:Placebo | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo9 FLHP-00164-01 Group:Placebo | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS Placebo10 FLHP-00165-01 Group:Placebo | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo10 FLHP-00166-01 Group:Placebo | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo10 FLHP-00167-01 Group:Placebo | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo10 FLHP-00168-01 Group:Placebo | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS Placebo10 FLHP-00169-01 Group:Placebo | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS Placebo10 FLHP-00170-01 Group:Placebo | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS HD10 FLHP-00171-01 Group:High-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD10 FLHP-00172-01 Group:High-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD10 FLHP-00173-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD10 FLHP-00174-01 Group:High-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD10 FLHP-00175-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD11 FLHP-00176-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD11 FLHP-00177-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD11 FLHP-00178-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD11 FLHP-00179-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD11 FLHP-00180-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD11 FLHP-00181-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS HD11 FLHP-00182-01 Group:High-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD11 FLHP-00183-01 Group:High-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD11 FLHP-00184-01 Group:High-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS HD11 FLHP-00185-01 Group:High-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS HD11 FLHP-00186-01 Group:High-Dose | TIMEPOINT:+23HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD12 FLHP-00187-01 Group:Low-Dose | TIMEPOINT:BASELINE SUBJECT_SAMPLE_FACTORS LD12 FLHP-00188-01 Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD12 FLHP-00189-01 Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD12 FLHP-00190-01 Group:Low-Dose | TIMEPOINT:-0.5HR SUBJECT_SAMPLE_FACTORS LD12 FLHP-00191-01 Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION SUBJECT_SAMPLE_FACTORS LD12 FLHP-00192-01 Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION #COLLECTION CO:COLLECTION_SUMMARY Samples were homogenized and subjected to methanol extraction then split into CO:COLLECTION_SUMMARY aliquots for analysis CO:SAMPLE_TYPE Blood (plasma) #TREATMENT TR:TREATMENT_SUMMARY Study subjects were admitted to the Clinical Research Unit (CRU) at the TR:TREATMENT_SUMMARY Translational Research Institute (TRI) at AdventHealth for 5 overnight stays. TR:TREATMENT_SUMMARY The first 2 overnight stays were used as baseline. On the 2nd day (Day -1), a TR:TREATMENT_SUMMARY baseline blood draw (-24 hours) was performed. On Day 1, a blood draw was again TR:TREATMENT_SUMMARY taken approximately 30 minutes prior to the start of the glucagon infusion. The TR:TREATMENT_SUMMARY study subjects began a ramped infusion (first 4 hours) of either saline TR:TREATMENT_SUMMARY (Placebo), Low Dose Glucagon (12.5ng/kg/min) or High Dose Glucagon (25ng/kg/min) TR:TREATMENT_SUMMARY for the next 72 hours (Inpatient). The Glucagon (GlucaGen, Novo Nordisk, TR:TREATMENT_SUMMARY Bagsværd Denmark) was administered under an FDA-approved IND (#136634). TR:TREATMENT_SUMMARY Intravenous (IV) bags of the study medication were hung together on an IV pole TR:TREATMENT_SUMMARY and changed out every 24 hours to provide a continuous infusion. With the TR:TREATMENT_SUMMARY exception of the 4-hour time point, all draws were performed in the overnight TR:TREATMENT_SUMMARY fasted state. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Briefly, samples were homogenized and subjected to methanol extraction then SP:SAMPLEPREP_SUMMARY split into aliquots for analysis by ultrahigh performance liquid SP:SAMPLEPREP_SUMMARY chromatography/mass spectrometry (UHPLC/MS) in the positive (two methods) and SP:SAMPLEPREP_SUMMARY negative (two methods) mode. Metabolites were then identified by automated SP:SAMPLEPREP_SUMMARY comparison of ion features to a reference library of chemical standards followed SP:SAMPLEPREP_SUMMARY by visual inspection for quality control. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Waters Acquity CH:COLUMN_NAME Waters Acquity BEH C18 (100 x 2mm, 1.7um) #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE NEGATIVE MS:MS_COMMENTS Proprietary analytical software for integration and peak picking #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS scaled units MS_METABOLITE_DATA_START Samples FLHP-00006-01 FLHP-00007-01 FLHP-00008-01 FLHP-00009-01 FLHP-00010-01 FLHP-00011-01 FLHP-00012-01 FLHP-00013-01 FLHP-00014-01 FLHP-00015-01 FLHP-00016-01 FLHP-00017-01 FLHP-00018-01 FLHP-00019-01 FLHP-00020-01 FLHP-00021-01 FLHP-00022-01 FLHP-00023-01 FLHP-00024-01 FLHP-00025-01 FLHP-00026-01 FLHP-00027-01 FLHP-00028-01 FLHP-00029-01 FLHP-00030-01 FLHP-00031-01 FLHP-00032-01 FLHP-00033-01 FLHP-00034-01 FLHP-00035-01 FLHP-00036-01 FLHP-00037-01 FLHP-00038-01 FLHP-00039-01 FLHP-00040-01 FLHP-00041-01 FLHP-00042-01 FLHP-00043-01 FLHP-00044-01 FLHP-00045-01 FLHP-00046-01 FLHP-00047-01 FLHP-00048-01 FLHP-00049-01 FLHP-00050-01 FLHP-00051-01 FLHP-00052-01 FLHP-00053-01 FLHP-00054-01 FLHP-00055-01 FLHP-00056-01 FLHP-00057-01 FLHP-00058-01 FLHP-00059-01 FLHP-00060-01 FLHP-00061-01 FLHP-00062-01 FLHP-00063-01 FLHP-00064-01 FLHP-00065-01 FLHP-00066-01 FLHP-00067-01 FLHP-00068-01 FLHP-00069-01 FLHP-00070-01 FLHP-00071-01 FLHP-00072-01 FLHP-00073-01 FLHP-00074-01 FLHP-00075-01 FLHP-00076-01 FLHP-00077-01 FLHP-00078-01 FLHP-00079-01 FLHP-00080-01 FLHP-00081-01 FLHP-00082-01 FLHP-00083-01 FLHP-00084-01 FLHP-00085-01 FLHP-00086-01 FLHP-00087-01 FLHP-00088-01 FLHP-00089-01 FLHP-00090-01 FLHP-00091-01 FLHP-00092-01 FLHP-00093-01 FLHP-00094-01 FLHP-00095-01 FLHP-00096-01 FLHP-00097-01 FLHP-00098-01 FLHP-00099-01 FLHP-00100-01 FLHP-00101-01 FLHP-00102-01 FLHP-00103-01 FLHP-00104-01 FLHP-00105-01 FLHP-00106-01 FLHP-00107-01 FLHP-00108-01 FLHP-00109-01 FLHP-00110-01 FLHP-00111-01 FLHP-00112-01 FLHP-00113-01 FLHP-00114-01 FLHP-00115-01 FLHP-00116-01 FLHP-00117-01 FLHP-00118-01 FLHP-00119-01 FLHP-00120-01 FLHP-00121-01 FLHP-00122-01 FLHP-00123-01 FLHP-00124-01 FLHP-00125-01 FLHP-00126-01 FLHP-00127-01 FLHP-00128-01 FLHP-00129-01 FLHP-00130-01 FLHP-00131-01 FLHP-00132-01 FLHP-00133-01 FLHP-00134-01 FLHP-00135-01 FLHP-00136-01 FLHP-00137-01 FLHP-00138-01 FLHP-00139-01 FLHP-00140-01 FLHP-00141-01 FLHP-00142-01 FLHP-00143-01 FLHP-00144-01 FLHP-00145-01 FLHP-00146-01 FLHP-00147-01 FLHP-00148-01 FLHP-00149-01 FLHP-00150-01 FLHP-00151-01 FLHP-00152-01 FLHP-00153-01 FLHP-00154-01 FLHP-00155-01 FLHP-00156-01 FLHP-00157-01 FLHP-00158-01 FLHP-00159-01 FLHP-00160-01 FLHP-00161-01 FLHP-00162-01 FLHP-00163-01 FLHP-00164-01 FLHP-00165-01 FLHP-00166-01 FLHP-00167-01 FLHP-00168-01 FLHP-00169-01 FLHP-00170-01 FLHP-00171-01 FLHP-00172-01 FLHP-00173-01 FLHP-00174-01 FLHP-00175-01 FLHP-00176-01 FLHP-00177-01 FLHP-00178-01 FLHP-00179-01 FLHP-00180-01 FLHP-00181-01 FLHP-00182-01 FLHP-00183-01 FLHP-00184-01 FLHP-00185-01 FLHP-00186-01 FLHP-00187-01 FLHP-00188-01 FLHP-00189-01 FLHP-00190-01 FLHP-00191-01 FLHP-00192-01 Factors Group:High-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:BASELINE Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:+71HR POST INFUSION Group:High-Dose | TIMEPOINT:+47HR POST INFUSION Group:High-Dose | TIMEPOINT:+23HR POST INFUSION Group:High-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:BASELINE Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:+47HR POST INFUSION Group:High-Dose | TIMEPOINT:+23HR POST INFUSION Group:Placebo | TIMEPOINT:+4HR POST INFUSION Group:Placebo | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:BASELINE Group:Placebo | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:+23HR POST INFUSION Group:Placebo | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:+71HR POST INFUSION Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:+23HR POST INFUSION Group:High-Dose | TIMEPOINT:BASELINE Group:High-Dose | TIMEPOINT:+47HR POST INFUSION Group:High-Dose | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:BASELINE Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:+71HR POST INFUSION Group:High-Dose | TIMEPOINT:+23HR POST INFUSION Group:High-Dose | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:+4HR POST INFUSION Group:Placebo | TIMEPOINT:BASELINE Group:Placebo | TIMEPOINT:-0.5HR Group:Placebo | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:+23HR POST INFUSION Group:Placebo | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:BASELINE Group:Placebo | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:-0.5HR Group:Placebo | TIMEPOINT:+23HR POST INFUSION Group:Placebo | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:BASELINE Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:+23HR POST INFUSION Group:High-Dose | TIMEPOINT:+47HR POST INFUSION Group:High-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:+71HR POST INFUSION Group:High-Dose | TIMEPOINT:BASELINE Group:High-Dose | TIMEPOINT:+71HR POST INFUSION Group:High-Dose | TIMEPOINT:+23HR POST INFUSION Group:High-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:-0.5HR Group:Placebo | TIMEPOINT:+4HR POST INFUSION Group:Placebo | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Low-Dose | TIMEPOINT:BASELINE Group:Placebo | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:+4HR POST INFUSION Group:Placebo | TIMEPOINT:-0.5HR Group:Placebo | TIMEPOINT:BASELINE Group:High-Dose | TIMEPOINT:+47HR POST INFUSION Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:+23HR POST INFUSION Group:High-Dose | TIMEPOINT:+71HR POST INFUSION Group:High-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:BASELINE Group:Placebo | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:+23HR POST INFUSION Group:Placebo | TIMEPOINT:+4HR POST INFUSION Group:Placebo | TIMEPOINT:BASELINE Group:Placebo | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Placebo | TIMEPOINT:BASELINE Group:Placebo | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:+4HR POST INFUSION Group:Placebo | TIMEPOINT:+23HR POST INFUSION Group:Placebo | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:+47HR POST INFUSION Group:High-Dose | TIMEPOINT:+23HR POST INFUSION Group:High-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:+71HR POST INFUSION Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:BASELINE Group:Placebo | TIMEPOINT:+23HR POST INFUSION Group:Placebo | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:+4HR POST INFUSION Group:Placebo | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Low-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:+71HR POST INFUSION Group:High-Dose | TIMEPOINT:+23HR POST INFUSION Group:High-Dose | TIMEPOINT:BASELINE Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Low-Dose | TIMEPOINT:BASELINE Group:Placebo | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:BASELINE Group:Placebo | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:+23HR POST INFUSION Group:Placebo | TIMEPOINT:+4HR POST INFUSION Group:Placebo | TIMEPOINT:-0.5HR Group:Placebo | TIMEPOINT:+71HR POST INFUSION Group:Placebo | TIMEPOINT:+4HR POST INFUSION Group:Placebo | TIMEPOINT:+23HR POST INFUSION Group:Placebo | TIMEPOINT:-0.5HR Group:Placebo | TIMEPOINT:+47HR POST INFUSION Group:Placebo | TIMEPOINT:BASELINE Group:High-Dose | TIMEPOINT:+47HR POST INFUSION Group:High-Dose | TIMEPOINT:+71HR POST INFUSION Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:High-Dose | TIMEPOINT:+71HR POST INFUSION Group:High-Dose | TIMEPOINT:+4HR POST INFUSION Group:High-Dose | TIMEPOINT:+47HR POST INFUSION Group:High-Dose | TIMEPOINT:BASELINE Group:High-Dose | TIMEPOINT:+23HR POST INFUSION Group:Low-Dose | TIMEPOINT:BASELINE Group:Low-Dose | TIMEPOINT:+71HR POST INFUSION Group:Low-Dose | TIMEPOINT:+4HR POST INFUSION Group:Low-Dose | TIMEPOINT:-0.5HR Group:Low-Dose | TIMEPOINT:+47HR POST INFUSION Group:Low-Dose | TIMEPOINT:+23HR POST INFUSION (14 or 15)-methylpalmitate (a17:0 or i17:0) 1.1107 0.7256 0.2785 0.6369 0.7928 0.4074 1.1838 1.2262 0.3957 0.9571 0.6378 1.8444 1.8211 1.0000 0.9201 1.0157 1.2762 1.0188 0.4636 2.3808 0.7196 2.9098 1.4692 1.0576 0.7934 0.9130 0.7500 3.0086 1.3994 0.7184 0.8313 0.9082 1.5286 1.1397 0.7535 4.4191 2.7414 1.5446 1.6309 1.8740 1.1207 0.9750 0.8065 0.5992 0.6585 0.5902 0.9890 0.7322 0.5186 1.7336 2.8717 2.5540 1.4267 0.8456 0.8905 0.9700 0.8630 0.3969 0.3405 0.6417 0.9373 1.0433 0.7327 0.8527 0.8696 0.7805 1.1139 1.8830 1.1187 0.8920 1.2380 0.4868 2.6665 1.1353 1.0562 0.6579 0.6733 1.2422 0.8879 0.7010 0.9643 0.2654 0.6035 1.1446 1.4934 0.8190 0.6584 0.6512 0.7422 1.2045 0.9024 0.9812 0.6732 0.6553 0.7000 0.8372 0.5501 2.5661 1.0432 0.7364 1.3009 0.7752 1.7934 0.7375 0.6167 0.6573 1.7071 0.3083 0.6421 1.9127 0.8009 0.6555 2.1617 0.9853 2.1201 2.6355 1.3564 0.8547 0.9383 1.2180 0.9318 1.6352 2.3856 1.3597 1.0896 1.1328 0.5569 1.3141 1.3236 0.8837 1.2219 1.0278 0.5962 1.0332 1.2964 0.8767 0.3843 0.9212 1.7928 1.1274 1.1671 1.9922 2.8166 1.1151 0.5357 1.3049 1.0357 0.6270 1.0806 0.5914 2.8894 0.8066 1.0004 1.1827 1.3222 1.2375 0.9296 1.4575 2.7127 0.7335 1.1712 0.4851 1.4414 0.8028 1.9516 1.1199 1.1591 1.2197 2.5567 0.8213 0.9695 0.4616 0.9889 2.1772 1.4247 4.4070 1.0581 0.3667 1.4188 1.4138 1.2055 0.8756 1.5036 0.8299 1.4159 1.4391 0.6105 (16 or 17)-methylstearate (a19:0 or i19:0) 0.9114 0.6288 0.2103 0.8242 0.9480 0.3984 1.2683 1.1260 0.4150 0.8763 0.6517 1.3261 1.8358 0.9014 1.0455 0.8461 1.0045 1.1580 0.4689 2.6610 0.8698 3.7426 1.4164 0.9984 0.7983 0.8397 0.7662 2.7336 1.0183 0.7242 0.8117 0.9122 1.5599 1.5767 0.9193 2.9830 2.7224 1.2155 1.2423 1.2780 1.1577 1.2086 0.9661 0.7355 0.7771 0.8872 1.0000 0.7196 0.6669 1.9692 2.6584 2.1675 1.8354 0.9427 1.0611 0.9940 0.8769 0.4415 0.3777 0.7393 0.9966 1.0025 0.6527 1.0116 1.0361 0.7845 0.8117 1.5027 1.0016 0.9371 1.3030 0.5446 1.9481 1.0716 0.8770 0.9200 0.5793 1.5596 0.7330 0.7113 1.1211 0.3328 0.7144 1.2917 1.5979 0.9219 0.9560 0.8538 0.8400 1.2851 0.8562 1.0618 0.8864 0.7221 0.7223 0.7539 0.7723 2.4273 1.0356 0.7524 1.3633 1.0997 1.8724 0.8580 0.7417 0.7316 2.0361 0.2908 0.8312 1.6397 0.8609 0.7750 2.5597 1.4922 2.0912 2.8995 2.0940 0.9782 1.0350 1.0456 1.0731 1.3965 2.2577 1.1879 0.8989 0.9708 0.5341 1.2423 1.0633 0.9685 1.1240 1.1324 0.5865 1.2098 1.5419 0.8082 0.5309 0.8293 1.4031 1.1160 0.9999 2.9194 2.6797 1.0857 0.5694 1.2232 1.2921 0.4897 0.9022 0.7715 2.4610 0.9918 0.8796 1.4512 1.0042 0.9392 0.9301 1.2152 2.3080 0.9537 1.1562 0.5643 1.1021 0.9555 1.8514 1.1493 0.9967 1.4011 2.3159 0.6329 1.0614 0.5185 1.0181 2.2057 1.6239 3.7760 0.9179 0.3283 1.3356 1.1806 1.0685 0.9162 1.7277 0.8220 1.6396 1.8945 0.6133 (2 or 3)-decenoate (10:1n7 or n8) 3.4375 1.6737 0.2027 1.5523 1.3996 0.6444 1.0363 0.7474 0.2651 0.5514 0.5512 2.1658 1.2979 1.2518 1.5323 1.6442 2.0739 1.2699 0.2376 1.5831 0.4730 1.2543 1.7597 0.9272 0.8674 0.6135 0.3680 1.1486 1.1170 0.8311 0.5788 0.9328 0.7757 1.1750 1.0298 1.8448 0.8795 1.2045 1.2996 1.3910 1.2075 0.7945 0.6874 0.7922 0.8510 1.4830 1.3941 0.1896 0.5683 0.7530 1.0007 1.1106 0.8983 0.7390 0.7889 0.9074 0.7135 0.2748 0.4494 1.1994 1.0196 1.3635 0.8022 1.1778 1.6777 1.0986 0.8421 1.2792 0.9142 0.6263 0.7472 0.5197 1.0190 0.9538 0.7067 0.9042 0.7107 1.4162 1.6625 0.6221 1.2779 0.2413 0.5675 1.0154 1.2254 0.9566 1.0061 0.6888 0.8117 0.1896 0.8748 1.4493 0.6408 0.9939 1.0886 0.9354 0.8906 1.0709 1.4766 0.9407 1.8265 1.3236 1.4452 1.1378 1.4988 0.9200 1.3377 0.2930 0.9293 0.9782 0.4184 0.2838 0.7421 1.0663 0.9973 1.6653 1.2171 1.0259 1.5081 0.6440 0.7031 1.7451 0.9519 1.1638 1.1041 0.7808 0.1896 0.8826 1.0461 0.8934 1.9073 1.0094 0.5180 1.2084 1.2938 0.1896 0.6030 1.6050 0.1896 2.3572 1.4323 1.1549 1.3748 0.8923 0.4855 2.5740 1.0757 0.6536 1.0318 0.5490 2.7869 1.1409 1.1272 1.2227 1.0706 1.2128 1.0349 1.7310 1.3293 1.0704 1.9125 0.7551 1.3429 0.9261 0.8278 0.7358 0.8428 0.3069 1.0946 0.4455 0.7090 0.1896 0.6923 0.9510 1.0000 1.1657 0.9769 0.3387 0.8540 0.6890 1.2588 0.1896 1.1769 0.3680 1.0685 0.9009 0.6815 1,2,3-benzenetriol sulfate (2) 2.4904 8.1225 1.6145 2.2731 4.4620 8.4900 0.1478 0.1478 0.1478 0.1478 0.7141 2.4016 2.2958 1.1884 2.3777 11.8495 1.8737 2.1200 0.5320 16.5817 4.9083 0.9693 1.1899 3.1298 0.4119 13.9817 0.4695 2.1369 1.2814 4.3657 1.0202 2.0699 1.1789 18.9068 7.1909 0.1478 0.8703 0.3247 0.5973 9.5573 0.3313 0.1666 0.1478 0.1549 0.1478 0.4267 0.1478 0.1478 0.1478 0.3604 0.1478 0.1478 0.1478 0.1478 0.1478 0.1478 0.1478 0.1478 0.1478 0.6567 0.1478 0.1478 0.1478 0.1478 0.4568 0.7967 0.8422 0.4488 0.5101 0.2409 0.3912 7.0237 0.3442 0.3399 1.3444 0.3837 0.1874 0.1478 0.1478 0.2024 0.2289 0.1478 2.3003 0.4634 0.3055 0.1478 0.9574 0.5712 3.4674 0.1478 0.6517 0.1478 4.6366 0.7243 7.9407 1.6350 0.8539 0.6101 0.9798 0.7574 0.7522 19.7055 0.5735 1.4531 9.4372 2.5293 3.3301 1.6155 6.8865 0.1478 0.1478 0.1478 2.7775 0.2321 0.1872 0.1478 0.1478 0.1991 0.1478 0.1478 0.5803 0.3692 0.1478 0.1478 0.1478 0.1478 0.1478 0.1478 0.9004 0.1478 0.1478 3.4455 0.1478 0.1478 0.1478 1.0244 0.1478 1.1678 0.1496 0.2419 0.1676 0.4633 1.3954 0.1888 0.1478 0.1478 0.1478 29.1407 1.0000 1.2482 0.7904 1.0937 2.6973 1.9649 0.6315 0.1478 2.6764 0.1478 0.1478 2.7467 0.8283 9.3236 1.4700 0.7824 3.0785 0.1478 0.1478 0.1478 0.1478 0.1478 0.3255 0.1478 0.3410 0.1478 1.2964 0.1478 0.1478 0.1478 0.1478 0.1478 1.1316 1.9310 0.1561 0.1478 0.8930 0.2322 1.0927 1,5-anhydroglucitol (1,5-AG) 1.2758 1.2948 1.1421 1.1079 1.0941 1.2486 0.7603 0.7676 0.9216 0.7789 0.8016 1.2026 0.9875 0.9854 1.1612 1.0708 1.1064 1.1406 1.2474 1.0891 1.3609 1.1459 1.2386 0.9806 0.8333 0.7776 0.9192 0.9563 1.0217 1.8125 1.5258 1.7850 1.5406 1.7300 1.6613 1.1633 1.1494 0.8783 1.0958 1.0176 1.0523 1.2461 1.2647 1.3577 1.3460 1.2194 1.2588 0.9580 1.3424 1.1058 0.8640 1.0000 0.6027 1.4566 0.7548 1.4838 1.4525 1.2724 0.7507 0.8193 0.6549 0.7366 0.5607 0.6753 0.6812 0.6190 0.6227 0.6814 0.6296 0.8249 0.8541 0.7586 0.9416 0.7532 0.8964 1.2497 1.1462 1.2226 1.2435 1.1753 0.8503 0.8941 0.8939 0.6548 0.9454 0.8942 1.1534 1.2069 1.4231 1.3743 1.4487 1.6146 1.2968 1.1398 0.9156 1.3207 1.1423 0.7992 0.6097 0.6927 0.7585 0.8490 0.8012 0.4738 0.4393 0.4662 0.3577 0.5734 0.5232 0.5836 0.5936 0.7235 0.6229 0.4533 0.5737 0.8827 0.8082 0.8390 0.7363 0.4160 0.3203 0.3493 0.2451 0.3634 1.0999 1.3183 1.6735 1.5152 1.6010 0.7849 1.0349 0.9107 1.0744 0.8632 1.0679 1.6708 1.8204 1.7512 1.5038 0.9881 1.7766 0.9261 1.2419 1.1015 1.1416 1.3969 1.0906 0.8542 0.7861 0.9757 0.8838 0.7226 0.9113 1.0280 0.8108 1.1540 1.0143 1.0082 0.9592 0.9479 1.1122 0.9130 0.9382 0.9065 0.7910 0.7741 0.5555 0.9918 1.1883 1.2699 1.2690 1.3868 1.5114 1.3511 1.3555 1.6771 0.9100 0.9792 0.9356 0.9785 1.0179 1.7121 1.6413 1.4794 1.6391 1.4137 1.4050 10-heptadecenoate (17:1n7) 1.6645 1.0561 0.1278 0.7701 0.9577 0.2657 1.6971 1.6986 0.2350 1.0177 0.6220 1.8674 1.5065 0.7470 0.7132 0.7454 1.1013 0.8667 0.1839 1.9925 0.4249 2.6213 1.1331 1.4589 0.9995 0.9025 0.5604 3.8816 2.5004 0.6950 0.4774 0.8502 1.4247 1.1747 0.6430 6.5014 3.1143 2.2613 1.8088 2.1815 1.4278 0.6523 0.5677 0.3964 0.5596 0.3885 1.1446 0.6784 0.2577 1.6037 2.6265 2.9820 1.6354 0.9171 1.0636 1.2840 1.2539 0.2052 0.1794 0.3650 0.7287 1.0005 0.5832 0.6352 0.7882 0.7909 1.3638 2.6957 1.2694 1.2406 2.1349 0.5873 5.2143 1.9350 1.5857 0.5839 0.5584 1.5883 1.1605 0.6700 1.0809 0.1449 0.5676 1.4265 2.2269 0.8385 0.5928 0.7693 0.5243 1.5349 0.7757 1.1797 0.8104 0.7310 0.6499 0.9234 0.5649 4.3018 1.3646 0.8542 1.9565 0.7713 3.0017 0.6849 0.4044 0.5366 1.4013 0.1674 0.4940 2.1638 0.5943 0.4043 1.5664 0.8329 2.1313 3.4726 1.6879 0.8055 0.9024 1.3629 0.7928 1.8487 2.5550 1.5110 1.1841 1.1959 0.3138 1.4341 1.3580 0.8287 1.2459 0.9711 0.4858 0.9880 1.1927 0.8217 0.2759 0.7656 1.9029 1.3827 1.0669 1.4082 2.6512 0.8283 0.3284 1.4462 0.9001 0.5474 1.0737 0.5341 5.4516 0.8628 0.9288 1.3043 1.2665 1.3597 0.8733 2.1250 3.6144 0.8060 1.6316 0.4388 1.7689 0.6735 1.9340 1.2738 1.1968 0.7078 2.8626 0.6771 0.9043 0.2996 1.0000 2.5304 1.5686 5.2894 0.9032 0.1970 1.0564 1.0365 0.9590 0.6961 1.4490 0.5972 1.2572 1.2419 0.3989 10-nonadecenoate (19:1n9) 1.3917 0.9905 0.1061 0.8580 1.0117 0.3119 1.3061 1.2368 0.2107 0.8666 0.5550 1.8411 1.6541 0.8291 0.8501 0.8290 1.1464 0.9941 0.1881 2.8355 0.5660 3.4897 1.2478 1.1728 0.7496 0.8657 0.5469 3.3585 1.5816 0.5364 0.6648 0.7318 1.4912 1.3482 0.6070 4.9235 2.8347 1.7275 1.4960 1.8241 1.1114 0.7619 0.6525 0.4706 0.6275 0.5570 1.1491 0.7089 0.3242 2.2862 3.4231 2.8478 1.9720 0.7204 0.9674 1.0439 0.8394 0.1677 0.1944 0.4717 0.7862 1.0231 0.5740 0.8199 0.8067 0.7229 1.0483 2.2902 1.0560 1.0929 1.8570 0.5613 3.6803 1.5721 1.2686 0.5395 0.5083 1.5443 0.9105 0.6391 1.0000 0.1416 0.5490 1.2590 1.8381 0.8612 0.5520 0.6262 0.5445 1.3502 0.6444 1.0059 0.7232 0.7335 0.6819 0.8470 0.5391 2.9567 1.0204 0.6431 1.4372 0.6967 2.2177 0.5257 0.5047 0.6056 1.7037 0.1664 0.5584 1.9543 0.6034 0.4432 2.1305 1.1417 2.1362 3.3575 1.9269 0.9838 1.0233 1.1355 0.8303 1.5900 2.4713 1.2041 1.1393 1.0404 0.2625 1.1595 1.3332 0.8294 1.3116 1.2010 0.4732 1.1108 1.3425 0.7750 0.3048 0.7693 1.6205 1.1817 0.9349 1.8774 2.8618 0.9248 0.4064 1.4526 0.9923 0.4782 0.9371 0.5651 3.9703 0.8680 1.0102 1.1307 1.0492 1.0848 0.7525 1.6171 2.6855 0.7983 1.3432 0.4190 1.4276 0.6860 1.9154 1.0662 1.1348 0.8118 2.4172 0.6114 0.8501 0.2788 0.7992 1.9682 1.3236 3.5223 1.0546 0.1979 1.4579 1.3770 1.2315 0.7408 1.8549 0.6909 1.5090 1.7083 0.5971 10-undecenoate (11:1n1) 1.1028 1.0000 0.5191 1.0225 0.8822 0.6150 0.7145 0.5789 0.4416 0.5968 0.5669 1.7514 0.8178 0.9210 0.9226 0.8423 1.0915 0.9964 0.4809 1.0615 0.7292 1.0425 1.1639 1.0373 0.8134 0.6059 0.6659 1.2921 1.0504 0.7446 0.7159 0.9770 0.8337 0.6937 0.8399 1.9633 1.2917 1.5586 1.3301 0.8733 1.0076 0.6503 1.0243 0.9716 1.0995 0.8063 1.3390 0.6505 0.4688 0.5768 0.9530 0.9217 0.9003 1.0073 0.7766 0.9214 0.9777 0.4035 0.6637 0.7887 0.6904 0.8355 0.5844 0.6559 0.5691 0.7508 0.4937 0.9713 0.6699 1.0030 0.9630 0.7258 1.1921 0.9385 1.0944 1.1804 0.9461 1.7135 1.3667 1.0080 1.1479 0.3511 0.5880 0.9040 1.3731 1.0854 0.9470 0.7128 0.7418 1.2850 1.0518 1.1852 0.9071 1.0396 0.9477 1.1440 1.1426 1.0097 0.9239 1.0199 1.6027 1.0514 1.2171 0.9262 0.7407 1.0468 0.9675 0.6801 0.7487 1.1115 0.7175 0.8737 0.7585 1.2236 1.4306 1.0780 0.9343 0.7063 0.8873 1.5699 1.2834 1.8375 2.1762 1.9324 1.5759 1.3971 0.8169 1.4191 1.3746 0.9622 1.5186 0.8854 0.9716 1.3501 1.0292 0.7720 1.0208 1.0009 1.1487 1.1013 1.1657 1.3072 1.1278 1.1331 1.4560 1.9231 1.4794 0.6989 0.8552 1.0839 1.2126 1.0164 0.9789 1.3215 1.0532 1.2507 0.9525 2.1267 1.6642 1.0588 1.8001 0.9232 1.2144 0.9913 1.1418 1.0752 1.0036 0.6970 1.0278 0.5680 1.1237 0.6828 0.8584 1.6386 1.0838 1.3174 0.9796 0.4914 1.2172 1.1860 0.8868 1.0037 1.2881 0.7811 1.4094 1.1794 0.7934 11beta-hydroxyandrosterone glucuronide 0.8262 0.7332 0.7389 0.5594 0.6341 0.8120 0.5921 0.3815 0.9905 0.4885 0.6054 0.7563 1.0422 1.0095 1.2239 1.1411 1.1899 0.3392 0.3927 0.3392 0.3392 0.3392 0.3667 0.8472 0.7022 0.6900 0.6303 0.7676 0.7790 1.4279 1.5739 1.6563 1.5360 1.4448 1.5422 0.4589 0.8988 0.7821 0.8130 0.6782 0.7012 2.3430 2.3834 2.0490 2.1879 2.3405 1.4182 0.6769 0.9614 0.8676 0.3403 0.7354 0.4379 0.8998 0.6532 0.6019 0.9855 1.4321 2.4188 2.6631 3.2129 2.0744 3.2251 2.4391 2.2912 1.7982 1.9626 1.1258 1.5573 0.9107 1.0338 0.7661 0.9280 1.2518 1.0917 0.8098 0.9030 0.4649 0.6201 0.8505 2.3560 2.0612 2.3393 1.7293 2.1087 2.0835 0.7795 0.6228 0.6361 0.5819 0.7814 0.8293 0.9230 0.7595 0.6307 0.7519 0.5179 1.4491 1.5013 1.5299 0.9743 1.7146 1.4619 0.3807 0.4532 0.4281 0.3588 0.3392 0.4240 1.8884 2.2705 1.7568 1.8833 1.1063 1.5183 1.2242 1.0139 1.0327 1.1201 1.0491 1.3768 1.4755 0.8933 1.4332 0.8094 0.5658 0.5845 0.8768 0.7921 1.9248 2.7720 2.2428 1.8848 2.7015 1.9461 0.4928 0.5683 0.3935 0.4959 0.3588 0.5617 1.3586 1.3821 1.5589 0.8438 1.7919 1.5195 2.2163 1.5414 2.1800 2.0924 1.6130 2.2991 1.7211 2.6874 2.4286 1.8194 1.4800 2.7049 0.8939 0.5664 0.7805 0.7830 0.9953 0.8840 0.5270 0.5994 1.1130 1.0000 0.8323 1.2970 1.4782 1.2633 1.5090 1.2697 1.7668 1.2290 1.2957 0.8381 1.1774 1.3206 0.5447 0.6961 0.6638 0.5523 0.6024 0.6604 12,13-DiHOME 0.7424 1.0995 0.3908 0.7507 0.3908 1.2218 1.0913 1.0418 0.3908 0.8488 0.9964 0.5867 0.7815 1.2936 0.7524 0.9457 0.9628 1.3568 1.0009 1.6166 0.3908 1.2848 1.5668 0.3908 0.9466 1.1866 0.3908 0.5307 1.7358 0.3908 0.3908 0.7908 0.3908 1.3832 0.6419 1.1990 1.1156 0.9112 0.3908 1.3742 0.9975 0.9520 0.3908 0.3908 0.6724 1.5108 0.6835 0.9417 0.3908 0.9078 0.5360 0.8541 1.0104 0.3908 0.3908 0.4939 1.0164 0.3908 0.3908 0.9020 1.0250 1.0045 0.7267 0.5383 0.5021 0.7041 0.7742 0.9873 0.8366 0.6984 1.2422 0.7264 0.6195 0.7507 0.3908 1.1757 1.4521 1.4295 1.9423 0.3908 1.0001 0.3908 0.8218 1.0760 1.1782 0.9310 0.3908 0.3908 1.0495 0.3908 0.9608 0.5243 1.0133 1.2389 1.8319 1.0776 0.8551 1.2801 1.2043 0.9546 1.4093 1.3866 0.8741 1.4215 1.1360 0.7760 1.7339 0.3908 0.8011 0.7847 0.3908 0.3908 1.0848 0.9695 1.1515 1.5717 1.3457 1.4775 1.1526 1.0113 0.3908 0.8389 0.9054 1.6377 0.3908 1.0227 0.3908 0.7661 0.3908 0.9339 1.3090 1.2035 1.0009 0.9154 1.3290 0.9066 0.3908 0.7425 1.0066 0.7946 0.7392 0.6181 1.7570 1.0137 0.3908 1.0069 1.0494 1.3945 0.8654 0.3908 1.9981 0.7009 0.9999 0.3908 1.5000 0.9211 1.5439 0.8803 1.0000 0.7821 1.7204 1.0257 0.9831 0.9164 0.9547 0.3908 0.3908 0.3908 0.3908 0.6998 0.7965 0.3908 1.2892 0.3908 0.6233 1.2984 1.1702 0.3908 0.5945 0.8080 1.0567 1.3322 1.1836 0.6528 1.1615 0.8834 1.4453 13-HODE + 9-HODE 1.4958 1.3045 0.3889 1.2929 1.3853 0.4550 1.2788 0.6897 0.4619 0.3112 1.0000 0.6828 0.8482 0.9213 0.6242 1.1575 1.2233 1.5921 0.3128 0.6760 0.9165 1.7996 1.5921 0.5196 1.1584 1.1638 0.5220 0.4546 0.7009 1.1606 0.4502 1.1560 0.8202 1.4747 0.1673 0.7110 0.6304 1.8972 0.9037 1.7668 1.3310 0.3156 0.8150 0.2006 0.1839 0.4858 0.3412 1.1350 0.2060 1.3818 0.7892 0.5230 1.1875 0.5065 0.4288 1.0157 1.2384 0.3952 0.3618 0.5296 1.1553 0.3763 1.0512 0.3699 0.2701 0.9912 1.1872 1.4883 1.0633 1.1548 1.6842 0.3871 1.9148 0.5054 0.5203 1.0268 0.4067 1.5590 1.8592 0.8807 1.3370 0.3262 1.1770 1.4268 1.4989 0.9073 0.3656 0.8657 0.7549 1.3535 1.0129 1.2578 0.5132 1.5694 1.8505 0.5775 1.3080 1.8738 1.2752 0.3494 0.5008 0.4043 1.6764 0.5331 0.4975 1.1492 1.6118 0.4612 1.1014 1.2245 0.8261 0.4813 1.3439 0.8559 0.6103 1.9535 1.4995 1.6415 0.9677 1.1857 0.4594 1.6276 1.2073 1.4845 0.3364 1.2332 0.3985 0.3747 0.2998 0.9974 1.7309 0.7809 0.8651 1.4087 0.7115 1.5177 0.4295 1.3170 0.4700 1.7399 1.3330 1.0437 2.0091 0.6533 0.5108 1.3960 1.3098 1.4214 0.8524 0.7545 2.5561 1.1915 0.5146 1.2833 1.3145 0.5605 1.2530 1.8684 1.6821 1.0026 1.2150 0.5685 1.5466 0.3518 0.2768 1.2438 1.1071 0.1975 1.1977 0.9024 0.6333 0.4476 1.2806 1.4560 1.2367 1.9171 0.9898 0.1046 0.9031 0.5255 0.6543 1.3098 1.6776 0.9218 1.5973 1.4152 1.1007 16a-hydroxy DHEA 3-sulfate 0.6409 0.4820 0.4364 0.3070 0.2659 0.3322 0.2491 0.1921 0.2366 0.1595 0.1630 2.3680 2.3382 1.4329 2.4573 2.9094 2.0983 0.6006 0.8829 0.8946 1.6247 0.7162 1.6788 0.3621 0.6526 0.4478 0.4934 0.7537 0.4700 0.8595 0.9827 1.0935 0.4890 0.7777 0.5883 2.2837 1.6792 1.8839 1.9578 2.0020 1.8398 1.8996 1.7386 1.9413 1.7819 1.8470 1.8476 0.7577 0.7869 0.8412 0.8330 1.0000 1.0223 1.7871 1.0173 0.8251 1.9095 1.2234 2.5554 1.2887 3.3792 2.3151 3.2183 1.8721 1.8880 2.3952 2.0085 2.2624 1.9657 1.5511 2.0617 1.2279 1.5816 2.1727 1.4793 1.1289 0.7387 0.5635 0.5636 0.6143 1.1071 0.7539 0.7850 0.9368 1.2015 1.0847 1.4375 1.4224 1.7050 1.5395 1.0423 1.4872 1.9195 1.2925 1.4201 1.7657 1.5324 0.4383 0.4754 0.4896 0.5659 0.5680 0.4825 0.2636 0.3562 0.5194 0.2964 0.3091 0.6397 0.6241 0.9794 0.5237 0.3333 0.4248 0.3925 0.1610 0.1874 0.1167 0.1347 1.0848 1.5740 1.2864 1.2437 1.2609 0.7115 1.3310 0.8822 1.4551 0.8605 0.5045 0.7867 0.4862 0.5774 0.8709 0.6213 1.7270 2.0704 1.8400 1.3094 0.9783 2.4658 0.5415 0.3837 0.5912 0.3487 0.7191 0.4375 2.2524 1.6892 2.7925 3.4629 1.6715 2.6055 1.4430 1.3292 1.5225 1.4942 1.5633 1.6599 0.6927 0.8028 0.7053 0.7966 0.6030 0.8222 0.3881 0.4467 0.4759 0.6549 0.6194 0.8266 0.7953 0.6947 0.9362 0.7759 0.9770 5.5971 6.3145 6.9049 5.3548 7.1261 2.5066 6.6670 2.9668 3.6552 3.0979 9.1733 16-hydroxypalmitate 1.1132 0.7350 0.4553 0.8655 0.9810 0.5128 1.3205 1.1902 0.7222 1.0461 1.0036 1.8058 0.9515 1.0092 0.8212 0.7344 0.9301 1.0397 0.4522 1.8621 0.7750 1.3696 1.0715 1.3638 0.9216 0.9984 0.7670 1.3365 1.5124 1.0430 0.8183 1.2345 0.9083 1.0016 1.0897 1.9548 1.0038 1.2792 1.1577 1.1113 1.0954 0.8977 0.9318 0.8651 0.8857 1.0372 1.5247 0.7690 0.5975 1.2211 1.2136 0.8607 0.9365 0.7686 1.0376 1.2011 0.9955 0.5683 0.6301 0.9057 0.9145 1.3650 0.6882 0.9232 0.9633 0.8775 1.0803 1.2287 0.8389 0.8365 1.1351 0.7666 1.2339 0.9773 0.8611 0.8363 0.5907 0.7913 1.0486 0.7162 1.2788 0.6353 0.8271 1.0285 1.3168 1.0833 0.7337 0.8273 0.7001 1.1384 0.9031 1.0166 1.0204 1.0412 1.2403 1.2971 1.2362 1.4889 1.1657 1.1458 1.5599 1.0373 1.5496 1.1420 1.0000 0.8622 1.1742 0.3864 0.9693 1.3033 0.9774 0.8694 1.0044 1.0583 1.1574 1.1669 1.2663 1.3395 1.5122 0.8844 0.8404 1.1607 0.8391 0.9715 0.9011 0.8310 0.4370 0.8186 0.8803 1.0050 1.1900 1.1668 0.6545 1.0432 0.9115 0.9279 0.5163 0.9409 1.0880 1.3636 1.0237 0.8592 1.2367 0.9788 0.5959 1.5730 1.2611 0.8388 0.8493 0.6741 1.4479 0.7917 1.1718 1.0584 0.9040 0.9523 0.7856 1.3586 1.1934 0.9873 1.5205 0.7450 1.1929 0.8545 0.8892 1.0740 1.1550 0.5113 1.0354 0.8274 1.1368 0.6718 1.1112 1.4098 1.1910 1.6050 0.7803 0.5623 0.7198 0.8343 0.9704 1.0635 1.7389 0.8581 1.2457 1.2690 0.9492 1-carboxyethylphenylalanine 0.9325 0.7977 0.8194 0.7054 0.6373 0.7893 1.6282 1.5461 1.3162 0.7599 0.8590 1.9544 3.3347 4.1688 2.8104 3.3764 3.4549 0.6431 0.8426 0.8471 1.2416 0.8115 0.8601 0.7796 0.7250 0.5417 0.7648 0.5409 0.7698 1.7305 1.5735 1.3834 0.8679 0.9730 0.7403 1.1482 1.8772 1.4420 1.7269 1.9189 1.8278 1.1477 1.2434 1.2455 1.0000 1.2906 0.9614 1.0861 0.8603 0.5931 0.7074 1.3236 0.6292 1.0683 0.6761 0.6887 1.5283 1.2906 1.1135 0.7849 1.2653 1.0063 1.2787 0.8419 1.1934 1.1015 0.7966 0.5339 0.5769 0.4814 0.4814 0.6182 0.6752 0.9063 0.7807 0.9603 1.1471 0.7588 0.5790 0.6652 0.6338 1.0200 0.4814 0.4814 1.0072 0.9737 1.2670 1.3110 1.6868 0.9848 1.4529 1.3397 0.9700 0.6751 0.7124 1.0601 0.7101 1.5930 1.2456 1.3375 0.9337 1.6699 1.3731 0.6854 0.8061 1.1247 0.9498 0.7869 1.3219 1.6746 2.2518 1.4054 0.6716 0.8849 1.0522 0.7101 0.5870 0.4814 0.4814 0.4814 0.6351 0.4814 0.6233 0.7458 0.5730 1.1655 0.6592 0.9930 0.4814 1.1378 1.1422 0.7220 1.0116 1.0221 1.0000 0.7596 0.9762 1.3057 0.8598 0.7118 1.0980 1.0515 0.8679 1.5061 0.8321 1.3750 1.0959 1.2767 0.8130 1.4979 2.2179 0.9903 1.8731 0.7830 1.2600 1.1190 1.2502 0.7640 1.0512 1.0510 0.6421 1.5215 1.1350 1.1673 1.5929 0.5952 0.7272 0.6616 1.0662 1.4131 0.8789 1.2862 2.1061 0.9685 0.8143 1.8254 0.7118 1.3492 0.8191 1.2787 0.9056 1.4625 1.0947 0.9673 1.1737 0.6314 0.4814 1-carboxyethylvaline 0.9329 0.9609 0.7336 0.5420 0.5420 1.0033 1.5069 2.5135 1.5364 0.5420 0.8311 1.3961 1.9124 2.3781 1.8302 2.2153 2.2832 0.5420 0.5420 0.5420 0.9334 0.5420 0.8024 0.5420 0.5420 0.5420 0.5420 0.5420 0.5420 1.4752 0.9880 1.0358 0.5420 0.6284 0.5420 0.5420 1.3692 0.9951 1.3822 1.4114 1.5877 0.9306 1.1122 1.1422 1.0455 1.8195 0.9832 0.8373 0.7684 0.5420 0.5420 0.9975 0.5420 0.9059 0.5420 0.5420 1.0167 0.8315 0.5420 0.5420 1.0957 0.5420 0.9692 0.5420 0.9944 0.7592 0.5420 0.5420 0.5420 0.5420 0.7038 0.5420 0.6444 0.5420 0.6738 0.7621 1.0333 0.5420 0.7070 0.5420 0.5420 0.8088 0.5420 0.5420 0.8277 0.5420 0.9581 1.6952 1.9682 1.2321 1.4697 1.0340 1.0936 0.5420 0.5420 0.6842 0.5420 1.6523 1.1607 1.3528 0.8527 1.3026 1.1198 0.5420 0.5420 1.4738 0.7609 1.0429 1.3872 1.4653 1.8246 1.2436 0.5420 0.5420 0.6800 0.8866 0.5420 0.5420 0.5420 0.5420 0.5420 0.5420 0.5420 0.5420 0.5420 0.5420 0.5420 0.5420 0.5420 0.5420 0.7623 0.5420 0.7368 0.5420 0.5420 0.5420 0.7052 0.7756 0.6090 0.5653 0.9360 0.7678 0.5420 1.0734 0.5420 0.9833 0.5420 0.8658 0.6761 0.7188 1.6335 0.5420 1.3478 0.5420 1.0000 0.9286 1.1441 0.5420 0.9900 1.0458 0.6380 1.2494 0.5420 1.0027 1.4093 0.5420 0.5420 0.5420 0.9015 0.6584 0.5420 1.2624 2.2199 0.5420 0.5420 1.8099 0.5420 1.0025 0.5420 0.7314 0.5420 0.5420 0.5420 0.5420 0.6034 0.5420 0.5420 1H-indole-7-acetic acid 0.3046 0.3046 0.6963 0.5796 0.3046 0.3046 0.3046 0.3046 0.3046 0.8312 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.8352 1.4476 1.0433 0.4433 1.4404 0.7116 0.7643 0.8074 0.9293 0.8340 0.5251 0.6200 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 1.4996 1.5995 1.6027 1.8060 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.8681 1.9647 1.1274 0.7456 1.5839 1.1436 1.1867 1.3417 1.4831 1.6081 1.6289 1.7666 0.7501 0.7260 0.6276 0.7330 0.6057 0.3046 0.6607 0.3046 0.3046 0.9420 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.4928 0.3046 0.5520 1.0002 0.3046 0.3046 0.8741 0.7424 1.0162 1.3067 1.1826 1.5068 0.9474 0.7378 1.1120 1.5851 1.2785 0.3046 1.3408 1.0289 0.9343 1.2974 0.9790 0.5342 0.3046 0.3046 0.3046 0.3046 0.3046 1.0667 1.3263 0.3046 0.3046 1.4945 1.0002 0.3046 0.7868 0.3046 0.3046 1.4931 1.4039 1.5154 0.8228 1.0166 0.4160 0.3222 0.3046 0.3046 0.3046 0.8827 0.9838 0.9686 0.4561 0.7966 1.6327 0.3046 0.5860 0.3046 0.3046 0.3046 0.3046 0.7441 0.3046 0.9412 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.3046 0.8032 1.6338 1.3627 1.1992 1.0537 1.5442 0.4724 0.8146 0.9754 0.8512 1.1683 0.9506 0.8667 0.7880 1.4774 1.8016 1.8638 0.9998 0.3046 1.4111 1.6756 1.4619 1.1863 1.3117 0.3046 1.0152 0.3046 1.0099 0.3046 0.5469 0.3046 0.3046 0.3046 0.3046 1-linoleoyl-GPA (18:2)* 1.7003 1.4138 0.6185 1.0184 0.8142 1.3737 1.4879 1.7990 0.8678 0.9955 1.2707 1.6617 1.3322 1.0852 0.8129 0.4031 0.4031 0.5711 0.4031 0.4031 0.5980 0.8777 1.1493 0.9089 0.7057 1.2993 0.6844 1.2959 1.0113 1.0659 0.6623 0.6908 0.4031 0.4031 0.4031 1.0912 0.9792 0.8455 0.4031 0.4031 0.8042 1.4069 1.0005 1.2897 0.9062 1.3772 0.7714 0.4031 0.7453 0.8413 0.9146 1.3885 1.4341 0.9202 0.8098 0.9149 0.4031 0.4890 0.6781 1.0680 1.6574 0.6157 1.4218 0.8392 1.5631 0.9887 1.4935 1.4943 1.4798 0.4031 0.6473 0.7115 0.4031 1.1341 0.4031 1.2099 1.2972 0.4031 1.2883 1.7170 0.7703 0.7876 1.4706 0.4031 0.9041 0.9318 0.5142 0.4031 1.1051 0.4031 0.9747 1.0618 0.4031 0.4031 0.4031 0.7443 0.7593 2.0993 0.7794 1.0925 0.4031 1.2251 1.6875 0.4031 0.4031 0.4031 0.7001 0.4031 1.0397 0.4031 1.3829 0.7567 1.1107 0.4031 1.1465 1.8232 1.0077 0.9139 0.4031 1.1190 1.3179 1.2836 0.4031 1.2763 0.4031 1.4015 0.4031 1.2729 0.9279 0.4031 0.6925 0.8110 0.7630 0.7848 0.6613 0.4031 0.4031 0.6918 0.7319 0.4031 0.4031 0.4031 1.3787 0.8438 0.4031 0.7653 0.7021 0.7486 0.7755 0.5929 0.4031 1.0536 1.2546 0.4031 1.5325 1.0498 0.7539 0.4031 0.4031 1.2007 0.9358 1.0916 1.1679 0.7176 1.6918 1.1339 0.4739 0.4031 1.4042 0.7674 0.9775 0.4031 1.7606 0.7768 1.1661 1.9698 0.5940 0.4189 0.8089 0.7918 0.4031 1.5736 1.0665 0.8869 1.2884 1.2344 0.9995 1-linoleoyl-GPG (18:2)* 1.7551 1.2719 0.6948 0.7701 0.6175 1.3423 1.1903 0.9134 1.1260 0.4752 0.9056 1.1975 1.8187 0.9753 0.7917 1.5167 1.2552 0.4752 0.9228 1.2374 0.5508 1.5725 0.7062 0.4752 0.6085 0.4752 1.2943 1.0942 0.5540 1.1424 1.6328 1.0875 0.6262 1.7397 0.4752 1.9230 1.4793 0.4752 0.7814 1.0507 0.4752 1.1070 1.0127 0.7802 0.7842 1.1788 0.4752 0.4752 1.1547 0.7986 0.9895 0.6726 0.6421 0.7022 0.7393 0.7364 0.9045 1.5618 0.6616 1.1190 0.6835 0.4752 0.9508 0.8539 1.2567 1.0337 1.0455 1.3156 1.0116 0.4752 0.4752 0.6499 1.4399 0.7029 1.0108 1.5010 1.0315 0.9266 0.6193 1.3677 0.6673 0.9621 0.9988 0.8338 1.4795 0.8192 0.7781 0.6004 2.5974 0.7636 0.8372 0.8601 1.1300 0.4752 0.4752 0.4752 0.7554 1.7960 0.8054 0.4752 0.7064 1.4468 1.1729 0.8948 0.9255 0.7846 1.8641 0.9510 1.3394 1.1718 0.7771 1.5778 2.0667 0.5821 1.1189 1.1914 1.0327 0.7498 0.4752 0.5950 1.0974 0.9098 1.4873 0.7701 0.7082 0.9659 2.0755 1.3346 1.1865 0.4752 0.7754 0.8758 0.9645 0.7569 0.7138 1.1060 0.8528 1.0000 1.2538 0.4752 0.8523 0.4752 1.8361 0.5870 0.5229 0.4752 0.4752 1.4470 1.1976 1.8718 2.1931 1.2623 1.5399 0.8637 0.6825 1.0000 1.0779 0.4752 1.2443 1.0638 1.0888 1.2394 1.2720 1.3620 2.7279 0.4752 0.4752 3.1086 2.1243 0.9049 0.5720 0.9804 0.7257 0.6818 1.4123 1.7424 0.4752 0.7410 1.0501 1.0167 0.7600 0.9872 0.9639 1.2695 1.3306 0.9785 0.6979 1-palmitoyl-GPG (16:0)* 1.0825 0.4727 0.7496 0.4727 0.7084 0.9005 1.0891 0.4727 1.1341 0.4727 0.8922 0.9889 1.6591 0.4727 0.4727 1.0210 0.4727 0.4727 0.5291 0.4727 0.4727 0.4727 0.4727 0.4727 0.4727 0.4727 1.4454 1.2684 0.5983 1.2956 1.5181 0.8080 0.8961 1.4541 0.4727 1.3593 1.9940 0.4727 0.4727 0.4727 0.4727 1.3998 1.1670 0.9422 0.8258 0.9417 0.4727 0.4727 0.4727 0.4727 0.4727 1.1084 0.4727 0.4727 0.4727 0.8109 0.7892 1.2746 0.4727 0.4727 0.4727 0.4727 0.4727 0.4727 1.0000 0.4727 0.4727 1.1141 0.8535 0.4727 0.4727 0.4727 1.0886 0.4727 0.4727 0.4727 1.1098 0.4727 0.4727 1.0605 0.7591 0.8624 1.0823 0.4727 1.4084 0.4727 0.4727 0.4727 1.4438 0.4727 0.4727 0.4727 0.6336 0.4727 0.4727 0.4727 0.4727 2.2884 0.7711 0.4727 0.4727 0.4727 0.8519 0.4727 0.7233 0.4727 0.4727 0.4727 1.0392 0.9269 0.4727 1.1179 1.6707 0.4727 1.0124 1.4941 1.0233 0.8085 0.4727 0.8185 0.8105 0.4727 0.4727 0.4727 0.4727 0.4727 1.3412 0.4727 0.4727 0.4727 0.4727 0.4727 0.4727 0.4727 0.4727 0.4727 0.6309 0.7138 0.4727 0.4727 0.7120 1.2841 1.2285 0.4727 0.4727 0.4727 0.4727 1.1023 0.9911 1.0044 2.1323 0.5788 0.8583 0.4727 0.9496 0.4727 0.7419 0.4727 1.3587 0.7583 1.0393 0.4727 1.0344 0.9377 2.3291 0.7193 0.4727 3.9289 2.6176 1.3218 0.4727 0.8443 0.8453 0.4727 1.1340 2.3474 0.6505 0.4727 0.4727 0.4727 0.9086 0.9956 0.4727 0.9900 0.8585 0.9034 0.4727 1-stearoyl-GPS (18:0)* 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.6911 3.8730 3.2651 0.2988 3.3376 1.2753 0.2988 0.2988 0.2988 0.5408 2.2566 0.2988 1.0253 3.0672 1.7023 0.3490 1.8579 0.6062 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 1.0867 0.2988 0.2988 0.2988 0.2988 0.5613 0.2988 0.6391 1.0072 2.7937 0.6233 0.2988 0.5399 0.2988 1.2025 0.2988 0.7810 0.7388 2.6232 0.2988 1.0965 0.2988 0.5727 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.5544 0.2988 0.2988 0.3420 0.6286 1.0974 0.5410 0.2988 0.4617 1.3250 0.2988 0.7741 1.1033 0.2988 1.0012 0.6858 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.6990 0.2988 0.2988 0.2988 0.2988 0.2988 1.4516 0.4374 0.2988 1.6896 0.7163 0.7655 1.4073 0.7742 1.0003 0.4380 1.0000 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.4746 0.2988 0.2988 0.2988 0.2988 0.8587 1.2673 1.3836 1.1502 0.2988 0.9997 0.2988 7.5645 2.6607 0.7134 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 0.2988 2.7087 1.3949 0.2988 0.5100 2,3-dihydroxy-2-methylbutyrate 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 1.1181 0.6508 0.5249 0.5249 0.5249 1.2289 0.8905 1.0884 1.1666 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 1.9177 1.0000 0.9457 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.8483 0.6817 0.5249 0.5249 0.5249 0.9723 0.5249 0.5249 0.5249 0.5249 0.8564 0.5249 0.5249 0.5249 0.5249 0.8672 0.5249 0.7321 0.5249 1.0930 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.9216 0.6488 1.2972 1.1349 1.6688 0.5249 1.1311 0.5249 0.5249 1.4105 0.5249 0.8134 0.5249 0.5249 0.5249 1.0928 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 1.5572 0.5249 0.9765 0.5249 1.2565 1.2048 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 2.7302 1.3652 0.5249 0.6100 0.5249 0.8614 0.5249 1.3091 0.7126 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 1.0568 0.5249 0.5249 0.5249 0.5249 1.5242 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.6796 0.5249 1.5091 0.9056 1.1896 0.5249 0.9324 0.9270 1.3269 0.5249 0.7286 1.6915 0.5249 0.5249 0.5249 0.5249 0.5249 0.5249 0.8562 0.5249 0.5249 0.9265 0.5249 1.6482 0.5249 0.5249 0.5249 0.5957 0.5249 0.5249 0.5249 0.9237 0.5249 0.5249 0.5249 0.5249 1.0706 0.5249 0.7955 0.5249 1.0321 0.5249 1.2652 1.0000 0.5249 0.9860 2,3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)* 1.0057 0.8767 0.8741 0.8517 0.8550 0.8295 0.8888 0.8948 0.9601 0.8743 0.8049 1.2310 1.1912 1.2740 1.1395 1.3306 1.2046 0.7680 0.6996 0.6769 0.7270 0.9083 0.7282 0.8221 0.8355 0.6455 0.8385 0.8847 0.8756 1.2531 1.3036 1.3464 1.1601 0.9612 1.0827 1.1150 1.2439 1.2523 1.3665 1.2009 1.1206 1.3354 1.3130 1.3198 1.3281 1.3448 1.2082 1.0000 0.8731 0.8073 0.9616 0.9159 0.7918 1.0062 0.9041 0.9002 0.9938 0.9516 0.8141 0.8239 0.8958 0.9362 0.8977 0.9091 0.9132 0.8772 0.7602 0.7418 0.8739 0.9707 0.9825 0.8058 1.0428 1.0921 1.1233 0.9418 0.9686 0.7961 0.7282 0.8114 1.1062 1.0596 1.0539 0.9363 1.1493 1.0018 1.4138 1.3819 1.4974 1.5011 1.4721 1.6273 0.9569 0.7682 0.7931 0.9854 0.9525 1.2488 1.0998 1.1718 1.1426 1.3789 1.2635 0.9040 0.8482 0.7750 0.9384 0.8356 0.8554 1.0643 1.1098 1.1757 0.9962 1.2162 1.0151 0.8382 0.8133 0.6851 0.6935 0.9609 1.1705 1.0836 1.0103 1.0318 0.8128 0.9291 0.8975 0.9194 0.8462 1.1725 1.4013 0.9654 1.3284 1.2606 1.2936 0.8280 0.8775 1.0445 1.0262 0.8160 1.0018 0.9090 0.8353 0.8947 0.7998 0.9989 1.0057 1.1175 0.9846 1.2626 1.3428 1.1042 1.2873 1.1310 1.2680 1.0681 1.1243 1.1657 1.2407 1.3285 1.1229 1.3108 1.2340 1.1525 1.4749 0.8976 0.8647 1.0679 1.0782 1.1120 1.1171 1.1703 1.5158 1.2093 1.0840 1.5672 1.0207 0.9720 0.9716 0.9466 0.7624 0.9205 1.0996 1.0406 1.1467 0.8264 0.7712 2,3-diphosphoglycerate 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.6425 0.0274 2.4207 0.0274 0.0274 0.0274 0.0274 0.0274 16.8784 0.0274 0.0274 0.0274 0.0274 0.0274 0.5446 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.4555 37.2446 0.0274 0.0274 0.0274 0.0274 0.0274 0.5973 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 2.0232 0.0274 0.0274 0.0274 0.0274 0.0274 5.5525 0.3585 0.0274 0.9604 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 1.0396 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 12.1201 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0434 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 0.0274 1.9566 0.0274 0.0274 0.0274 2,6-dihydroxybenzoic acid 0.6949 0.9067 0.3866 0.1324 0.3989 1.1767 0.5293 0.8178 0.2913 0.2756 0.4343 0.8158 1.1788 0.6694 1.0000 2.5494 1.0802 0.6932 0.7436 1.4048 1.3136 0.6395 1.1146 1.1424 0.8678 1.6864 0.6559 0.8953 0.9604 1.0947 0.4549 0.7446 0.5510 0.4430 0.3433 1.0777 2.0229 1.4327 1.5605 3.3894 1.5418 2.2124 1.8383 1.8628 1.3513 3.4364 1.0000 1.2892 0.5962 1.1396 0.4497 0.8444 0.1868 1.0497 0.2777 0.8193 0.8233 0.4886 0.7667 1.5128 1.0568 0.6748 1.2774 0.7933 1.5081 2.0909 0.9935 0.8337 0.6596 0.3498 0.5258 1.2762 0.5368 0.3880 0.8558 1.5699 1.3530 0.5914 0.9228 1.3791 0.4051 0.3319 1.2935 0.4484 0.7009 0.8574 1.2575 1.1647 2.2274 0.8426 1.6816 1.1548 1.8221 0.5137 1.4793 1.2974 0.9065 1.8901 1.2848 1.4092 1.0981 2.5524 1.3502 0.6827 1.9445 1.6477 0.9255 1.1102 2.7346 1.9466 3.7264 1.6713 2.2783 0.8520 0.9694 0.6010 0.3280 0.9867 0.3634 1.7092 2.2996 0.9850 0.7571 1.0371 0.1439 1.0535 0.4203 0.7080 0.5822 0.3653 1.0078 0.8669 0.3319 0.5075 0.8981 1.2729 0.8527 1.1352 0.7062 0.7799 1.1871 0.6694 0.6733 0.8562 0.2632 0.5004 0.2841 1.9700 0.9537 1.3310 1.6432 1.1626 1.7708 1.0580 1.2241 0.9013 1.8965 0.6651 1.0065 1.2658 1.0679 2.1462 1.2950 1.1595 1.9834 0.1841 0.1088 0.6231 0.9689 1.1575 0.6598 1.4100 2.4549 0.8012 1.7807 2.1356 1.6822 3.1251 2.0439 3.8577 3.1892 2.0040 0.9165 1.3331 1.8419 0.5801 1.3271 21-hydroxypregnenolone disulfate 0.8284 0.7804 0.8365 0.7347 0.7130 0.9738 0.4619 0.3878 0.5606 0.4707 0.5127 1.0730 1.2462 0.9899 1.2717 1.1659 1.2656 0.9768 1.3345 1.1401 1.2429 1.3104 1.2272 0.3003 0.2563 0.3013 0.2177 0.2177 0.2570 0.8233 1.1061 1.1566 0.8515 1.3195 0.8760 1.4728 1.7646 1.6669 1.7066 1.6664 1.6366 1.6533 1.3316 1.4466 1.6163 1.5394 1.5876 0.7276 1.1589 1.3134 0.6154 0.7695 0.6696 1.3223 1.3741 1.1425 1.4198 1.4935 2.6276 1.9334 2.4044 1.7918 2.1784 1.8365 0.9449 0.9327 1.0000 0.9044 1.0078 0.8890 0.9465 0.7640 0.9192 1.0000 0.9695 1.6183 1.5226 1.1520 1.1616 1.2092 1.0074 1.0184 0.9487 0.8543 0.9339 0.7610 0.6157 0.5028 0.5904 0.4712 0.5854 0.6125 1.2839 1.1615 0.9563 1.2465 1.2136 0.6147 0.5409 0.6007 0.5075 0.6325 0.6626 0.5525 0.7396 0.6670 0.5903 0.5421 0.5790 0.8542 1.1075 0.9512 0.6960 0.5596 0.6104 0.3158 0.3240 0.3659 0.2617 0.7198 0.9544 0.9999 0.7868 0.8368 1.2129 0.9961 1.0836 1.4419 1.4148 1.3255 1.7914 1.5146 1.4808 1.6740 1.3702 0.8558 0.8811 0.9158 0.8423 0.8847 1.0651 1.7669 1.6411 1.8937 1.3468 1.7765 1.6408 1.8733 1.5033 2.1868 2.3086 1.6183 2.1236 1.0827 1.3017 1.2764 1.1026 0.9522 1.3855 0.9638 0.8398 0.7576 0.9164 0.6849 1.0024 0.6285 0.5911 1.1953 0.9286 0.9495 0.6547 0.5291 0.5395 0.6196 0.6813 0.7691 1.3037 1.3353 1.2587 1.3898 1.2965 1.3777 1.8806 1.8577 1.6675 1.4290 1.3718 2-acetamidophenol sulfate 0.3118 0.4422 0.3118 0.3118 0.4279 0.9094 0.3118 0.7081 0.3118 0.5434 0.6945 0.4750 1.0000 0.5569 1.4709 2.6820 0.7557 1.7399 0.3118 1.5059 0.6884 0.8329 0.5630 0.6823 2.1152 1.6345 0.3118 0.9967 0.4231 1.2617 0.3118 0.4175 0.5638 0.3118 0.5543 0.3118 1.6628 0.7733 1.1617 2.3472 0.4614 2.2547 1.0356 0.6097 0.3118 2.1294 0.3118 2.0144 0.3118 1.8721 1.4432 0.6379 0.7561 1.1831 0.7805 1.3083 0.7521 0.3118 0.3118 1.9041 0.5760 0.6905 0.9012 1.4205 0.8946 1.1615 0.4770 0.3118 0.7026 0.3118 0.3118 1.6158 0.4809 0.7913 0.5001 2.1847 0.9892 0.3118 0.3118 0.8367 0.3118 0.3118 1.0476 0.8115 0.3118 0.3118 1.1157 0.4459 1.2902 0.3118 1.0120 0.4184 0.9667 0.3118 1.0033 0.3118 0.3118 1.7028 1.8848 1.1543 0.3118 3.1263 0.7400 0.3118 2.5444 0.5445 0.6816 0.3118 1.3566 0.5834 0.6265 0.3118 2.5780 1.4478 0.5679 0.8403 1.3111 1.3492 0.5843 3.4031 4.0651 3.5393 0.7003 1.0799 0.3118 1.5821 0.3118 0.8051 0.7844 0.4890 0.7988 1.1701 0.3118 0.3887 1.1273 1.0630 0.3118 0.3118 0.6954 0.9548 0.4983 1.6876 1.6661 1.8261 0.4839 1.0288 0.5880 2.3551 1.0967 0.4227 1.0102 2.5061 1.4907 1.9457 1.4458 0.3118 1.8814 0.3118 0.5806 2.5900 0.5120 2.7720 0.8117 0.9740 2.0440 0.5137 0.3118 0.3118 1.3493 1.8905 1.3281 0.3118 1.5853 0.8091 1.8670 1.1480 2.8451 0.3118 0.6068 2.6529 1.4239 3.0845 0.6618 0.3118 0.5088 0.3118 0.8517 2-aminophenol sulfate 0.4444 0.7203 0.2144 0.1211 0.4583 1.1745 0.4466 1.3967 0.2166 0.5211 0.8658 0.9738 2.0480 1.0373 2.2974 4.3640 1.3622 2.1186 0.2661 1.7099 1.2856 0.5921 0.7238 1.0560 2.1131 2.4378 0.3663 1.5204 1.0191 1.6598 0.3271 0.8441 2.0528 0.7852 0.8101 0.3953 1.7402 0.9100 2.5880 2.4067 0.9925 4.3177 1.6898 0.9196 0.7443 2.4916 0.3135 2.1546 0.3777 1.8508 0.7488 0.8472 0.6276 1.5292 0.6090 0.9222 0.5387 0.2806 0.4195 1.9436 0.8783 0.8068 1.3606 1.6389 0.9206 0.8389 0.4772 0.2654 0.7606 0.4325 0.8243 1.9283 0.8553 1.0000 0.8421 2.9415 0.8196 0.2696 0.5242 1.0122 0.7632 0.3552 2.3684 1.8185 0.6732 1.1733 2.3806 0.8321 2.1126 0.2882 1.1884 0.6842 1.5037 0.2367 0.9785 0.4033 0.1537 1.9333 2.7174 1.7531 0.7050 3.9667 1.3315 0.5476 1.6349 0.7914 0.8290 0.3700 1.8230 0.6580 2.1894 0.3614 2.3518 1.5813 0.6357 0.9080 1.1814 1.4938 0.5789 1.6985 3.5003 2.6660 0.5191 1.1626 0.2840 2.0701 0.5429 1.0948 0.7827 0.5025 1.4513 1.3430 0.2543 0.4489 1.9431 1.2054 0.3059 0.5200 0.8876 1.4152 0.8418 2.3429 1.7439 2.4118 0.4751 1.0882 0.8724 3.4440 1.3345 1.1559 2.2278 3.1954 1.8094 2.7446 2.0299 0.7985 2.6452 0.4276 0.9809 2.7386 0.6063 3.1434 1.1581 1.0279 2.0647 0.2903 0.1378 0.6927 1.5271 2.0837 1.6430 0.7235 2.8443 0.8715 2.5321 2.2052 2.4312 0.5019 0.7080 2.7607 1.8096 3.2915 1.4350 0.4099 1.1575 0.3303 1.1040 2-hydroxy-3-methylvalerate 0.7489 0.6362 0.4820 1.1867 0.9888 0.7455 1.0792 0.9554 0.6367 0.8296 0.9640 2.0613 2.3819 2.3709 2.2527 2.1603 2.6143 1.3444 0.7197 1.7199 1.2738 1.7623 1.1484 0.6192 0.6719 0.6522 0.3801 0.9564 0.7083 1.7328 1.3430 1.6260 1.4454 1.4504 1.4535 0.9625 0.8716 0.8897 1.0138 1.0228 0.9374 1.2161 1.1749 1.3505 1.2808 1.3589 0.9181 0.4370 0.2672 0.6533 0.8474 0.4821 0.6297 0.7360 0.9347 1.0287 0.7623 0.5110 1.1020 1.8038 1.6308 1.8269 1.4719 1.7334 1.2193 1.2890 1.2374 1.0731 1.1986 0.4230 0.9984 0.6245 0.4909 0.7972 0.4763 1.2378 1.1266 0.9911 0.9686 1.0997 1.2439 0.4632 1.0207 1.0416 0.7117 0.7152 0.9372 1.2120 0.9962 0.9678 0.9215 1.0715 0.9504 1.0550 0.9469 1.1479 0.6788 0.8728 0.7768 0.8972 0.7738 0.9671 0.9888 1.9452 2.1397 1.5599 1.9933 1.2714 1.5936 0.9372 1.0042 0.8622 1.0000 1.1015 1.2452 0.7169 0.9762 0.8096 0.8773 0.7502 0.8658 0.4387 0.6150 0.8037 1.1820 0.8282 0.6627 1.0274 1.2484 2.0499 1.7835 1.8335 1.3822 1.7291 2.1194 1.0469 0.8498 1.2902 1.6004 1.0213 1.1053 1.7186 1.7084 1.3922 1.2277 1.6781 1.7632 1.0617 1.0272 0.7550 1.0165 1.1573 0.9853 1.0557 1.0030 1.0247 0.9970 1.0135 1.2177 0.7903 0.4987 0.9347 0.8267 0.8717 0.8342 1.1404 0.9569 0.4611 0.7574 0.9166 1.1043 0.7324 1.1740 1.4307 0.9067 1.2172 0.6456 0.3925 0.6453 0.5598 0.8193 0.6822 1.3938 0.4759 0.7878 1.0248 0.8677 2-hydroxyacetaminophen sulfate* 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 1.0000 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0696 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 5.0275 0.0181 2.6295 6.9268 7.9840 7.0381 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.2288 1.6661 0.0181 0.0181 0.3339 0.0181 0.2253 0.0181 3.6584 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0232 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 1.9090 2.5060 0.9564 0.0181 0.0459 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0425 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 0.0181 2-hydroxyarachidate* 1.0645 0.7988 0.6700 1.0501 0.6842 0.8385 0.8226 0.6891 0.8085 0.4556 1.1982 0.6877 1.6629 0.8496 0.8284 1.5292 0.8573 0.6001 1.4916 1.8738 0.6695 2.1628 1.1412 0.9880 0.6865 1.7513 0.9713 3.3944 1.3763 0.8735 0.7848 0.6235 1.2771 2.0988 0.9728 2.0002 2.3431 0.8193 0.9261 0.9114 0.6957 1.7896 1.7701 0.9056 1.3699 1.8607 1.4591 0.4666 0.9060 2.7303 2.6401 1.4349 1.2711 1.2929 0.6443 0.6199 0.9581 0.8640 0.5052 1.0370 1.1135 1.1612 0.7275 0.7870 1.5180 0.8145 1.3438 1.3165 1.2859 0.7601 0.9582 0.4556 1.6982 0.8660 0.7873 1.2519 0.7074 1.2227 0.4556 1.2699 0.9532 0.6241 1.7893 1.4678 2.0822 1.4377 1.0627 0.9677 0.9954 0.8247 0.9313 0.7963 0.8256 0.9823 1.2936 1.0474 0.6490 3.3557 1.5776 1.2509 1.5762 1.6659 1.6429 0.4556 0.8057 0.7187 1.8717 0.7959 1.1608 1.4474 0.6871 1.5531 2.9708 1.0068 2.0326 1.6035 1.0535 0.9932 0.8580 1.0818 0.9894 0.6822 1.4900 0.7552 0.8822 0.8593 0.7171 1.2093 1.0189 0.9369 0.8394 1.4566 0.4974 1.6028 1.4046 0.6583 0.7984 1.1018 1.2517 0.6366 0.6523 2.8160 3.3057 0.9081 0.6933 0.6496 0.8142 1.0706 1.0258 0.8432 3.1511 0.7898 0.7789 1.1827 1.0046 0.6836 0.8184 0.6712 1.4083 1.4701 0.7475 1.2047 0.7984 0.7010 2.9041 1.2533 0.9024 2.6515 3.0687 0.8978 1.0765 1.1909 0.8423 1.6014 1.3732 2.4426 1.3176 0.6427 1.2229 1.2960 0.8783 0.9604 0.9138 0.9651 1.4828 1.3549 0.4989 2-hydroxybehenate 1.0024 0.8289 0.6494 1.0225 1.1186 0.8108 1.0386 0.7477 0.8009 0.9536 0.9945 0.9051 0.9215 0.6381 0.6448 0.9105 0.6942 0.9206 0.6809 1.8289 1.1230 2.1910 1.0586 1.0805 0.9308 1.2386 1.0165 2.7250 0.9561 0.6961 1.0752 0.8779 1.3374 1.7175 0.9371 1.3911 1.7334 0.7234 0.9299 0.9583 0.6926 1.5110 1.5444 1.0966 0.9413 1.1441 1.0761 0.9271 0.8687 1.5738 1.8039 1.3621 1.2706 0.8520 1.0278 0.8685 0.8260 0.6061 0.6507 0.8507 0.7685 0.8677 0.8236 0.7999 1.0432 0.9745 1.0656 1.3038 1.0469 0.8762 1.0261 0.7699 1.4345 1.1086 1.0175 0.5302 0.9644 1.0831 0.7304 0.9580 0.7896 0.6463 1.1818 1.0047 1.2938 0.7235 0.8339 0.8099 1.2818 0.9696 0.8709 0.8917 0.9768 1.0155 0.9789 0.7718 0.7149 1.7917 1.1613 0.9921 1.3039 1.4174 1.4982 1.0021 0.8152 0.8730 1.6110 0.8206 1.1221 1.1263 0.8645 1.2130 2.2505 1.0733 1.5351 1.3179 1.1847 1.0151 0.7132 1.3135 1.0247 1.1776 1.5792 1.0099 0.9899 0.9437 0.9182 1.3486 1.2336 1.1266 1.2534 1.3256 0.9868 1.2577 1.1560 0.8895 0.6530 0.8626 1.3817 0.8072 0.8360 1.8551 2.5635 0.9912 0.6532 0.7875 0.6051 0.8943 0.7293 1.0114 1.4789 1.0000 0.9186 0.8332 0.7778 0.9419 0.9785 0.8152 1.3228 1.0079 1.2838 0.9335 1.2851 0.9897 2.4640 0.9673 0.7809 1.9912 1.6636 0.8363 1.0353 0.8118 1.0251 1.4553 1.3835 2.0774 1.1801 0.7043 1.3606 1.2893 0.9774 0.9159 1.0519 1.0373 1.0927 1.0017 0.9138 2-hydroxydecanoate 1.3897 1.2449 0.4576 1.2609 1.0637 1.3620 1.8851 2.0316 1.1492 0.9995 1.2418 1.2374 0.9140 1.6080 1.2400 1.3109 1.2078 0.8130 0.2774 1.0408 0.8914 0.8350 0.8568 1.7832 1.0110 0.9691 0.4872 1.0639 0.8064 1.4005 0.4975 1.0500 0.7974 1.1259 0.9006 0.7882 1.1036 0.8428 0.6891 0.9190 0.7915 1.3085 1.5442 1.1590 1.2770 1.7634 1.0634 0.8960 0.3748 0.8472 0.7897 0.7523 0.6300 0.8026 0.6848 0.7315 0.8988 0.3932 0.5430 1.0773 0.9062 0.8353 0.9111 0.7301 1.2373 1.2697 1.3172 1.9204 2.4511 0.6148 0.7742 1.1574 0.8695 1.0262 1.6403 1.1394 1.0715 1.0713 1.1618 1.0285 0.9684 0.3274 1.1249 0.8591 0.9268 1.0315 0.9814 0.7152 1.3544 0.7427 1.3440 0.9884 1.1173 1.0829 1.4707 1.0543 0.8360 1.5932 1.1784 0.9734 1.2158 1.6333 1.3073 1.1388 1.4433 1.6069 2.0255 0.8912 1.9249 1.0378 0.9533 0.5552 1.0128 0.7841 0.8376 0.6329 0.8600 0.8811 0.7342 1.0493 1.0349 0.9321 0.6544 0.9170 0.7191 0.9428 0.4083 0.8011 0.8217 0.6886 0.9659 1.1123 0.4144 0.7780 1.0698 0.9880 0.5112 1.0124 0.8173 0.7641 0.6183 1.5088 1.5739 1.6489 0.6429 1.5131 1.3909 0.9812 0.7281 0.5398 0.9230 0.9930 1.1385 1.0246 1.5579 1.1674 1.1766 1.1824 1.2665 1.0429 1.4420 1.4713 1.4123 1.0655 2.1731 0.9890 0.7161 0.5365 1.2441 1.3015 1.0060 0.4005 1.1246 1.0882 1.0905 1.1173 0.5485 0.2212 0.4871 0.7396 0.6465 0.8656 1.0940 0.5548 1.0000 0.9440 0.9251 2-hydroxynervonate* 1.0481 0.8453 0.4868 1.0337 0.9052 0.6232 1.2748 0.7313 0.7733 0.8188 0.9030 0.8480 1.0478 0.4057 0.5339 0.8827 0.4570 0.7447 0.5699 1.5912 0.8186 2.3303 0.9217 1.0848 1.1605 1.3929 1.6544 4.0137 1.2199 0.8000 0.9997 0.7166 1.3151 1.8322 0.7672 2.0070 1.9424 0.8837 0.8178 0.9636 0.6554 2.1161 1.8123 1.3300 1.3758 1.5298 1.1727 0.8546 0.6964 2.0128 2.0936 1.6470 1.6156 0.8763 1.0581 0.8582 0.7089 0.6370 0.4124 0.7294 0.7718 0.7721 0.6226 0.9376 1.3736 0.9124 0.8605 1.7742 1.1807 0.9924 0.8374 0.5367 1.7845 1.0966 1.0394 0.8145 1.0048 1.4293 0.6221 1.2725 1.1573 0.5842 1.2532 1.5629 2.1382 0.9926 0.9247 0.6678 1.1782 0.9232 0.8024 0.7999 1.2868 1.3531 1.3031 0.9045 0.9535 2.1506 1.0062 0.9348 1.1526 1.3805 1.4334 1.0000 0.8588 0.8252 1.9892 0.5235 1.2979 1.2777 0.6865 1.1651 2.3646 1.1062 1.7356 2.1040 1.7219 1.1128 0.7302 1.1435 1.0003 1.1714 2.3397 0.9756 0.9574 0.9561 0.6788 1.3586 1.3582 0.9169 1.3224 1.2598 0.9593 1.2152 1.2538 0.6355 0.3047 0.6576 1.1016 0.5503 0.5940 2.6494 3.1808 0.8258 0.6538 1.0227 0.7444 0.8213 0.8634 1.0068 1.5886 0.8732 0.7268 0.9930 0.8106 0.8680 0.9482 0.8003 1.7504 0.9799 1.1847 1.0438 1.4054 1.0046 2.9284 1.0866 0.8682 1.7922 1.9031 0.7549 0.8850 0.7088 0.7826 1.3995 1.3636 2.1331 1.0718 0.5208 1.4936 1.2606 0.9534 0.7306 1.3087 0.7383 1.1898 1.0564 0.7199 2-hydroxyoctanoate 1.1581 1.1223 0.7895 0.9691 0.7155 2.0520 0.9701 0.8672 0.5920 1.3613 1.5690 0.8971 0.9930 1.2895 1.0577 1.5880 1.2686 0.7647 0.7208 0.8963 1.8566 0.6532 1.1653 0.9194 0.9004 1.0000 0.6146 0.8545 0.7629 1.4082 0.9113 1.0134 0.7890 1.4907 0.8059 1.7454 1.2599 1.1833 0.9070 1.3781 0.8141 1.4497 1.6686 1.6869 1.4023 2.6337 1.1114 0.7714 0.4868 0.8294 0.6174 0.7095 0.7012 0.7176 0.7913 0.8826 0.8253 0.4868 0.9415 1.6798 0.8286 0.7664 0.9061 0.8657 0.9399 1.7835 0.7875 0.9243 1.3381 0.6516 0.5094 0.9141 0.7357 0.9107 1.0138 1.1297 0.9966 0.7798 1.1797 1.6324 0.6566 0.5654 1.3098 0.7893 1.1547 0.7153 1.5455 1.1582 2.4706 1.2702 1.5088 1.5384 1.3975 0.8258 1.0237 1.0239 1.1659 1.0856 0.9045 0.9690 0.8169 1.5678 1.1443 0.9997 1.9528 1.6590 1.2939 1.5479 2.0438 0.8951 0.6875 0.8139 1.1593 0.6941 0.6908 1.1409 0.6355 0.8664 0.7510 0.9987 1.7639 1.0396 0.8174 0.8232 0.4868 0.7517 0.4868 0.7260 1.0573 0.7017 0.4868 1.1976 0.6709 0.9664 0.9919 1.3133 0.9765 1.1623 0.8196 0.8003 0.9831 1.3134 2.0019 1.1864 0.9672 1.2532 1.0003 1.5397 0.8997 1.0508 1.0492 0.9764 1.0790 1.4848 1.3372 1.3900 1.9083 1.0146 1.3403 1.4802 1.9574 2.2295 1.6188 1.3812 1.9734 0.9836 0.8737 1.1310 1.5364 1.4333 0.9916 0.9119 1.2397 1.0011 1.3701 1.3126 0.5591 0.7492 0.7159 1.2934 0.8914 1.1417 0.8527 1.1247 1.3577 0.9885 0.9517 2-hydroxypalmitate 1.3825 0.8872 0.6192 1.2084 1.4913 0.9171 1.0343 0.9368 0.6141 0.8466 0.7967 1.0837 1.5502 0.7434 0.7493 1.0096 0.8921 1.0055 1.0579 2.6601 0.8176 2.6813 1.1197 0.7985 0.9606 1.0003 1.4420 3.1766 0.9355 0.8342 1.2259 0.7895 1.3707 1.7738 0.8054 2.4723 1.8720 0.9008 0.8132 0.7522 0.8411 1.2604 1.0788 0.8259 0.9055 0.9808 0.9126 0.5844 0.7833 1.1666 2.6091 1.4718 1.5302 0.7286 0.9853 0.8149 0.7344 0.8214 0.4672 0.6279 0.7155 0.8469 0.6834 0.9345 1.0341 0.8151 1.0031 1.4560 0.9018 0.6681 0.9934 0.5651 1.4763 1.0120 0.8659 1.1749 0.9513 1.3460 0.6993 1.1289 1.1145 0.5717 1.3817 1.4759 1.3922 0.8430 0.7801 0.7114 1.0558 0.9352 0.8229 0.8766 1.1681 0.9620 0.9997 0.8110 1.1474 2.7064 1.0270 1.1442 1.2389 1.4205 1.7384 0.9911 0.8881 0.7226 2.0437 0.7480 0.9522 1.3181 0.8606 1.3849 2.6174 0.8258 2.0764 2.0653 1.5181 0.9673 1.1783 0.8970 1.3804 1.0026 1.2889 0.9070 0.6585 0.8466 1.2478 1.0522 1.3745 1.0829 0.8807 0.9607 0.7250 0.8629 1.1025 0.7858 0.5118 0.7350 1.2093 0.6911 0.8189 2.2481 2.7918 1.1091 0.7180 1.0000 1.1694 0.8548 1.0061 0.8578 2.0974 0.8731 1.0034 0.9498 0.9186 1.0406 0.9944 1.0608 1.8476 1.0439 1.2352 0.8700 1.2348 1.1032 2.3253 1.3160 0.8711 3.1234 3.3808 0.9618 0.8580 0.8128 0.7609 1.7143 1.4720 2.3955 1.0521 0.6908 2.0188 1.2252 1.3997 0.7067 1.4035 1.0132 1.1670 1.3619 0.6944 2-hydroxyphenylacetate 0.3289 0.2514 0.5786 0.6798 0.5324 0.6018 0.2496 0.9189 0.8960 1.0351 2.2303 0.8934 0.4866 1.0375 1.1824 1.0860 1.2514 0.7257 0.8945 0.9172 0.7569 0.8826 0.9296 0.8462 0.8750 1.2646 0.6363 0.8460 0.8543 1.0282 1.1196 1.1524 1.3491 1.2905 1.2441 1.1834 0.2885 0.8087 0.5467 0.4742 0.2496 1.0018 1.2384 1.1517 0.9518 0.4088 0.9151 0.9982 0.8061 2.2586 1.8263 1.1303 1.4898 0.8659 1.6175 1.1738 0.7507 1.1194 0.7410 1.2165 1.0684 1.1992 1.2620 1.1448 1.0169 0.8524 1.1367 0.8836 0.9619 0.2635 0.7557 0.4062 1.2694 1.1162 0.2496 0.7684 0.7308 0.6913 0.8470 1.1166 1.2560 0.7791 1.7606 1.5397 0.8367 0.9666 1.1002 0.9532 1.0906 0.9724 0.9296 1.0479 0.9776 0.8238 0.9704 0.8745 0.9831 0.9774 1.1883 1.6561 0.9247 0.9339 0.8623 0.2591 0.3559 0.2496 0.2496 1.1872 1.2387 0.4803 0.9148 0.7206 2.1550 1.7809 0.6861 0.8748 1.2755 1.3585 1.3696 0.8732 1.1226 0.8715 0.9428 0.7445 0.8717 0.9205 0.9279 0.9272 1.3341 1.3452 1.5896 1.4282 1.0548 1.1024 1.3267 0.4862 0.3248 0.2496 0.8928 0.8619 1.1153 1.7131 1.9354 0.9890 0.2991 1.0573 1.6623 2.1571 1.6012 0.7591 0.8671 2.2387 0.6057 0.9652 0.9714 0.8048 1.1642 1.0923 1.3197 1.0341 0.7870 1.1027 1.0397 0.8104 1.3247 1.7716 1.2104 1.0728 1.2090 1.2321 1.6375 0.8864 1.6631 2.0712 1.4957 0.4900 1.9301 1.2516 1.7804 1.4004 2.1447 1.4004 2.0047 1.2093 1.4106 0.8905 1.3173 2-hydroxyphytanate* 1.8749 1.2533 1.0654 1.0069 1.3702 1.1570 0.9902 1.0964 1.0157 0.6876 0.8931 1.8227 2.6677 1.1802 0.9226 1.7912 1.2617 1.0058 1.6209 2.1190 1.9204 2.6772 1.6256 0.8607 0.4978 1.0359 1.3089 2.4378 1.0047 0.9466 1.4969 0.6778 0.7070 1.3174 0.6293 3.3111 3.2170 1.1106 0.9292 1.1871 0.9372 0.6330 0.8060 0.6919 0.5097 0.6632 0.4989 0.5771 0.8113 1.0000 1.4246 1.5243 0.6611 0.6471 0.3664 0.4095 0.5487 0.6817 0.4979 0.5505 0.6498 0.6405 0.7048 0.5572 0.9201 0.6505 0.8598 1.3652 0.8434 0.3603 0.3636 0.2756 0.9396 0.4557 0.5244 0.9327 0.8869 1.0563 0.6488 1.3987 0.5775 0.7158 0.9827 0.7997 1.8630 1.0742 0.8536 0.9577 1.4997 1.1704 1.2874 1.2728 1.0133 0.6873 0.7192 0.7032 0.7028 3.2561 0.7191 0.8444 1.1181 1.4826 1.6955 0.7629 0.7815 0.7770 1.3480 0.7912 1.1117 1.5371 0.9897 1.5402 2.1174 0.5429 1.5827 2.0672 1.1469 0.9061 0.7134 0.7220 0.8552 1.0427 2.1596 1.0225 0.7447 1.1066 1.2785 1.4006 1.2923 0.7761 1.1596 0.9953 0.6151 0.9209 0.8094 0.7360 0.7044 1.1511 1.2271 0.4803 0.9859 1.9555 2.6152 1.2240 0.9680 1.1327 1.0039 0.6449 0.6700 0.8497 1.8327 0.5746 0.7848 0.8831 1.2327 1.2116 1.2370 1.1672 2.5575 0.8908 0.9201 0.9477 1.3641 1.0355 3.8411 1.1060 0.8036 4.5345 4.4180 1.2091 0.8915 1.9054 1.5020 1.9149 2.4642 3.9873 0.4937 0.4625 1.2010 1.1120 0.6400 1.2280 1.2779 1.4963 2.1644 1.7641 0.8940 2-hydroxystearate 1.1149 0.8696 0.6298 1.0605 1.2427 0.8196 0.8110 0.6812 0.6480 0.7391 0.7803 1.1249 1.5073 0.6535 0.7721 1.0103 0.8258 0.7967 0.9222 2.0756 0.8506 2.2144 0.9891 0.8037 0.9860 1.0115 1.4675 3.0527 0.8646 0.8297 1.2126 0.8215 1.3769 1.7884 0.9257 1.9780 1.8290 0.8256 0.8138 0.7701 0.9033 1.3682 1.2220 0.9229 1.0442 1.1168 0.9845 0.6152 0.8822 1.1936 1.9942 1.3734 1.1538 0.7487 0.8870 0.8046 0.7929 0.9049 0.4677 0.6047 0.7497 0.9399 0.6582 0.9445 1.2539 0.9663 1.0806 1.5983 1.0109 0.6314 0.7030 0.4789 0.9908 0.6819 0.7576 1.1429 0.8614 1.1620 0.5137 1.0568 1.1064 0.5802 1.2675 1.3484 1.0534 0.7014 0.9044 0.7288 1.1387 0.9405 0.8729 0.9525 1.2746 1.0774 1.0717 0.8935 1.1051 2.2924 1.1623 1.2567 1.2564 1.4717 1.7202 1.0174 0.9741 0.7824 2.2508 0.7873 1.1145 1.1688 1.0000 1.2987 2.3439 0.9074 1.9614 2.0715 1.4121 0.9955 1.1782 0.7941 1.2112 0.8766 1.0655 0.8446 0.6437 0.9065 1.2278 0.7780 1.4085 1.2798 1.0832 1.0791 0.8068 1.0212 1.3817 0.8582 0.6176 0.7524 1.1904 0.7972 0.7751 2.3581 2.4732 1.0003 0.7076 0.7278 1.0486 0.9528 1.0450 0.9250 1.4668 1.0407 0.7788 0.9784 0.8587 0.9425 1.0239 0.8411 1.5888 1.0511 1.0901 0.8650 1.1060 1.1858 2.3510 1.1121 0.7761 2.6267 3.0678 0.8448 0.8360 0.9062 0.8158 1.4819 1.4755 1.9571 1.0424 0.7223 1.7618 1.2079 0.9830 0.9079 1.3710 1.2080 1.4373 1.4748 0.8595 2-methoxyacetaminophen glucuronide* 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.9852 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.9737 0.0715 0.4267 1.1923 1.3039 1.1804 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 1.0000 0.0715 0.0715 0.1494 0.0715 0.0715 0.0715 1.0349 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 1.0148 1.2651 0.3546 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 0.0715 2-methoxyacetaminophen sulfate* 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.8898 0.3615 0.3615 1.4463 1.5939 1.1809 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.5704 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 1.0000 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 1.0315 0.9685 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 0.3615 2-naphthol sulfate 8.3713 8.6879 7.5883 4.8879 6.2165 7.5614 0.8629 1.1941 0.9876 1.2527 1.1936 1.5982 0.9719 1.9621 0.6758 1.1798 1.5126 2.7434 3.8292 3.5746 5.7800 2.9409 4.5837 0.7367 0.2593 0.6061 0.4792 0.2593 0.4936 1.4166 1.1003 1.2273 0.7826 1.4070 1.0891 0.9404 1.6473 1.1272 0.9551 1.0268 1.0538 0.2593 0.2593 0.2593 0.2593 0.2593 0.2593 0.4148 0.5996 0.5380 0.3738 0.4332 0.2593 0.2593 0.2593 0.2593 0.2593 0.3645 1.3064 1.4856 1.3878 1.1253 2.0610 0.8934 0.2593 0.2593 0.2593 0.2593 0.2593 0.2593 0.2593 0.2593 0.2593 0.2593 0.2593 2.1522 1.9636 1.8960 2.1617 2.4413 0.3299 0.7352 0.4857 0.2593 1.0000 1.8690 1.0307 1.1706 1.4755 1.2954 1.8910 1.7774 0.9929 0.5981 0.7357 0.6145 0.6602 0.7175 0.4791 0.4575 0.6135 0.7215 0.7562 0.5194 0.5777 0.5886 0.5720 0.5328 0.8141 0.2593 0.2593 0.2593 0.2593 0.2593 0.2593 2.3809 1.2609 2.0541 1.5767 0.6020 0.5845 0.3175 0.4555 0.5505 0.2593 0.4546 0.4315 0.4137 0.4064 0.4079 1.0071 0.5318 0.7031 0.6542 0.3812 1.0558 0.9524 1.0791 1.0521 0.7484 0.9862 1.4482 1.9127 2.2034 1.4849 1.8083 1.6088 0.3043 0.2593 0.3071 0.2593 0.2593 0.4075 0.2593 0.4579 0.2593 0.2593 0.2593 0.4347 1.1307 1.8330 1.7573 1.9802 1.3091 3.0801 3.6042 3.1206 4.8151 5.0162 4.9920 0.2593 0.2593 0.2593 0.2593 0.2593 0.2593 0.8128 0.8310 0.8416 1.0681 0.8492 0.6004 0.3580 0.4634 0.4906 0.4068 0.3774 3-(3-hydroxyphenyl)propionate 3.7037 3.4829 1.9379 1.3493 3.5291 3.0565 0.3367 0.9173 0.3367 0.9396 0.9016 0.6132 0.4837 0.3367 0.5381 0.3367 0.6409 0.5694 0.6883 0.7944 1.0048 0.8506 1.0071 0.6550 0.8901 1.1195 0.3367 1.0916 0.5516 1.7483 0.3367 0.5634 0.3367 1.3477 1.0874 0.4827 2.0933 1.1731 1.3101 1.2390 0.9891 1.5880 0.3367 0.3367 0.3367 0.7646 0.3367 0.4096 0.3367 1.8338 0.9372 0.3367 0.3367 0.3367 0.3367 0.3367 0.3367 0.3367 0.3367 1.3931 0.7870 0.3772 1.2268 1.1770 1.7321 1.3226 0.9952 1.1184 1.4324 0.3367 0.3367 1.2698 0.4816 0.4571 0.4826 1.8684 0.3367 0.3367 1.1941 0.3367 1.1821 0.6974 1.6405 0.8433 1.1127 1.7244 1.2106 0.9703 0.4922 0.3367 0.3367 0.3367 1.7874 0.5155 1.6859 0.5881 0.3367 2.5424 1.9144 1.3814 1.3590 2.1856 1.4385 1.2382 1.2154 0.6438 4.3823 0.3367 0.7201 0.3367 0.3367 0.3367 0.9483 0.5800 0.3367 0.7166 0.6379 0.8020 0.4766 0.4593 0.5181 0.3367 0.3454 0.5795 0.3955 0.3367 0.3367 0.3367 0.4002 0.3367 0.3367 0.3367 0.3367 0.3367 0.3367 1.0000 0.3367 1.0585 0.5510 0.7180 0.3367 1.8533 0.3367 0.7331 0.3367 0.9145 0.3367 1.4166 1.5198 1.2652 0.6396 1.1263 1.9832 0.5653 0.3367 0.3367 0.3367 0.3367 0.3367 1.1837 0.5063 0.7241 0.6006 0.3367 1.1071 0.3367 1.1814 0.3367 0.4892 1.1701 0.5647 0.4744 1.2796 0.3367 1.7077 0.8637 0.3367 0.3367 0.3367 0.5111 0.5148 4.1038 0.4151 1.2132 1.4789 1.9627 1.9209 3-(4-hydroxyphenyl)lactate (HPLA) 1.8975 1.4686 1.1456 0.9881 0.8435 1.1621 1.1928 1.0652 0.8662 0.6491 0.8101 1.5212 1.6938 1.7063 1.6072 1.4816 1.8217 0.8204 0.7759 0.9872 1.1175 0.9381 1.0502 0.6522 0.6714 0.5008 0.6145 0.6985 0.7816 1.3888 1.0497 1.3182 0.8389 0.7049 0.8607 0.9027 1.1504 1.1765 1.1151 1.3125 1.1600 1.0603 0.9670 1.2049 0.9989 1.2358 0.9134 0.7851 0.6160 0.5229 0.6144 0.7803 0.5147 0.8203 0.6675 0.6596 0.9141 0.7683 1.4111 1.4173 2.0125 1.7902 1.8960 1.5045 1.0847 1.1368 1.1251 0.9709 1.0102 1.0141 0.8190 0.6081 0.9559 1.0005 1.2164 1.0795 1.2254 0.9437 0.9115 1.3215 0.7625 0.8994 0.7562 0.6309 1.2439 1.1255 1.8721 1.9647 1.9549 2.0367 2.1803 2.0334 1.2273 0.9034 0.8710 1.2901 1.0026 1.1652 0.9950 1.0722 0.9310 1.3545 1.1846 1.2884 1.4418 1.5165 1.4449 1.2979 1.6167 0.8974 1.3260 0.8013 0.4498 0.5080 0.6126 0.6412 0.5655 0.5465 0.5827 0.9534 1.0702 0.9675 0.7880 0.9056 0.6816 0.9570 0.7406 0.8429 0.6814 2.0279 2.1751 1.4127 1.6291 2.0326 1.9099 0.9157 0.9926 1.0554 1.2628 1.0000 1.3553 1.0940 1.0030 1.3411 0.8816 1.4766 1.2277 0.7710 0.7355 0.7332 1.0313 0.8198 1.0739 1.0152 1.0293 1.0972 1.0977 0.9957 0.9829 0.9974 0.7295 1.2207 0.8789 1.0825 1.2340 0.6527 0.6300 0.5715 0.9762 0.9354 0.7758 0.8296 1.1684 0.9064 0.7982 1.3519 0.7229 0.8013 0.7233 1.0643 0.7694 1.3126 1.4515 0.8793 1.2542 0.9412 0.8721 3-(methylthio)acetaminophen sulfate* 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.2568 1.0544 0.2903 0.6568 0.3900 0.4567 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 2.5816 0.0807 2.7522 3.8219 4.0547 3.5549 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.4807 1.3751 0.0807 0.0807 1.2372 0.0807 0.2036 0.0807 0.9456 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 1.0000 1.7195 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 0.0807 3-(N-acetyl-L-cystein-S-yl) acetaminophen 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 1.4290 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 2.2948 0.0297 0.6986 1.8745 2.0596 2.0752 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.1071 1.4295 0.0297 0.0297 0.3260 0.0297 0.0509 0.0297 1.0000 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.9945 1.0000 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 0.0297 3,4-methyleneheptanoate 2.5298 0.7214 1.4096 1.7008 1.9853 2.4407 0.1835 0.1835 0.1835 0.1835 1.1724 0.4854 1.0303 0.2479 0.3082 0.7061 0.6604 0.6776 0.1835 1.3236 0.1835 0.6847 0.5622 0.6381 0.3225 0.9221 0.1835 0.6592 0.2241 0.3247 1.4059 0.5421 0.9148 1.7151 1.2849 0.8182 0.1835 1.7126 1.3593 0.4519 0.6070 0.6544 0.5639 0.4070 0.4125 0.1835 1.3877 0.1835 0.9009 1.4677 1.5888 1.2468 0.8688 0.7999 0.7484 2.5476 1.4041 0.5828 0.6995 3.4222 0.1835 3.0643 1.3976 1.0000 0.7536 0.1835 0.5200 0.1835 0.1835 0.8064 1.2394 1.0579 1.1129 0.6667 0.1835 1.4103 0.6716 0.1835 1.1563 0.7519 0.6393 0.7262 1.1844 0.1835 0.3208 0.1835 0.8640 1.7892 3.2334 2.0239 0.1835 0.5960 1.8187 3.0745 3.3701 3.0807 1.5754 0.1835 0.6491 1.1578 0.7996 2.1394 1.3629 1.6134 2.2602 2.0259 1.3564 1.6124 1.4935 0.3569 0.2464 0.6606 0.6248 0.5923 0.5713 1.2126 1.8453 1.1008 1.8461 1.9573 3.5981 2.7268 2.2423 1.1048 0.9049 1.6724 0.9933 0.6912 1.6078 0.6038 0.7986 2.2922 1.3686 2.0073 0.9322 1.5440 0.5003 0.3578 1.2509 0.9380 0.9697 0.7636 3.0604 0.6808 0.9528 1.1799 1.3233 3.3274 1.7855 1.0665 0.6460 0.6788 1.2146 1.5697 0.1835 0.7230 2.3581 0.6740 0.4844 0.7323 0.8101 3.7840 2.6678 0.8422 0.1835 2.0605 1.6671 0.8074 0.3894 0.5850 1.1083 0.6992 0.3385 1.4563 1.7143 1.3754 0.8188 0.2387 0.1835 1.0773 2.0845 0.2960 0.4485 0.2587 1.5574 1.2568 0.6194 3beta-hydroxy-5-cholestenoate 1.6393 1.0158 0.6281 0.7000 0.7986 0.7995 1.0673 0.9029 0.8318 0.6184 0.7257 1.7853 1.9289 0.7503 1.0722 1.4834 1.1308 0.7166 1.0239 1.4817 0.9243 1.8548 1.3197 0.5468 0.5126 0.7025 1.0141 1.9834 0.9062 0.7773 1.2287 0.7034 0.8060 1.0932 0.5745 2.1780 1.9118 0.9310 0.8292 0.9570 0.6530 1.1635 0.9999 0.7483 0.8165 0.8963 0.9764 0.5976 1.0067 1.2595 1.6352 1.7139 1.0268 0.4827 0.5861 0.5538 0.6276 0.6494 0.8994 0.8028 0.9212 1.0724 0.8574 0.9362 0.9493 0.7092 0.7915 1.5164 0.6598 0.8096 0.9564 0.5033 1.6442 0.9215 0.8325 1.3077 1.1760 1.1585 0.9685 1.1651 0.8912 0.8925 1.1607 0.9645 1.9420 1.0000 0.9842 0.9609 1.6767 1.2073 1.0614 1.2008 1.4495 1.2349 1.2028 1.3678 1.3664 2.0096 0.9362 0.7802 1.0651 1.1983 1.6201 1.1686 1.2939 1.1705 2.0010 1.2287 1.5457 1.4455 0.9925 1.9271 2.3819 0.8985 1.9868 2.7130 1.7549 1.2283 1.1978 0.7884 0.7689 1.0557 1.4595 0.7440 0.4376 0.4060 0.9859 0.7584 0.8488 1.0538 1.3336 1.1100 1.0587 1.3727 1.0249 0.6970 0.6355 0.6012 1.2687 0.7421 0.8341 1.4173 2.0376 0.6151 0.7727 0.9214 0.7958 0.9747 0.9020 1.2670 2.5923 1.0000 1.0565 1.0797 1.0564 1.2909 1.1908 1.2373 2.2222 0.8515 1.1214 0.8045 1.1877 0.9501 2.3369 0.8514 0.8148 3.2000 3.4431 0.9065 0.8252 1.3318 0.8700 1.7188 1.8482 3.0044 0.8664 0.6074 1.3097 0.9903 0.9285 0.8155 1.2885 0.9959 1.4200 1.0566 0.6995 3-bromo-5-chloro-2,6-dihydroxybenzoic acid* 1.1840 0.9576 0.8901 0.9485 0.8945 0.9504 0.9934 0.8881 1.0522 0.9207 0.9195 1.4532 1.5509 1.1391 1.1950 1.3815 1.2760 0.8011 0.8624 0.9867 0.8345 1.1948 0.8564 1.8034 1.6763 1.9645 2.4507 2.8072 1.9180 1.3495 1.6512 1.3515 1.4260 1.7127 1.2069 1.1483 1.1807 0.9694 0.9181 0.9510 0.8415 0.2106 0.2230 0.1923 0.1858 0.2052 0.1934 1.0557 1.2793 1.2829 1.5455 1.3501 1.1422 1.3826 1.4328 1.3866 1.4892 1.6133 1.3195 1.3663 1.4368 1.3741 1.3160 1.3960 0.2071 0.1961 0.1912 0.2207 0.1883 0.5679 0.6771 0.5138 0.6951 0.6480 0.6105 1.4915 1.3867 1.3436 1.3217 1.3283 0.1013 0.1199 0.1137 0.1255 0.1748 0.1138 0.5760 0.5325 0.7328 0.5815 0.5380 0.5970 0.9762 0.8873 0.9583 0.8853 0.9643 1.3478 0.8730 0.9035 0.9629 1.0004 1.1248 0.8989 0.9177 0.9017 1.0688 0.8948 1.0000 1.4345 1.1764 1.9121 1.7920 1.1385 1.5791 0.8545 0.7828 0.6938 0.6395 0.0801 0.0818 0.0955 0.1003 0.0779 0.7791 0.7237 1.0125 0.8822 0.8413 0.8409 0.9996 0.9291 0.9536 0.9258 0.8714 1.0447 1.1393 1.1579 1.3515 1.1194 1.1570 1.6460 1.8864 1.2879 1.1812 1.3759 1.3304 1.8369 1.7280 2.0827 2.4953 1.8638 1.7972 1.2742 1.3201 1.3710 1.3005 1.3616 1.8429 1.2857 1.4031 1.2159 1.3850 1.1972 2.0195 0.6905 0.6563 1.5523 1.2050 0.6608 0.9545 1.1249 0.9622 1.2785 1.3749 1.6510 0.9405 0.9288 1.0996 0.9157 0.9340 0.6630 0.8017 0.7682 0.8308 0.7451 0.6418 3-carboxy-4-methyl-5-pentyl-2-furanpropionate (3-CMPFP) 0.7911 0.6811 0.5941 0.7962 0.8148 0.8194 0.8344 0.8301 0.8819 1.0453 1.0762 1.1714 1.1139 1.1601 1.0562 1.1757 1.2315 0.9029 0.5856 0.8507 0.8762 0.9413 0.6773 1.0920 0.9379 1.0771 0.9082 1.1854 1.0129 1.6353 1.2187 1.4327 1.2068 1.2698 1.2351 0.8563 0.9856 0.8497 0.8508 1.0193 0.8690 1.1348 1.5803 1.3353 1.3877 1.5145 1.1842 0.8813 0.8305 0.9812 1.1135 0.7411 0.7679 1.2845 0.9525 1.0425 1.1468 0.9871 0.7690 0.9523 0.8158 0.9483 0.8272 0.9471 0.9620 1.0340 1.0645 0.9688 1.2748 0.6973 0.9436 0.7968 0.8057 0.9789 0.9886 1.1464 1.2118 1.0000 1.2749 1.3871 0.7573 0.4530 0.5850 0.7369 0.6509 0.5877 0.7277 0.7633 0.9257 0.6884 0.8580 0.8057 1.0316 0.9725 1.0388 0.8842 0.8349 1.6695 1.4897 1.6268 1.5739 1.9646 1.6674 0.9717 0.9984 0.8025 1.0593 0.6720 0.9095 1.1977 1.3589 1.2883 1.4433 1.3536 1.5161 0.6439 0.7416 0.7873 0.7033 0.9048 1.0943 0.9436 0.6905 0.7907 0.8655 0.8017 0.6248 0.7762 0.9735 0.8311 0.6968 0.8552 0.6710 0.7150 0.8753 0.7956 0.7240 0.8340 0.9213 0.7530 0.8124 1.0240 1.0121 0.8026 0.7153 0.8717 1.0921 1.3888 1.3735 1.4407 1.6089 1.4522 1.5812 1.4242 1.6234 1.5889 1.5545 1.3310 1.6446 1.5876 2.0874 2.0320 2.1350 1.6015 2.7055 1.6618 1.3982 1.3348 1.4653 1.5350 1.2608 1.0412 1.0959 1.3013 1.2383 1.1588 1.1916 1.1447 1.2536 1.3547 1.2201 1.2169 1.0164 1.0838 1.2798 0.9087 0.8035 3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF) 1.1098 1.0000 1.0534 0.9714 0.9549 0.9772 1.5385 1.4660 1.5467 1.3143 1.4023 0.9318 0.7919 0.8296 0.7943 0.8295 0.8967 4.8334 5.8539 5.5914 6.4577 5.6549 6.3495 1.3158 1.0564 1.1892 1.2380 1.2267 1.2984 0.8865 0.7922 0.8810 0.7526 0.7598 0.7633 0.5622 0.5824 0.5424 0.5619 0.5293 0.5054 6.4619 7.1373 7.0937 6.9362 7.2513 7.2224 0.7111 0.7337 0.6727 0.7474 0.6561 0.6184 0.7672 0.6403 0.6601 0.7573 0.7231 0.9926 0.9867 0.9924 0.9701 0.9841 0.9247 0.1318 0.1413 0.1160 0.1094 0.1129 0.4405 0.4326 0.4187 0.4576 0.4899 0.4925 3.7069 3.8281 3.6120 3.8180 3.9518 1.6543 1.5817 1.5368 1.5515 1.8744 1.7260 2.5424 2.7582 2.9889 2.9540 3.1488 3.1734 7.8712 6.4768 7.0852 7.4935 8.1093 0.1803 0.1856 0.1936 0.1738 0.2026 0.1908 1.5895 1.6245 1.8311 1.5815 1.7092 1.8980 5.2491 5.5771 6.1026 4.9486 4.9925 4.9769 2.2162 2.1273 2.1797 1.9764 0.5546 0.5745 0.5029 0.5419 0.5669 0.9145 1.0074 0.9362 1.0529 0.9475 0.6378 0.7644 0.6687 0.7528 0.7103 0.6614 0.2351 0.2561 0.2497 0.2746 0.2340 0.2620 1.7376 1.8014 1.8304 1.7333 1.8896 1.8048 1.0402 0.9512 1.1752 1.1578 1.0120 1.1473 12.9398 16.7250 14.6703 14.5309 15.5000 17.4546 6.0655 7.1513 6.4960 7.0333 5.8556 7.5728 2.8621 2.7056 3.2159 3.3281 3.2793 0.3720 0.3783 0.3853 0.4056 0.3903 0.3904 0.7947 0.8103 0.7714 0.8297 0.7527 0.0872 0.0813 0.0820 0.0945 0.0743 0.0730 3-hydroxy-2-ethylpropionate 1.2379 1.1442 0.6320 1.3507 1.6394 1.0167 1.3211 1.3389 0.9445 0.9329 1.2444 1.4283 1.5625 1.3386 1.2490 1.2650 1.2418 0.6405 0.4356 0.6123 0.4908 0.7517 0.5695 0.9001 0.7470 0.8832 0.7345 1.3167 0.6663 0.9320 0.8313 0.8886 0.7895 0.7850 0.7571 0.9179 0.7902 0.7691 0.8474 0.7654 0.7070 1.4562 1.3444 1.4370 1.4931 1.8914 1.5077 0.7100 0.4455 1.0453 1.0308 0.7098 0.7979 0.9875 0.9519 1.2657 1.1480 0.6717 1.1766 1.4585 1.7410 1.6610 2.0103 1.3394 1.0916 1.1770 1.1672 1.2188 1.2667 0.7411 1.2534 0.9711 0.8317 1.0511 0.7161 0.7912 0.8101 1.1114 1.0040 0.7867 1.3119 0.6417 0.8365 1.1719 1.0587 0.8910 1.7060 1.3719 1.1662 1.5568 1.4102 1.5358 0.7560 0.7839 0.7257 0.8161 0.7343 1.8100 1.8342 1.8123 2.2651 2.1016 2.0805 1.5012 0.9682 1.1173 1.1737 0.9549 1.0000 1.0804 0.9458 0.9287 0.8248 1.1924 1.2224 0.7648 0.7693 0.6683 0.7466 1.0365 0.9053 1.0278 0.8709 1.0537 0.9640 0.9793 0.6940 1.0125 0.9238 1.0317 1.6056 0.8856 0.8212 1.0713 1.2810 0.6398 0.5612 1.0505 0.8077 0.7657 0.8320 1.1653 1.1611 0.9408 0.9307 1.3090 1.0584 0.7964 1.1632 0.9094 1.2080 1.0227 1.0897 0.8951 0.9847 1.0640 0.9486 1.7009 1.3280 0.8903 1.0721 1.0707 0.9791 1.1996 1.1924 1.2562 0.8947 0.6338 0.8432 0.7603 1.0337 0.7727 1.3227 1.5841 1.0715 1.4728 0.8293 0.5737 0.7794 0.9673 0.7721 0.6609 1.3698 0.5266 1.0648 0.9652 0.8290 3-hydroxybutyroylglycine 0.5115 0.6288 0.5115 0.8517 0.5843 0.5115 0.5115 0.5115 0.5115 0.5115 0.5115 1.1887 0.5115 0.8947 0.7374 1.1339 0.9807 1.0202 0.5115 2.0820 0.5115 1.6713 0.5540 1.0160 1.0513 0.9137 0.6568 2.0498 1.0633 0.5115 0.5115 0.5115 0.5115 0.5115 0.5115 0.8347 0.5115 0.8098 0.8663 0.5115 0.5115 1.1062 0.5115 0.8984 1.1464 1.0208 1.7245 1.3806 0.8660 1.1745 1.8212 1.5031 1.8846 0.8123 1.1175 0.8754 0.5115 0.5115 0.5115 0.5138 0.5115 0.5115 0.5115 0.5115 0.8622 0.9194 0.7503 0.9808 0.5115 1.7180 2.6255 2.1070 1.5415 2.2532 1.5342 1.2485 0.8324 2.0742 1.2922 0.7138 0.6866 0.5115 0.5115 0.6834 0.5115 0.5115 0.5115 0.5115 0.5115 1.1139 0.5115 0.5115 0.6287 1.0153 0.7035 0.5115 0.5115 0.9407 1.0556 1.1501 1.7826 1.0895 1.1242 0.5928 0.9313 0.5115 0.8071 0.5115 0.8622 0.5115 0.5115 0.5115 0.5115 1.2171 1.0193 0.8477 1.2545 1.1551 1.2141 3.7205 2.9884 2.9509 3.7832 2.8650 0.7815 0.5115 0.5115 0.5115 0.8615 0.6081 0.8600 1.1281 0.5115 0.5115 1.2125 0.6111 0.5115 0.5115 0.9726 0.5115 0.5115 0.6705 0.6424 0.5115 0.5115 0.5115 0.5115 0.7023 0.9482 0.6052 1.2773 1.1687 1.3620 0.5115 0.5115 0.5115 0.5115 0.7856 0.5115 0.5115 0.8451 0.5115 0.5115 0.5115 0.5115 0.9847 0.9504 0.5115 0.5115 0.5115 1.4226 0.5972 0.5115 2.2161 0.8093 0.5115 0.6419 0.5115 0.5578 0.5115 0.7709 0.5115 1.9780 0.5115 0.7680 1.3437 1.0426 3-hydroxydecanoate 1.8403 1.0456 0.3620 1.3744 0.9279 0.6917 1.3626 1.0031 0.4263 0.7575 0.8511 1.9510 1.0662 1.1498 1.2406 1.0000 2.0197 1.1679 0.3252 1.7219 0.5465 1.4131 0.9477 1.2474 1.0815 0.6474 0.6285 1.2152 1.3420 0.8432 0.7590 0.9846 0.8887 0.8020 0.8354 1.9279 0.8431 1.2132 1.0238 0.9684 0.9234 0.7216 0.7050 0.6776 0.8193 0.8256 1.2335 0.6672 0.4606 1.2037 0.9652 0.9406 0.7654 0.8156 1.2661 1.2018 0.9467 0.3661 0.3841 1.0682 0.9855 1.2112 0.7667 1.1112 1.0474 1.1894 0.8522 1.4100 0.9320 0.6923 1.0383 0.5946 1.3093 1.3342 0.9516 0.9029 0.7448 1.0366 1.0706 0.5161 1.4610 0.3404 0.6986 1.1488 1.2397 1.2209 1.0328 0.8016 0.9496 1.2607 0.8723 1.5458 0.7339 1.1095 1.0077 1.1636 1.1851 1.3652 1.1343 1.0016 1.9088 1.2021 1.5097 1.8333 1.9708 1.3380 2.2223 0.4817 1.1352 0.9387 0.5595 0.4084 0.5957 0.6066 0.6809 1.1033 1.4757 1.2464 1.8084 1.0578 1.0308 1.3132 1.3274 1.6080 1.1999 0.8881 0.3747 0.8261 1.1968 0.8684 1.5025 1.0511 0.4473 1.0646 1.4100 0.7779 0.5441 0.7950 0.9747 1.1034 1.1486 1.1192 1.2299 1.0578 0.6565 1.9571 1.2765 0.8359 0.9715 0.8170 1.8822 1.1838 1.3704 0.8061 0.7195 0.7560 0.7354 1.0742 0.9984 1.0170 1.5231 0.6790 0.9875 0.7265 0.8203 0.7418 0.9571 0.4060 0.9229 0.6494 1.0233 0.2503 0.7818 1.4516 0.8704 1.5415 1.0826 0.4007 0.8760 0.9206 1.7192 0.6500 1.5244 0.4705 1.2853 1.0483 0.9845 3-hydroxyhexanoate 1.2874 1.1090 0.5918 1.5126 0.9487 0.9181 0.7882 0.6672 0.4325 0.9762 0.8581 1.1611 0.7771 0.8525 0.8209 0.8355 0.7800 0.8088 0.3142 1.1995 0.3696 0.9892 0.5422 0.8057 0.8379 0.8246 0.4285 1.2606 1.0400 0.7344 0.5963 0.7929 1.1134 0.9632 0.8200 1.9272 0.9066 1.1090 1.2312 0.9295 0.7815 0.9946 0.8209 0.9253 1.1622 1.2316 1.3173 0.5656 0.2736 2.1820 1.8220 0.8643 1.2195 0.9774 1.9269 2.0587 0.9360 0.4510 0.6442 1.3542 0.9764 1.1463 0.7817 1.1419 0.9121 1.2261 1.0496 1.5578 1.3093 1.1342 2.0702 1.3409 1.3723 2.0672 1.2508 0.9139 0.5994 1.3336 1.1000 0.8147 1.6846 0.2469 0.8813 1.3454 1.0532 1.1452 0.8825 0.8727 1.1164 1.1160 0.7647 0.9656 0.7548 1.1255 1.0912 1.1346 1.0748 1.5073 1.5411 1.1928 1.8020 1.1970 1.2701 2.1859 2.3467 1.0847 2.7122 1.0200 0.9987 0.5912 0.3854 0.3777 0.8332 0.7836 0.7485 0.8564 1.2871 1.0297 1.2518 2.4909 1.7687 2.1580 2.0001 2.0351 2.3123 1.0108 0.4935 1.1611 1.9441 0.8981 1.1251 1.1954 0.5017 0.9584 1.2903 0.8200 0.6149 0.8553 1.1542 0.7846 0.8138 1.1858 1.0325 0.6134 0.6171 1.2219 1.0574 1.0000 0.9148 1.0748 1.4541 1.3899 1.3308 0.9004 0.6880 0.6751 0.8349 1.1830 0.9393 0.8580 1.4197 0.8130 1.0382 0.7358 0.8475 1.3509 1.3376 0.3672 0.7484 0.5937 1.1404 0.3998 0.7870 1.4477 0.7420 1.2173 1.3725 0.4000 1.1353 1.0727 1.9116 0.6190 1.7684 0.4824 0.9038 1.4896 0.9939 3-hydroxylaurate 1.9789 1.0778 0.5319 1.7094 1.1882 0.8428 1.4764 1.1017 0.5831 0.8636 0.7505 2.0667 1.3001 1.3011 1.4367 1.0665 2.2592 1.1491 0.4075 1.4719 0.5382 1.1953 1.0091 0.9872 0.9830 0.8415 0.6256 1.0641 1.3060 0.7314 0.7794 0.9892 0.9499 0.6738 0.8666 1.7736 0.8296 1.2865 1.0500 1.0179 1.0171 0.5489 0.4665 0.4840 0.6165 0.6237 0.9888 0.5789 0.6106 0.8337 0.9621 0.9232 0.8324 0.7783 1.2889 0.8490 0.9984 0.4808 0.6448 0.9490 1.0998 1.3526 0.9109 1.2274 1.0495 1.0636 0.8568 1.1948 0.6973 0.6537 0.8814 0.5377 1.1518 1.2321 0.8346 0.9903 0.8812 1.2843 1.4667 0.8818 1.4557 0.2722 0.4200 1.0000 1.0639 0.8667 1.0831 0.8738 1.0329 1.4111 1.0028 1.6219 0.6955 1.1155 0.9625 1.0358 1.1481 1.2871 1.0257 0.9542 1.6636 1.0045 1.3824 1.6084 1.6566 1.2495 2.0333 0.5642 0.9497 1.0059 0.5600 0.4411 0.6206 0.6346 0.7508 1.1428 1.5934 1.2335 1.9109 0.8450 0.7346 1.2667 0.9475 1.2410 1.2738 0.9041 0.5468 0.9821 1.1277 0.9438 1.4968 1.0563 0.7128 1.2829 1.4864 0.8305 0.8328 1.0179 1.2070 1.3144 1.2949 1.1497 1.0159 1.0475 0.6870 1.8468 1.1615 0.7702 0.9810 0.8306 1.7576 1.2124 1.3831 1.0016 0.7721 0.8530 0.8283 1.2042 1.2197 1.0016 1.5195 0.7249 1.1387 0.8757 1.0100 0.7279 0.8733 0.4026 1.0413 0.5009 0.9861 0.3644 0.8691 1.2712 0.7115 1.7076 1.1694 0.5745 0.8848 0.8554 1.5249 0.7470 1.6863 0.6136 1.2635 1.2005 0.7890 3-hydroxyoctanoate 1.7960 1.2711 0.4972 1.3677 1.2665 1.1817 1.0000 0.8540 0.5321 0.6233 0.8874 1.5325 0.9166 1.1867 0.9213 0.9312 1.2690 0.9576 0.1658 1.4091 0.3491 0.9419 0.6410 0.9915 0.8596 0.7517 0.4874 1.1429 0.9630 0.7619 0.6232 1.0661 0.6683 1.6182 0.8599 1.9015 0.7870 1.1077 0.9800 0.7019 0.8403 1.0162 1.1230 0.7590 1.1634 1.3537 1.2736 0.6028 0.3152 1.5457 1.1439 0.8265 0.7083 0.6871 1.2493 1.4509 0.8800 0.2836 0.5179 1.7134 0.8468 1.2708 0.6667 1.1215 0.9081 1.2017 1.3366 1.4785 1.1828 0.6987 1.2166 1.0049 1.2403 1.5295 0.9409 0.9663 0.5910 1.0819 0.8693 0.5945 1.5998 0.1658 1.1207 1.0992 1.3951 1.1395 1.1139 0.7505 1.0000 1.1088 0.9216 1.3364 1.1271 1.2314 1.0900 1.3907 1.7646 1.1512 1.4949 1.1033 2.1653 1.3582 1.4830 1.8923 2.2851 1.1657 2.3388 0.7039 1.1008 0.7323 0.4890 0.2850 0.6768 0.5905 0.5684 0.8369 1.2021 1.4688 1.5594 1.1145 1.3834 1.3114 1.7802 1.4466 1.4555 0.8218 0.3947 1.1443 1.9030 0.8034 1.1447 0.9869 0.5337 0.9717 1.1471 0.7301 0.4371 0.6705 1.1545 0.7556 0.8209 0.9273 1.4743 0.8183 0.6176 1.3988 1.1408 1.0509 0.8552 0.8551 1.8526 1.1985 1.5106 0.9664 0.6151 0.9820 0.7134 1.1729 0.8876 1.1316 1.5597 0.6374 1.0215 0.9312 0.8077 0.9608 0.9676 0.3900 0.6802 0.7505 0.9973 0.1690 0.5624 1.1897 0.7847 1.1599 1.0566 0.4287 0.9351 1.0007 2.1332 0.8874 1.6164 0.5407 1.0560 1.3599 0.9445 3-hydroxyoleate* 2.0590 1.1635 0.2702 1.3408 1.2603 0.6994 1.4754 1.0317 0.6361 0.6893 0.8664 1.3460 1.7968 0.7196 1.0000 0.9141 1.0143 0.8920 0.4902 1.1751 0.4271 2.5470 1.2844 0.8272 0.9200 0.7393 0.6071 1.2151 1.0596 0.9208 1.2370 0.9935 0.5289 0.1853 0.9015 2.8210 2.3145 0.6646 1.0100 1.3830 1.1175 0.4482 1.0234 0.2883 0.6166 0.3166 1.1001 0.5140 0.3149 0.4916 1.7316 0.8303 0.4854 0.8656 0.9996 0.6351 0.9348 0.6483 0.1853 0.3354 0.7696 1.0400 0.5534 0.9533 1.1319 0.7891 1.0722 1.5243 0.4168 0.3763 0.7311 0.5127 2.1387 1.5122 1.1392 1.1837 0.3594 1.5485 1.0740 1.2168 0.9667 0.1887 0.9936 1.3127 2.0054 0.7411 1.0406 0.9157 1.6195 1.2853 1.0329 1.3405 1.1577 0.9390 0.9701 1.1837 0.9494 1.8413 1.3357 1.0478 1.7676 1.4335 2.2094 1.0688 0.9811 1.0392 2.2301 0.3563 1.0042 1.4354 0.9279 0.7921 2.1331 0.3104 1.9531 2.0860 1.4704 0.8435 1.1048 0.6799 0.8015 1.0444 1.9765 1.1841 1.2563 1.0424 0.1853 1.7597 1.4988 0.8431 1.3053 0.8781 0.4976 1.1388 1.1707 0.3857 0.4028 0.3580 1.2544 0.6330 0.8774 1.7636 0.9362 1.2260 0.7177 1.1556 0.8689 0.6136 0.4056 0.9154 2.6389 0.9804 1.0701 0.4262 0.6280 1.1141 0.8510 0.5132 1.1711 0.9453 0.7100 0.5777 1.1098 1.1775 1.5087 0.6583 0.6357 1.4061 1.3961 1.0004 0.6886 0.4597 0.7709 1.5870 1.1812 2.8458 0.8814 0.3478 1.3388 1.0064 1.0215 0.8793 1.5312 0.8595 1.5471 1.5445 0.7368 3-hydroxypyridine sulfate 0.4353 0.4353 0.4353 0.4353 0.4353 1.3138 0.6806 0.6281 0.4353 0.4353 0.8527 0.4353 0.7182 0.8948 0.8265 0.9947 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.7477 0.4353 0.4707 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 1.0053 0.4353 1.6341 0.4353 1.3640 0.4353 2.3200 0.8554 0.7245 0.4353 0.4353 0.9477 0.4353 0.4353 0.4353 0.4353 0.6457 0.4353 0.4353 2.0989 2.2935 3.2353 1.8478 3.5465 1.9174 0.4353 0.4353 0.8254 0.4353 0.6636 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.8028 0.4353 0.6122 1.1046 0.4353 0.8000 0.7980 0.4353 0.4480 2.0957 0.5699 2.2343 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.6321 0.4353 0.7159 1.4914 1.2268 0.4353 0.4353 1.2725 6.5031 15.6602 5.5380 6.1893 1.7034 2.1844 0.4353 0.4353 0.4353 0.4353 1.0573 1.4675 0.8042 0.5648 1.0705 0.4353 0.4353 0.4353 0.4353 0.4353 0.6879 0.5740 0.9759 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 0.6977 0.4353 0.4353 0.4353 1.0436 1.3287 1.2201 0.6315 3.0667 0.4353 0.4353 0.6554 1.0995 1.0241 0.4353 0.4353 1.1532 0.4353 0.4353 0.6112 0.4353 0.4353 0.4353 0.9922 1.1508 0.4353 0.4353 0.4353 0.4353 0.4353 0.4353 3-indoleglyoxylic acid 0.5501 0.2834 0.7593 0.8806 0.6499 0.8548 0.8106 0.7572 1.3477 1.3407 1.7886 1.6941 1.3410 1.5579 1.5382 1.2995 1.3298 1.2990 0.9188 0.4690 0.2834 1.0679 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.9826 0.3645 0.7496 0.4529 0.5857 0.2834 0.3333 0.7085 0.9488 0.7882 0.5834 0.6107 0.6562 0.7824 1.3504 1.1655 1.1655 0.7037 0.9455 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 1.0971 0.2834 0.2834 0.2834 0.8090 0.2834 0.2834 0.2834 0.2834 0.2834 0.3600 0.6496 0.5385 0.3842 0.7584 0.3926 0.6201 1.0034 0.2834 0.5869 0.7155 0.9417 1.1724 1.4746 1.0889 1.0587 0.9748 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.7583 0.2834 1.1781 0.8097 0.5183 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.8283 0.9296 0.5352 0.9463 1.0603 0.7707 0.9677 1.1376 1.6787 1.6070 1.1635 1.0519 0.2834 0.8229 1.2686 0.8092 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 0.5935 0.9747 0.2834 1.6487 1.3860 0.2834 0.2834 1.1671 1.0432 1.1511 1.3224 0.7814 1.0910 1.5246 1.6908 1.0528 1.4814 1.0612 1.5123 2.2421 1.7656 1.6434 1.0118 1.2230 1.2891 0.7092 0.2834 0.2834 0.2834 0.2834 0.7077 0.2834 0.2834 0.2834 0.2834 0.2834 0.2834 1.2615 1.3692 1.6377 1.2630 1.0174 1.1121 0.9966 1.0063 1.0613 1.6018 0.7013 0.8275 0.8608 0.8913 0.5350 0.8923 1.1985 0.7398 1.3134 1.2561 1.6868 2.1041 3-indoxyl sulfate 0.8719 0.9857 0.9218 0.6772 0.6812 0.9463 1.8445 1.7093 1.9010 1.1166 2.5103 1.5767 1.6270 1.9223 1.9014 2.0485 1.5396 0.1595 0.5213 0.4923 0.4410 0.4483 0.5982 1.1929 0.8984 1.3268 1.1452 0.8811 0.8064 1.3905 1.0213 1.0905 0.7023 1.1694 0.8516 0.8372 0.9488 0.9876 0.5559 1.3510 0.6548 0.8987 1.4963 1.4586 1.2989 1.1450 0.8611 2.5671 2.0392 1.6699 1.3197 2.3033 0.6989 1.4716 0.6510 1.0864 2.1831 1.6990 1.0313 1.5390 1.5060 1.0538 1.2578 0.9424 0.6486 0.6474 0.4012 0.4910 0.6633 0.3561 0.5429 0.9568 0.5225 0.7262 0.7122 0.8602 1.2133 0.9532 1.0194 0.9353 0.3061 0.6189 1.1440 0.5647 0.8900 0.5637 0.7647 1.1055 1.9421 0.9858 1.2516 1.2842 0.7965 0.7209 1.3795 1.2449 0.9491 1.9370 1.6714 1.7367 1.8539 2.7571 2.0092 1.0000 1.1647 1.2235 0.7648 1.3550 1.0954 1.6953 1.8911 1.6428 2.1184 0.6956 0.9816 0.7415 0.6432 1.1396 0.5521 0.8879 1.8100 1.1483 0.6312 0.9033 0.3819 0.5900 0.4508 0.7914 0.7240 0.5454 0.6141 0.5945 0.7563 0.6705 0.5392 1.2619 1.1892 1.0509 0.9301 0.7527 1.1789 0.9388 1.4223 1.1263 1.7840 2.4059 1.2358 1.1112 0.8459 1.0623 1.1717 0.7582 1.0984 0.4222 1.3920 1.0142 1.6788 0.7469 1.2842 0.5499 1.1497 1.3457 1.1508 1.1446 1.1716 0.7283 0.5692 1.1290 1.5112 1.2557 0.6581 1.7083 1.7522 0.9270 2.0170 1.7039 0.3265 0.3879 0.3196 0.2920 0.4272 0.8037 0.5856 0.8807 1.1586 0.5843 0.4836 3-methoxycatechol sulfate (1) 2.5460 2.4265 1.2422 1.0982 2.3708 2.6604 0.9701 0.9597 0.2260 1.7509 2.5998 1.0794 1.2633 0.7657 1.5753 6.0801 1.3437 2.2088 1.0732 7.0788 2.0334 2.2936 2.3126 1.1993 0.7750 4.8941 0.8519 2.1354 1.5856 3.0476 0.8990 2.1143 0.5806 8.2629 3.2446 0.6449 1.8028 1.5944 1.8192 3.8985 1.1397 0.3111 0.1262 0.1262 0.1262 0.3104 0.1262 0.1262 0.1262 0.1262 0.1262 0.1262 0.1262 0.1262 0.1262 0.1262 0.1262 0.1262 0.1262 0.4523 0.1262 0.1262 0.1262 0.1262 0.5449 1.0362 0.7925 0.2350 0.7417 0.1580 1.0481 2.9643 0.4157 0.3224 0.7612 0.6899 0.4678 0.1262 0.3952 0.2610 0.3618 0.1461 4.6447 0.8092 1.1735 1.0299 1.6513 1.3048 2.4146 0.1262 0.9983 0.2573 1.9004 0.3131 2.9636 0.8315 0.2264 0.5634 0.7378 0.7481 0.7844 7.0549 0.8144 1.0595 4.0002 1.6862 1.1382 0.5788 2.2367 0.1262 0.1708 0.1262 0.8889 0.2244 0.1262 0.1262 0.1262 0.1262 0.1262 0.1262 1.0017 0.5742 0.1262 0.1262 0.1262 0.1262 0.1262 0.1262 0.3458 0.4952 0.3134 1.2991 0.1262 0.3090 0.2781 1.0687 0.1869 1.3068 0.3971 0.6867 0.7513 0.9668 0.9109 0.4623 0.1262 0.5640 0.1262 10.3426 1.2109 0.7760 1.0767 1.9438 2.2684 4.1498 0.8259 0.6006 2.3323 0.1262 0.5551 3.3961 0.6632 5.1798 1.5239 2.4398 1.2803 0.1262 0.1262 0.1262 0.1262 0.2869 1.9987 0.4135 2.3791 0.2059 2.2548 0.9326 0.5609 0.1735 0.3361 0.3089 1.6317 1.4819 0.7939 0.1881 1.0458 0.5096 2.2392 3-methyl-2-oxobutyrate 1.0170 0.9419 0.7304 0.8792 1.1252 0.8544 1.1255 1.1463 1.0126 0.9070 1.0911 1.2465 1.2697 1.1994 1.3576 1.2248 1.4889 0.9798 0.8086 1.4531 1.0704 1.2484 1.1514 0.8900 0.9070 0.9369 0.9615 1.1912 0.8520 1.2339 1.2248 1.0965 0.9313 1.0779 0.8750 1.2747 1.0348 1.0925 1.2417 1.0514 1.0622 1.0037 0.9630 1.0124 1.0806 1.2355 1.2877 0.8311 0.5948 0.9653 0.8909 0.8949 0.6858 0.8951 0.8805 1.2715 1.1260 0.8939 1.0423 1.2198 1.2406 1.3116 1.1387 1.1849 1.0765 0.9999 0.8224 0.9739 0.8385 0.8422 1.5259 1.0906 0.8743 1.0615 0.7753 0.9371 0.9328 1.2308 0.9925 0.7928 0.9645 0.7597 0.9257 0.7913 0.9036 0.7513 0.9822 1.0698 0.9614 1.2697 0.9800 1.4276 0.9522 1.0001 1.0746 0.9642 0.9653 0.9736 1.0167 1.0054 1.0019 1.1538 1.0675 1.0858 1.2404 1.1480 0.9773 0.8882 1.1137 0.7938 0.8028 0.7620 0.9523 0.7826 0.8606 0.9805 1.1702 1.2472 1.1206 0.6782 0.8086 0.8205 0.7621 0.7375 1.0013 0.9028 0.9788 1.0463 1.2062 1.2268 1.3583 1.5067 1.0887 1.2903 1.2527 0.9756 0.9663 1.0207 1.1888 1.3311 1.0343 1.0366 1.4229 1.2071 0.9549 1.4382 1.3020 0.9418 0.9310 0.9239 1.2461 1.0426 1.0000 0.9978 1.0421 1.0437 0.9643 1.1485 1.1885 0.9032 1.0113 0.8512 0.9982 0.7804 0.8625 0.9831 0.8903 0.7050 0.8932 0.8845 0.9316 0.8349 1.0568 1.2007 1.0183 1.0164 0.7713 0.7474 0.7740 0.9691 1.3132 0.8125 1.1355 0.8305 0.9055 0.9295 0.9804 3-methyl-2-oxovalerate 0.9229 0.8809 0.4415 1.2359 1.2266 0.9006 1.1499 0.9470 0.6856 1.0433 1.2179 1.5803 1.9585 2.0441 1.9214 1.9894 2.1433 1.0881 0.4422 1.6342 0.8510 1.3526 0.9833 0.6650 0.7808 0.8577 0.5320 1.1187 0.6000 1.3060 0.8835 1.3578 1.1362 1.2228 1.1836 1.2034 1.0083 0.9505 0.9577 0.9054 0.8185 1.0578 1.0502 1.1942 1.0587 1.2977 1.0999 0.6813 0.3530 1.2956 1.1159 0.7751 0.8149 0.8372 1.0205 1.2295 1.0144 0.5321 0.6992 1.4522 1.3070 1.4984 1.2452 1.5095 1.1200 1.1079 0.9084 0.9002 0.9203 0.5324 1.1354 1.0000 0.6063 1.0935 0.5945 0.9639 0.8336 0.9168 0.8342 0.7800 1.1054 0.4581 1.0485 0.8851 0.7768 0.7577 1.1999 1.1882 1.0580 1.1334 1.0783 1.2988 0.8937 1.1600 1.3542 1.0681 0.8855 0.8712 0.9211 0.9743 0.8865 1.2448 0.9103 1.4999 1.5319 1.2769 1.3916 0.6340 1.1877 0.8128 0.7296 0.6436 0.9725 0.8279 0.9255 0.7477 1.0611 1.2895 1.0968 0.5773 0.6498 0.5852 0.6392 0.5866 1.1030 0.8195 0.4931 0.9984 1.2098 1.3084 1.3077 1.5384 0.8660 1.0868 1.5455 0.9429 0.7298 1.0358 1.2472 1.0780 1.0260 1.5600 1.7522 1.5022 0.7736 1.5451 1.7037 0.9091 0.9188 0.7009 1.0185 1.0695 0.9719 0.9404 1.0079 0.9659 0.9543 1.0016 1.1205 1.0220 1.0779 0.9446 0.9876 0.8081 0.9497 1.1158 0.9429 0.4955 0.8392 0.8473 1.0192 0.5437 0.9198 1.3376 1.0309 0.9126 0.8003 0.5449 0.7749 0.7984 1.2554 0.7099 1.6520 0.6220 0.9129 1.2358 1.2738 3-methylxanthine 1.0000 0.7420 0.6265 0.8842 0.8438 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 1.3526 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 1.8346 0.6265 0.6265 0.8935 0.6265 0.6265 0.6265 0.6265 0.6265 0.7146 0.6265 0.6265 0.6265 0.6265 0.6265 0.9285 0.6265 0.6265 0.6265 0.6265 0.6265 0.7377 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 1.0866 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 1.1261 4.8254 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 1.5689 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.9367 0.6265 1.0633 0.6265 2.6985 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 0.6265 1.2141 0.6265 0.6265 0.6265 0.6265 0.6265 3-phenylpropionate (hydrocinnamate) 0.0644 0.2035 0.1744 0.0644 0.1966 0.1728 1.2885 2.0447 1.0354 1.7179 1.6001 0.8116 0.5721 0.4288 1.0222 0.5672 0.9143 0.0644 0.1899 0.1320 0.1148 0.1414 0.1972 0.6557 1.1392 0.3755 0.7409 0.6093 0.4465 1.1140 0.5797 0.9522 0.1430 0.5280 1.6798 1.1030 1.7636 1.2153 0.7858 1.2396 0.9972 2.4975 2.3062 2.8886 1.6276 2.1341 1.1574 1.6935 0.6518 1.2248 1.1586 0.9219 0.4248 1.3665 0.7274 1.1296 2.3519 1.5014 3.8283 6.8074 5.5700 5.1329 7.3624 6.4649 0.1605 0.0946 0.1606 0.1045 0.1804 0.3111 1.1553 1.6214 0.3241 1.3896 1.3560 1.2368 1.7843 1.4877 1.5130 1.9506 0.5297 0.7163 1.0000 0.4773 0.9568 0.8628 1.0047 0.6704 0.8362 0.3153 0.6434 0.3894 0.8488 1.3101 1.2760 0.8934 0.9179 0.2811 0.1759 0.2710 0.1674 0.3010 0.3031 1.3222 0.9734 1.5512 1.6182 1.1003 3.0707 0.7988 0.8042 0.5662 1.5256 1.2483 0.9567 0.4969 0.7293 0.5705 0.7506 2.5248 3.4057 1.9471 1.1373 1.8123 1.9817 2.6013 1.4713 2.7410 2.2026 0.9953 1.2692 1.4197 1.0542 1.0343 1.7733 1.3315 0.7778 0.6904 0.8907 0.8920 0.7581 3.8056 2.5837 2.7093 3.9613 5.3204 3.6817 0.2260 0.2187 0.2433 0.1753 0.1589 0.2133 0.5865 3.2279 1.3546 3.4387 1.0204 1.5365 0.4457 0.6479 0.8600 0.6441 0.9362 1.1999 1.4206 1.9391 1.1920 2.4485 2.9750 0.5565 0.6810 1.8691 1.0757 1.1501 0.7638 1.1836 0.8821 1.1422 1.8580 1.7453 0.1620 0.1510 0.0919 0.1178 0.0644 0.0644 4-acetamidobutanoate 0.9887 0.5897 1.6255 0.3914 0.5072 0.8346 1.1018 1.3378 1.0230 1.1042 1.0969 0.8934 0.8736 1.0335 0.9098 0.7894 1.0050 0.8490 0.9255 1.0504 1.1806 0.9613 1.2511 0.8721 0.8290 0.8493 0.8439 0.7812 1.1164 1.0146 0.8740 1.1152 0.8829 1.0673 0.7841 1.1155 0.8571 1.2631 1.4363 1.4118 1.2913 1.6622 1.5109 1.3675 1.6116 1.2320 1.1862 1.0171 0.7996 0.6598 0.3914 0.9961 0.7802 0.8332 0.5810 0.8459 1.0562 0.6465 0.8193 0.6886 0.7786 0.7187 1.0412 0.6547 0.9764 1.1233 0.9148 0.8558 0.8423 1.0416 0.8501 1.1394 1.1123 1.0289 1.2776 1.1358 0.9621 0.9988 0.7346 0.8664 0.6704 0.9244 1.0657 0.8761 1.2436 1.4316 1.1160 1.0614 1.1923 0.9349 1.4322 1.3573 0.7664 0.7556 0.6600 1.0161 0.7114 1.1655 1.2823 1.1643 1.2327 1.1430 1.2785 0.7524 0.9968 1.0330 0.8230 0.9994 1.0811 0.7606 1.1149 0.9452 0.8707 0.8500 0.8301 0.7316 0.6162 0.5862 0.6664 1.2525 1.2916 1.4905 1.0470 1.5566 0.4510 0.9541 0.8641 0.8564 0.8119 0.8888 1.2669 1.2839 1.0019 0.9292 0.9981 0.3914 0.3914 0.8541 0.7100 0.8351 0.7241 0.7640 0.8863 0.8249 0.6415 1.0006 0.6576 1.1811 1.5798 1.1735 1.1542 0.9750 1.3540 1.1104 1.3983 1.5733 1.1289 1.1610 1.1630 1.3751 1.3996 0.9326 1.1197 1.3733 1.1732 0.7759 0.9715 0.7723 1.4031 0.8006 1.0611 1.1622 1.5128 0.9458 1.1045 1.6521 0.7993 1.0619 0.5747 1.4421 0.7898 1.6395 1.0175 1.3396 1.3289 1.2611 0.8892 4-acetamidophenylglucuronide 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 1.2201 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0082 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 2.1385 0.0046 1.0000 2.6905 2.6447 2.2807 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.1037 1.4207 0.0046 0.0046 0.1285 0.0046 0.0530 0.0046 2.4710 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.9348 1.0652 0.6126 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0104 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 0.0046 4-acetaminophen sulfate 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 1.0000 0.0317 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.4972 0.0085 0.1394 0.0566 0.0969 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 36.7254 0.0085 16.3155 51.7384 53.1472 47.9349 0.0967 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.1032 1.4274 15.8171 0.0085 0.0085 2.1933 0.0085 2.3176 0.0085 37.6517 0.0085 0.1248 0.0085 0.0085 0.0085 0.0085 0.0085 0.1823 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 1.2358 1.2856 1.0216 0.0085 0.0327 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0463 0.0085 0.5726 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 0.0085 4-allylcatechol sulfate 0.6814 1.1660 0.1641 0.1641 0.9656 1.5869 0.1641 0.1641 0.1641 0.1782 0.3949 0.1641 0.2544 1.6497 0.5314 0.3255 0.2912 0.3238 0.1641 0.9113 1.7485 0.1641 0.2213 3.5515 1.9020 1.2176 0.1970 0.7334 0.5366 1.3338 0.1641 0.2623 0.3807 1.0000 0.2939 0.5289 9.0653 1.2337 2.5101 2.1861 1.5203 2.0060 0.6605 1.7087 1.2544 2.4594 0.4981 3.8396 0.8071 1.7440 0.9768 1.5870 1.0813 2.0985 1.1238 0.9515 4.2918 1.7823 0.4536 1.0023 0.7965 0.5762 0.8107 0.8261 1.1697 0.5282 0.3248 0.1641 1.2270 0.3672 0.8301 1.4994 1.0232 2.9598 4.5425 1.7142 0.5548 0.1641 0.3158 2.5440 0.1641 0.1641 0.5782 0.1641 0.1641 0.1641 1.0833 0.7859 0.9769 0.1641 1.2814 0.5861 0.7917 0.1641 0.3273 0.1641 0.1641 0.4028 0.4798 0.1641 0.1641 0.2117 0.1641 1.3581 3.2035 1.5885 2.9933 0.7134 3.6123 0.4420 1.1539 0.2521 1.2987 0.5895 0.6345 0.1641 0.9061 0.7082 0.1641 1.0516 0.7988 0.5201 0.2369 0.5597 0.5372 1.9235 0.6273 1.5701 1.1345 8.9278 3.6604 2.6168 3.5048 7.7933 7.3592 0.2710 0.1641 0.2556 0.1641 0.2596 0.1641 1.7617 0.6620 1.5683 0.1641 0.1641 0.6003 2.0574 0.2872 0.1641 0.3863 1.3917 4.7630 1.1989 1.9024 0.1641 0.7623 0.1641 0.1641 2.6432 0.9942 1.1226 2.0245 1.1879 3.7997 1.4404 0.9457 1.8938 4.1919 6.1324 1.2685 0.4790 2.4136 0.7907 2.0291 0.9646 0.6023 0.1641 0.2281 1.6226 0.6278 2.4880 0.1641 0.1641 0.2462 0.1641 0.1641 4-allylphenol sulfate 1.8252 0.5334 1.4634 0.4649 1.0957 0.9607 1.0292 0.4237 0.8462 1.1818 0.3952 1.6172 1.8256 0.4765 1.0147 0.7801 1.7936 0.9613 1.9824 1.2959 1.2273 2.3517 2.5471 1.1494 1.0340 1.1648 1.6962 1.9482 1.9777 0.5354 0.9906 1.2347 0.5301 0.6458 1.1088 1.8330 1.0938 2.2815 1.5219 1.2260 2.3313 1.7136 0.7322 2.4702 2.1726 1.2606 1.8646 1.3822 2.1037 1.1328 2.2557 2.1651 0.9145 0.6517 0.1423 0.5555 1.4550 1.1369 1.5015 0.9098 1.7535 1.7267 1.0412 0.8748 0.3939 1.0367 0.8826 0.6995 0.0892 1.4955 1.6784 0.9274 1.8652 0.9585 0.7171 1.3003 2.4578 1.6503 2.0182 1.2826 0.8649 0.8168 0.5095 0.4404 1.1623 0.7551 1.5361 2.2192 1.3742 1.8463 1.6005 2.2290 0.4404 0.5788 0.4611 0.9141 0.7795 1.3491 0.7667 1.0788 1.1755 0.8421 1.4654 1.0059 0.8614 1.8410 0.9045 1.5360 1.1115 2.0933 2.2616 2.0544 1.1359 0.7493 1.4423 1.0000 0.6426 0.6895 0.8192 1.2578 0.8809 0.7170 1.0094 1.2285 0.2936 0.6640 0.5719 0.7707 0.3371 1.5336 2.7238 1.3845 1.7600 2.0351 1.0752 0.1939 0.3340 0.2910 0.4042 0.1797 0.4043 0.4987 0.3895 0.4417 0.4897 0.6305 0.8255 0.5596 0.7609 0.7821 0.9528 0.5651 0.6876 0.5141 0.8466 0.5100 0.4672 0.5472 0.6953 0.7438 1.1154 0.7874 1.2549 0.9406 1.1133 0.6179 0.3299 0.7632 0.9743 0.6727 1.4257 3.2472 3.9943 2.0944 2.3985 3.8132 0.4778 1.1775 0.7547 1.5787 0.9268 0.9205 0.3088 0.5870 0.7536 0.2718 0.3638 4-ethylcatechol sulfate 4.1746 2.4270 5.2426 12.9293 5.7767 0.6177 1.0240 0.4522 0.8145 1.8073 1.4152 1.1664 1.4209 0.7851 2.0281 0.9598 0.6854 0.4209 0.6042 0.5520 0.5314 0.5889 0.8289 0.7742 1.4243 0.9938 0.2258 2.1444 0.2258 0.4719 0.2258 0.5452 0.2258 0.2258 3.5048 0.3901 0.2916 0.2258 0.2258 0.2258 0.2258 1.8641 0.4601 1.6883 1.0761 2.0193 0.5652 0.4675 0.5495 0.6437 1.2971 0.6011 0.4869 0.6408 0.5523 0.6698 1.0637 0.6611 0.9660 2.9294 1.4120 1.0293 2.1733 2.1580 1.4764 1.0574 0.5366 0.3369 0.3320 0.2258 0.3007 0.2258 0.2258 0.2258 0.2258 0.2258 1.5201 0.4195 0.6133 0.4713 0.3085 0.7225 0.6661 0.3964 1.0823 0.2258 0.4713 0.2258 1.1901 0.2258 2.1593 0.9613 0.9922 0.4295 0.7203 0.8241 0.2258 1.2946 2.5168 1.1780 0.7781 1.6659 1.0728 0.4200 0.4823 1.7909 0.7437 1.5885 3.2031 3.5615 2.7554 3.3221 4.0620 2.3436 1.7435 0.3842 0.6494 0.2615 0.2258 3.9489 2.8854 2.3746 1.2698 1.9119 0.2258 0.2791 0.2258 0.4545 0.4657 1.2621 1.0062 1.7977 0.2258 0.8760 0.7620 0.2258 0.2258 2.0613 1.3489 1.0578 0.2258 1.2369 1.1529 0.9943 0.2258 1.9847 1.3963 0.6140 0.7308 1.1132 0.7628 0.8114 0.5649 0.5108 1.7374 3.6193 4.1397 1.8039 2.6911 0.2258 0.5083 0.9212 0.4614 0.9222 1.8624 1.2196 0.5402 2.8820 4.3600 2.8449 0.2258 0.2258 0.2258 0.4260 0.4631 0.2258 1.1090 0.7871 1.5190 1.2331 2.5999 0.4844 1.0057 0.6338 0.7252 1.3418 3.3107 4-ethylphenyl sulfate 46.5581 32.7857 72.1018 58.6532 41.4999 24.9907 1.6852 0.1244 1.7774 2.3471 1.2095 0.1048 0.1295 0.1941 0.1795 0.1587 0.1124 0.3430 0.2199 1.0000 0.2456 0.6635 0.2084 0.1746 2.3372 1.7309 0.4331 2.3759 0.2792 0.0834 0.3134 0.2307 1.0754 0.3996 6.8538 0.1141 0.0865 0.1077 0.1465 0.2926 0.1628 7.3431 2.5859 7.6466 4.4748 7.7384 5.1732 0.1956 1.2290 1.6386 1.7811 0.8545 0.7843 0.2237 0.8331 0.8733 0.9250 1.0770 2.2162 2.7237 1.9871 3.1405 0.3863 3.2886 2.0449 1.3326 0.3770 0.5094 0.0834 0.0834 0.1673 0.1482 0.0834 0.2661 0.0865 2.8898 9.4806 2.3462 2.5725 2.3659 1.1155 0.9744 2.4694 0.5231 0.9449 0.1327 2.8496 3.0629 3.3199 5.2827 9.6670 6.1091 0.1833 0.8911 0.9780 1.0052 1.1781 0.3183 3.0501 1.4832 0.2717 0.9068 0.3370 0.8752 1.6473 3.9563 1.2412 3.3334 6.4878 3.5787 0.5707 4.1671 2.8329 5.6708 3.3195 0.3797 1.5683 0.6590 0.7394 0.7116 2.8237 5.4921 1.3085 1.1171 0.3511 0.0834 0.0834 0.0834 0.2104 10.2430 0.1645 3.5004 3.4041 2.3489 5.9679 0.3467 0.5923 0.2856 0.7956 1.0256 0.6113 1.5440 1.0577 0.1285 0.9512 0.9035 1.3205 0.2757 0.1763 0.0834 0.1032 0.1522 0.1283 2.1346 0.2256 6.9044 4.1606 2.6751 2.0473 0.6252 0.2091 0.7597 0.2040 1.3668 0.5833 0.9737 0.6836 1.2908 0.8602 0.2456 1.0459 0.5949 0.2838 1.6162 0.9097 0.5337 3.7363 5.4469 5.3026 0.5126 6.1005 0.0834 3.2469 0.7580 0.6234 3.0439 2.9360 4-hydroxychlorothalonil 1.2735 1.1128 1.0000 1.1799 1.0946 1.0103 0.8613 0.8084 0.9469 0.8291 0.8394 0.6729 0.6228 0.4765 0.5143 0.5792 0.5692 0.5408 0.5684 0.6219 0.5074 0.7404 0.5839 1.9955 1.9425 2.2236 2.6694 2.9308 2.3708 0.9353 1.0328 0.9448 0.9072 1.0343 0.8428 0.8958 0.9029 0.7665 0.7489 0.7129 0.6878 0.2480 0.2310 0.1966 0.2322 0.2220 0.2202 1.0635 1.2703 1.1906 1.4393 1.2667 1.1218 0.9266 0.9349 0.9342 1.0205 1.0324 1.0908 1.1103 1.0987 1.1312 0.9837 1.1034 0.2172 0.2080 0.1889 0.2262 0.1886 0.6748 0.7583 0.6187 0.7498 0.7774 0.7307 1.2276 1.1478 1.0866 1.0404 1.0843 0.2369 0.2063 0.2264 0.2433 0.2788 0.1738 0.8336 0.8846 1.0929 0.9007 0.8619 0.9621 0.8727 0.8979 0.9001 0.8611 0.9153 1.7499 1.3475 1.2831 1.4521 1.5103 1.5865 0.9197 0.9186 0.9186 1.0120 0.9183 0.9706 1.9645 1.7069 2.5760 2.3765 1.7919 2.1108 0.8205 0.8169 0.7221 0.6959 0.1717 0.1742 0.2067 0.1751 0.1751 1.2092 1.1428 1.3796 1.3431 1.3061 0.5659 0.5892 0.6061 0.6319 0.5845 0.6131 0.7116 0.7281 0.7997 0.9406 0.7519 0.8087 1.6078 1.7676 1.3147 1.1895 1.4669 1.4183 1.5265 1.3953 1.7216 1.8978 1.4870 1.5527 0.9960 1.0129 1.0186 0.9908 1.0040 1.3012 2.9009 3.0932 2.6341 3.2161 2.7040 4.0542 1.3558 1.2845 2.6845 2.2017 1.3553 1.0395 1.1926 1.0279 1.3067 1.3518 1.6358 1.1204 1.1488 1.2196 1.1173 1.1213 1.0197 1.2644 1.1126 1.1916 1.0947 0.9778 4-hydroxyhippurate 2.7656 2.7322 1.7303 1.8943 2.0611 2.9004 1.1085 0.7308 0.3992 0.6507 0.7880 1.0762 1.5091 1.5496 1.6605 2.1732 1.3356 1.3495 0.4944 1.5972 1.7955 0.8120 1.1771 1.3138 1.2615 1.1745 0.4505 1.0062 0.8331 1.3736 0.2609 0.8550 0.6137 1.3441 0.8130 0.4766 1.7942 0.9467 0.9539 1.2755 0.7136 2.4443 1.6033 1.5936 1.0352 1.8028 1.1232 1.2611 0.8247 0.6383 0.9642 1.0000 0.8482 0.5493 0.2785 0.4513 0.7367 0.3537 0.6288 1.2030 1.4688 0.7602 1.2947 1.0963 3.0724 2.7208 1.8477 1.5058 2.5478 0.5468 0.7816 0.6172 0.9366 1.1655 0.9944 1.1401 0.7626 0.5752 0.8304 0.7593 0.5036 0.4480 1.2900 0.8128 1.2687 1.3885 0.8137 0.7172 1.0398 0.5337 0.7781 0.7482 2.0263 0.4963 0.9363 1.0226 0.6039 3.8322 4.2379 2.8169 2.0897 4.2005 3.0941 0.5141 1.1351 1.1960 1.0327 0.6590 1.3643 1.1630 1.0054 0.6559 0.8192 0.7495 0.5383 1.1866 0.9055 0.7537 0.4977 1.0791 1.3862 1.5397 0.5569 1.0660 0.4333 0.7686 0.2929 0.8429 0.7427 0.3051 0.4435 0.3177 0.3410 0.3197 0.4261 0.3459 0.3383 0.8986 0.5434 0.7544 0.8130 1.6397 0.8991 0.9770 0.4942 1.3585 0.6535 3.8305 1.6642 1.3901 2.5989 5.8051 4.1681 2.9366 1.0726 0.7001 1.0904 0.6058 0.7238 2.7247 0.8272 2.1596 1.2058 1.1419 1.8631 0.8951 0.9938 0.4926 1.6103 2.1605 1.7287 0.6102 1.6819 0.7022 0.7609 1.6392 0.9314 0.6208 1.0829 1.4536 0.9435 5.2803 0.6862 0.8791 1.1952 1.0667 1.5054 4-hydroxyphenylacetate 0.2231 0.6884 0.6923 0.2231 0.2231 0.2231 0.2231 0.2231 0.2231 0.2231 0.2231 1.1452 1.0172 2.6346 2.6932 1.1012 1.3094 0.2231 0.2231 0.2231 0.2231 0.2231 0.2231 0.6374 1.3535 0.7383 0.2231 1.3786 0.2231 0.9908 0.2231 0.9423 0.2231 1.0851 0.2231 0.6303 0.2231 0.2231 0.2231 0.2231 0.2231 0.9124 1.1553 1.1501 1.0917 0.2231 0.2231 1.4646 1.1483 0.6264 0.8389 2.4026 1.9254 0.2231 0.2231 0.9058 0.2231 0.2231 1.2345 0.4728 0.9725 0.2231 1.1627 0.2231 1.4351 0.9465 0.2231 1.0420 0.9672 0.2231 0.2231 0.2231 0.2231 1.0428 0.2231 0.7305 0.2231 0.2231 0.7081 0.2231 0.6400 0.2231 0.2231 0.8232 0.2231 0.2231 1.0092 1.6827 1.2932 0.2231 3.0392 2.1329 0.2231 0.2231 0.5587 0.2231 0.2231 0.9014 0.2231 1.0349 1.1928 1.7587 0.2231 0.6444 0.2231 0.8328 0.2231 0.2231 0.2231 0.9828 0.8582 1.1122 0.7414 0.2231 0.2231 0.2231 0.2231 0.2231 0.2231 3.0118 3.0390 0.2231 0.2231 0.2231 0.2231 0.2231 0.2231 0.2231 0.2231 0.2231 0.5644 0.2231 0.5796 0.2231 0.7872 0.2231 0.2231 1.2191 0.6032 0.7773 0.6755 0.2231 0.7344 0.2231 0.2231 1.2758 0.2231 1.4273 1.5531 2.3772 2.6313 1.5062 1.9556 0.2231 0.2231 0.2231 0.2231 0.2231 0.7875 0.2231 0.2231 0.2231 0.7709 0.2231 0.2231 0.2231 0.9843 0.9582 1.0255 0.2231 0.8091 0.7150 1.3629 1.0338 1.3318 1.2899 0.2231 0.2231 0.2231 0.2231 0.5802 0.7254 0.6838 0.2231 0.8090 0.4337 0.2231 4-hydroxyphenylpyruvate 1.1578 1.2880 1.3231 1.0350 0.8166 1.0000 1.1826 1.2413 1.1623 0.9364 1.1005 1.1227 1.6606 1.6541 1.2906 1.5501 1.3973 1.0621 1.3526 1.4141 1.3971 1.0995 1.1025 0.8250 1.1118 0.7047 1.0752 1.0014 0.8305 1.4727 1.6840 1.5287 1.0236 0.8841 1.0400 1.1706 1.1165 1.3475 1.4325 1.6938 1.1874 0.8119 1.0302 0.6512 0.6939 0.8723 0.8338 0.8985 0.9158 0.9286 0.7286 0.8363 0.5998 0.8715 0.8111 0.8849 1.1451 1.2199 0.7511 0.9163 1.3059 1.2848 1.1600 0.9249 1.0523 0.9986 0.8160 0.9174 0.7797 1.0110 0.8543 0.7197 1.0661 1.2873 1.0800 1.1534 1.0775 1.2488 1.0220 0.9544 0.8737 1.0710 0.9812 0.7171 0.9410 0.9223 0.9512 1.1892 1.0434 0.6903 1.1163 0.9243 1.1025 1.0361 0.9682 0.8383 1.2499 0.9024 0.8644 1.0064 0.7337 0.9519 0.8028 0.9728 0.6769 1.1539 0.8194 1.0095 1.2142 1.0987 1.1210 1.4341 0.7141 0.8863 0.8447 0.5375 0.6626 0.6634 0.6695 0.7385 0.7963 0.7598 0.8743 0.7987 0.6967 0.8786 0.9251 0.9451 0.8406 0.7726 1.1758 1.3542 1.8173 1.3785 1.0126 0.8409 1.0240 1.1064 1.0619 0.8670 1.0541 0.9780 0.8415 1.2876 1.0685 1.1828 1.0290 0.9834 0.8225 0.9497 0.9741 0.8179 0.7987 0.9554 1.1218 1.2758 1.0207 1.1319 1.1906 1.0406 0.6747 1.3146 0.9250 0.9877 0.8762 0.8300 0.7894 1.0219 1.1409 1.2489 0.6608 1.0258 1.1755 0.8600 0.8947 1.2049 0.7650 0.9262 0.8448 1.0313 0.8302 1.2815 1.2562 0.5594 1.2220 0.8934 0.9561 4-methoxyphenol sulfate 0.4974 0.6131 0.3277 0.3277 0.6348 2.0677 0.4906 0.7810 0.3701 0.5200 1.9871 0.8856 1.0771 1.5095 0.6977 1.7626 1.5103 0.7197 0.3277 3.0449 1.4124 0.9341 0.7168 1.2394 0.5882 1.8033 0.8189 0.8479 0.9782 1.9197 0.5258 0.9749 0.5302 2.0493 0.9580 0.3277 1.5348 0.8659 0.5334 2.3368 0.9982 0.9624 2.4065 0.9609 1.1599 2.5577 0.6386 1.5251 0.7114 1.1756 1.0938 1.0239 0.3277 2.1955 0.3277 1.3042 1.6173 1.8893 0.7169 2.5080 1.1900 0.8683 1.3274 0.5722 0.3277 0.8308 0.3277 0.3277 0.7862 0.8691 0.7160 2.3532 1.2048 0.3775 1.4700 1.0896 1.2724 0.3932 0.8860 1.4735 1.1030 0.4667 2.0968 0.7156 1.0598 0.9675 0.9381 1.5399 4.1708 0.7086 1.9563 1.1306 1.3327 0.5093 1.6414 0.7213 0.3277 1.2557 0.9901 1.3965 1.1275 3.1288 1.4702 0.9450 2.2662 0.9835 0.4560 0.8005 1.2577 0.8096 1.1677 0.6836 3.2379 0.3826 0.7757 0.9839 0.3958 1.9022 0.8128 1.4282 3.8078 0.7291 0.6456 1.1652 0.3277 0.6528 0.3277 0.7048 1.2261 0.3277 0.9607 2.2117 0.3277 0.5014 0.8288 1.1065 0.3277 1.0018 0.8661 0.3277 0.5446 0.8325 2.3827 1.7395 0.6218 1.0240 1.1654 2.8713 1.6245 1.3975 1.9610 0.9399 1.8041 0.8156 1.2330 0.8581 2.6110 0.5826 0.9350 0.8682 0.7939 2.4157 1.2062 1.0000 1.9504 0.3277 0.3277 0.7818 1.3788 1.6191 0.3768 0.9300 1.6703 0.7195 3.2981 1.6639 0.5641 0.5919 0.5802 1.3809 1.7020 1.0681 0.3277 0.5588 1.0996 0.8175 1.5612 4-methyl-2-oxopentanoate 0.9258 0.8512 0.4322 1.2137 1.0914 0.8818 1.1178 1.0223 0.8021 0.9913 1.1215 1.5398 1.7917 1.9059 1.8422 1.7637 2.0450 1.1048 0.4928 1.6520 0.9104 1.3378 1.0596 0.6339 0.8343 0.7691 0.5537 1.2052 0.6160 1.2048 0.9868 1.2969 1.1596 1.0868 1.1466 1.0965 1.0180 0.9978 0.9586 0.9424 0.8484 1.1478 1.1367 1.2383 1.2757 1.2027 1.3752 0.7376 0.3954 1.2840 1.0296 0.7912 0.7584 0.7366 0.9693 1.1455 0.8980 0.5887 0.7515 1.4417 1.3781 1.5494 1.2295 1.4802 1.0107 0.9171 0.6529 0.6957 0.6449 0.5607 1.1654 0.9528 0.5864 1.1118 0.6635 0.9944 0.8898 1.1060 0.8808 0.8435 1.1964 0.5221 1.0039 0.9791 0.8235 0.7271 1.2011 1.1108 1.0426 1.2808 1.1235 1.3962 1.0448 1.2134 1.3054 1.1700 1.0161 0.8870 0.8621 0.8542 0.9366 1.2169 0.9009 1.2999 1.5201 1.2112 1.3354 0.6990 1.2215 0.7566 0.7922 0.6559 0.9526 0.9059 0.9482 0.7937 1.2800 1.3437 1.3131 0.4162 0.4362 0.4838 0.4738 0.3842 1.1213 0.7707 0.5107 0.8592 1.1722 1.4301 1.3555 1.6020 0.9893 1.2368 1.5740 0.9396 0.7015 0.9602 1.3107 1.0447 0.9439 1.4091 1.5455 1.3233 0.7454 1.4844 1.6269 0.9251 0.9879 0.7314 1.0290 1.2346 0.8542 0.8760 0.9845 0.9216 0.8532 1.0590 1.1375 0.9410 1.1583 0.9511 1.0504 0.8162 1.0202 1.1028 0.9450 0.5343 0.8463 0.8285 1.0993 0.6307 1.0000 1.3630 1.0656 1.0229 0.8768 0.6074 0.8198 0.8086 1.3062 0.7683 1.7205 0.6635 0.9169 1.2989 1.2295 4-methylbenzenesulfonate 0.7677 0.6965 0.7982 1.1201 0.9213 0.7695 1.0810 0.9634 1.0078 1.0703 1.0409 1.2138 1.0695 1.1396 1.2094 1.2444 1.3249 0.9412 0.7683 0.8887 0.7634 1.0234 1.0492 0.9628 0.9138 0.9279 0.8524 0.9084 0.8390 1.0013 0.9548 1.1405 1.0796 0.9841 1.2151 0.9339 0.7270 0.8983 0.9664 0.6346 0.9276 0.7887 0.8138 0.7402 1.0000 1.0065 0.9810 1.0697 0.9643 0.9128 1.0952 1.0091 1.2110 0.8083 0.7684 0.8144 0.8667 0.8897 0.7813 0.7025 0.7768 0.6314 0.8075 0.8747 1.1601 1.0938 0.8423 1.0682 0.9325 0.8956 0.8383 0.7206 0.7750 0.8676 0.9550 1.2373 1.0197 0.8062 1.0171 0.8916 1.1911 1.0668 0.9212 1.0151 0.9927 0.9606 0.9116 0.6993 0.7619 0.8832 0.7755 0.9873 1.0522 0.9963 0.8425 0.8529 0.9473 1.3345 1.1857 1.3196 1.2541 1.1659 1.0793 1.5078 0.9897 1.0475 1.1117 1.0212 0.9425 1.0321 1.0512 1.1380 1.1051 0.8165 1.0643 1.1988 1.0821 1.2835 1.2614 0.8962 0.9424 1.2009 0.8748 1.1943 0.9059 1.1497 1.1106 1.0620 1.0487 0.9987 1.1879 1.1426 1.1356 1.4460 1.2173 0.7188 0.9793 1.1762 1.0974 0.8949 1.1643 0.9234 0.7920 0.8867 0.9828 1.1757 1.0699 1.2107 1.0272 0.9223 0.8761 0.9140 1.1590 0.9936 1.0665 1.1232 0.8656 1.3259 1.3519 1.1679 1.0877 1.0651 1.3009 1.1839 1.3254 1.3896 1.0301 1.1463 1.3968 1.2794 1.1838 0.9025 0.8815 1.1974 1.2757 1.2621 0.8853 0.9056 0.8739 0.8237 0.8189 1.3060 1.1211 1.1852 1.1412 0.8195 0.7512 4-methylcatechol sulfate 0.4335 0.6328 0.3060 0.4101 0.5441 1.0838 1.1456 1.4394 0.8121 1.5064 3.4439 2.5807 2.1997 2.5717 2.8932 3.4274 2.7646 0.1725 0.4154 0.2696 0.4071 0.5939 0.5427 1.6840 1.4553 2.7654 0.6675 1.8802 0.5376 1.1438 0.3399 0.5323 0.2248 1.5096 1.0422 0.3236 0.8364 0.4922 0.5069 2.6333 0.6520 1.1891 1.4093 0.9718 0.9131 2.6591 0.6417 1.6918 1.0000 4.1123 1.1559 1.1984 0.4092 1.2148 0.6623 0.6385 0.9442 0.7282 1.1662 5.4740 1.5429 1.4467 4.5192 1.9810 0.5786 0.5302 0.4176 0.3712 0.7314 0.0882 0.5269 3.2574 0.0889 0.4884 0.3597 0.9620 0.8741 0.2634 0.5278 0.8889 0.2553 0.4925 2.8470 0.4722 0.7494 0.8945 2.2105 1.0849 6.7536 1.0932 4.6221 1.5375 1.0998 0.5926 3.5497 1.5311 1.0635 2.1300 1.5228 1.5284 0.9902 2.9258 1.0274 0.8192 2.2333 1.2779 1.6704 0.9212 2.2225 1.1382 1.5758 0.9405 5.6841 1.2960 0.9321 0.6236 0.9395 2.3744 0.6928 1.3963 2.7121 0.8258 0.4283 0.7195 0.4683 0.7363 0.2312 0.4067 0.4776 0.5248 0.3361 1.0431 0.1549 0.3392 0.3254 3.4785 1.7670 2.1456 1.7808 1.5214 1.7240 1.2551 2.5335 1.3314 1.0756 1.8462 0.9594 0.7811 1.3034 0.5395 0.4877 1.1195 0.8695 1.0715 2.1702 1.1548 4.9329 0.6704 1.0852 0.6547 0.6628 0.9700 0.7275 0.7992 1.0098 1.0710 0.6459 1.1288 1.5784 1.8238 0.3983 0.4961 1.5699 0.5466 2.1241 0.4967 1.1854 0.8535 0.8042 3.3746 3.4963 1.1527 0.5024 0.9477 1.0393 0.8382 5.2458 4-methylguaiacol sulfate 0.3590 0.3859 0.3590 0.3590 0.3590 0.4589 1.0003 1.0667 0.5675 1.0394 3.9473 2.9420 2.9013 2.9881 3.2397 4.3052 4.2725 0.3590 0.3590 0.3590 0.3590 0.3590 0.3590 1.1316 1.0000 2.4907 0.3590 1.1526 0.3590 0.7918 0.3590 0.3590 0.3590 1.1128 0.5732 0.3590 0.3590 0.3590 0.3590 3.1033 0.3590 0.7993 0.6207 0.8687 0.5017 2.3987 0.3590 1.5755 0.6036 5.7944 0.9576 1.0909 0.3590 0.7584 0.3590 0.3590 0.6442 0.3590 1.2768 8.7762 2.3570 2.2420 5.3387 2.0332 0.4642 0.3590 0.3590 0.3590 0.5975 0.3590 0.4669 3.2730 0.3590 0.3590 0.3590 0.3590 0.3761 0.3590 0.3590 0.3590 0.3590 0.3590 3.1296 0.3590 0.5211 0.3590 1.0284 1.0422 15.7900 1.5001 5.0557 1.9576 0.5361 0.3590 2.0793 0.9707 0.5409 1.7050 1.0002 1.4928 0.8671 3.2683 0.7926 0.7116 4.2735 1.2331 0.9997 1.1065 1.6688 0.6493 0.3590 0.3960 4.2026 0.7831 0.3712 0.7760 0.7256 4.3573 1.1915 0.8317 1.3638 0.7085 0.3590 0.3590 0.3590 0.3590 0.3590 0.3590 0.3590 0.5648 0.3590 1.4711 0.3590 0.3590 0.4228 4.5845 1.2790 1.9979 1.2535 0.8950 1.1875 0.4420 1.6010 0.3874 0.5127 1.0662 0.3590 0.4424 2.0090 0.5297 0.5163 0.7278 0.8195 0.3590 0.9175 0.5336 3.6136 0.3590 0.3994 0.3590 0.4987 0.6261 0.3877 0.5656 0.6742 0.5156 0.3590 0.5107 1.1393 1.0709 0.3590 0.5776 1.4040 0.5879 4.3075 0.6869 1.2247 0.6368 0.7547 3.2705 6.2839 0.6710 0.3590 0.4929 0.7740 0.4305 5.2112 4-vinylphenol sulfate 1.6463 0.8710 1.3987 1.4450 1.5400 2.1426 0.7685 0.3498 0.6121 1.1454 1.5297 0.7737 1.2488 0.3500 1.0663 1.5080 1.0156 0.9115 0.8065 1.9754 1.0290 1.3462 1.1298 0.6957 0.7063 1.7033 0.7630 1.2359 1.0238 0.4440 0.6896 1.0442 0.9479 1.6784 1.4291 0.5518 0.3351 0.8902 0.3812 1.7109 1.3403 1.9397 0.7421 1.8730 1.1972 2.4870 0.9993 0.2556 0.6022 1.2187 0.8254 0.7197 0.1440 0.2858 0.1589 0.9929 0.9161 0.6002 1.0291 2.0576 1.3128 1.7186 0.4702 1.1989 0.4421 0.6182 0.4333 0.2374 0.1072 0.5410 1.2035 1.3631 0.8450 0.8818 0.4138 1.7575 1.7282 0.8011 1.3160 0.6466 1.0000 0.5298 0.8889 0.3914 0.9447 0.4316 2.0609 3.1059 3.4536 1.9452 2.1624 2.5172 0.2906 1.2018 1.6930 1.0486 0.6731 0.5689 1.3530 1.5655 0.9515 1.3998 1.3779 1.0772 1.7280 1.5329 0.7550 0.9727 2.5948 1.1681 1.2091 1.0736 1.9159 0.4022 1.5030 0.6904 0.7569 1.0412 0.9454 1.1356 2.3990 0.6417 1.0040 1.4187 0.3676 0.2669 0.4911 0.7222 1.2867 0.9960 0.3893 1.6018 0.5060 0.7361 0.9528 1.1577 0.4188 0.3228 0.7272 0.4428 0.6067 1.0493 1.8349 0.4347 0.6254 0.9832 1.3295 2.0725 1.3156 0.7969 1.0673 1.0308 0.4324 1.5675 0.6993 1.8632 2.3941 0.9351 1.4285 0.8289 0.6376 1.5378 0.9281 1.0637 1.3531 0.4684 0.1495 0.9830 1.5031 0.5605 1.4203 1.1746 0.7034 1.9193 2.4785 1.5750 1.3960 1.0235 1.6125 0.6165 1.9630 0.9181 0.7713 0.6394 0.9814 0.6400 1.3006 5,6-dihydrothymine 1.6405 1.1192 1.2979 1.0982 1.0223 1.0722 1.0171 0.9553 1.0233 0.8295 0.8333 1.1077 0.8134 1.1689 0.7646 0.8399 0.8733 1.0862 1.7432 0.7958 1.2635 1.1682 1.1310 1.0091 1.0015 0.8276 0.9092 1.2029 0.7985 1.0001 1.0876 0.8970 0.9361 0.6094 0.7812 1.0000 1.1296 1.2756 1.0594 1.1322 1.1142 1.0598 1.0853 0.6659 0.6277 0.9431 0.9972 0.8691 0.9362 0.7962 1.1529 0.6616 0.5912 0.7939 0.7381 0.7685 0.7129 0.8971 0.8528 0.7451 1.3740 0.7404 1.1138 0.6638 1.0311 1.0127 1.2304 1.1653 0.9656 1.1190 1.0912 1.0176 1.1215 1.0057 1.0343 0.9428 1.0428 1.3568 1.1777 0.9981 0.9472 1.2208 0.6992 0.6863 1.2274 1.2753 0.9577 0.8783 1.0084 1.4801 1.6064 1.1699 0.8151 0.9132 0.8523 0.9169 1.2009 1.0258 0.8016 1.1880 0.6591 1.0512 0.7938 0.8348 1.1131 1.6909 1.1392 1.3023 1.4291 0.7591 0.6852 0.8022 0.9008 0.4791 0.8621 0.7097 0.6148 0.6822 0.9799 1.0198 0.9838 1.3062 1.1024 0.9489 0.8682 1.0000 1.2957 1.1959 0.8982 1.0656 0.9750 0.8471 1.4096 1.0872 1.0000 0.9895 1.1560 1.0816 1.6771 1.0321 1.1010 0.7907 1.0609 1.2289 0.7968 1.1956 0.8454 0.9088 0.6619 1.1823 1.1926 0.7660 1.0126 1.3593 1.1391 0.8877 1.4266 1.1188 1.1515 0.8704 0.9101 1.3848 0.9467 0.9811 1.4904 0.6389 0.5810 1.0706 0.9992 1.2040 0.6141 0.8323 1.4056 1.2763 0.9959 1.7726 0.7623 1.0672 0.9673 0.9874 0.6407 0.8703 0.7348 0.8157 1.2652 0.9255 0.8437 5,6-dihydrouracil 0.3825 0.9843 0.8804 1.6206 0.3825 0.3825 0.3825 0.3825 1.2596 0.3825 0.3825 0.3825 0.3825 0.3825 0.3825 0.3825 0.3825 0.9808 0.7212 1.0728 1.1523 1.6320 1.0422 0.3825 0.9240 0.7091 0.8544 1.0825 1.3602 1.0069 1.4297 0.3825 1.2539 0.3825 1.7721 1.7807 1.5342 0.3825 0.3825 0.7865 1.1164 0.3825 0.3825 0.9877 0.3825 0.3825 0.5273 0.3825 0.3825 0.3825 1.2200 0.3825 0.8527 0.3825 0.8702 0.9220 1.6252 0.3825 0.4051 0.9585 0.9931 1.3174 0.8102 0.7747 0.3825 0.6827 0.3825 0.7706 0.7930 1.0276 0.7886 0.3825 0.9390 1.0233 0.3825 0.3825 0.3825 0.9658 0.9848 0.6398 0.7119 0.3825 0.5834 0.6792 0.8788 1.1498 0.9378 0.3825 1.5901 1.5161 0.3825 1.8215 1.6820 1.1117 1.2995 2.1851 1.5222 0.8164 0.3825 0.3825 1.0193 0.7616 0.3825 0.3825 0.7566 1.1541 1.2309 0.7662 0.9222 0.3825 0.3825 0.8370 0.3825 0.3825 0.3825 1.0236 0.5209 0.3825 0.6235 0.7047 1.0459 0.6202 1.1971 1.1946 1.1329 1.2142 1.2267 0.9156 0.7369 0.3825 1.1407 0.3825 0.8946 0.3825 0.8842 0.3825 1.7201 1.5549 1.2936 0.3825 1.0395 0.3825 0.5700 1.6621 0.3825 1.0129 0.9629 0.8774 0.3825 0.3825 1.3111 0.6567 0.3825 1.0718 0.3825 0.6531 1.0343 0.8823 0.9478 0.3825 0.8727 0.9877 0.3825 1.8641 1.1370 0.8422 0.4212 0.3825 1.0563 0.9213 1.1145 0.3825 1.7424 1.3811 0.3825 1.3345 0.5464 0.3825 1.0000 1.0964 0.3825 0.3825 1.2685 0.3825 0.3825 0.3825 1.3553 5,6-dihydrouridine 1.0905 1.1493 1.0402 0.7878 0.6757 0.9389 0.9110 1.0314 0.9372 0.7063 0.7081 1.3761 1.1128 1.1668 1.0796 1.1281 1.1621 0.5086 0.7652 0.6843 0.8530 0.6927 0.8389 0.7332 0.6873 0.6061 0.6211 0.6388 0.7523 1.3732 1.2751 1.4559 0.8515 0.9990 0.9268 1.0721 1.0300 1.0786 1.0809 1.1419 1.0948 1.1877 1.2332 1.3393 1.2924 1.1612 1.2598 0.9394 0.9609 0.7405 0.8479 1.0000 0.6118 1.3891 0.8875 0.8116 1.3604 0.9686 1.0505 0.9147 1.1086 0.9662 1.1497 0.7082 1.0459 1.2268 1.1702 1.0577 1.0234 1.1815 0.9338 0.7639 1.1291 0.9035 1.3635 1.0792 0.9648 0.8818 0.8851 0.9836 1.0243 1.1587 1.1972 0.7655 1.5693 1.4051 1.1800 1.2455 1.3544 1.3862 1.2376 1.1670 1.0010 0.7584 0.8173 0.9577 1.0211 1.4254 1.3718 1.4338 1.3570 1.4779 1.4988 0.7225 0.9241 0.9968 0.6833 0.8047 1.1627 1.1924 1.2764 1.2856 1.0280 0.8076 0.9686 0.8789 0.4983 0.5414 0.6221 1.2994 0.9326 1.1719 0.9120 0.9957 0.7234 1.1292 0.8307 0.9911 0.8676 0.6983 0.9261 0.7209 0.9301 0.9289 0.7229 0.7475 0.9063 0.8164 0.8282 0.5879 0.9855 0.7766 0.7086 0.9671 0.9870 1.1164 0.7646 0.9273 0.7974 1.1137 1.2737 0.7634 1.2234 1.0212 1.0864 1.0044 1.0639 1.1244 0.9523 1.1302 1.1387 1.1776 1.0912 0.9974 1.2827 0.7881 0.6795 0.9444 1.1025 1.2349 1.0119 1.5892 2.0652 1.3010 1.1597 1.9523 0.7033 0.8345 0.7811 1.0857 0.8395 1.2121 1.1941 1.1194 1.2007 0.9067 0.8459 5alpha-androstan-3alpha,17beta-diol monosulfate (1) 1.1585 1.0729 0.7853 0.4274 0.4422 0.5799 0.8287 0.7160 0.7042 0.3480 0.6047 2.0099 1.3702 1.4515 1.1687 1.3262 1.8300 0.3098 0.5886 0.6377 0.6430 0.4300 0.8122 1.1016 0.9375 0.9833 1.1020 1.0404 0.9431 2.2515 1.7096 1.8864 0.8532 1.6071 0.9112 2.8123 2.3789 2.3270 1.9785 2.4338 1.6945 2.2613 2.6729 2.2564 2.4912 2.9494 2.9214 0.4217 0.4506 0.4212 0.3689 0.4919 0.3098 2.6274 1.2127 1.8223 2.3650 2.3480 2.3272 1.3513 2.6540 1.4788 2.8564 1.0511 1.2926 0.9473 1.2165 1.2671 0.8875 0.6527 0.5552 0.4410 0.6037 0.5008 0.7744 0.3098 0.3098 0.4285 0.4022 0.3890 0.9085 1.0938 0.9597 0.7063 1.6380 1.5547 0.5033 0.5673 0.4446 0.4880 0.6812 0.5913 2.6308 1.2608 1.8346 2.3794 2.7746 1.0207 0.9014 0.9912 1.3043 1.1510 1.1144 0.4123 0.5136 0.9139 0.4228 0.5004 0.9828 3.0409 2.5667 2.3927 1.6528 1.0172 1.3937 0.3098 0.3098 0.3098 0.3098 0.6407 0.5606 0.5241 0.6438 0.5601 0.6441 1.6658 1.5816 1.9279 1.1057 0.3098 0.4899 0.3213 0.3098 0.4954 0.3098 1.0991 2.0038 3.4414 1.0370 0.6553 2.3802 0.5063 0.4564 0.5737 0.6018 0.7704 0.3870 2.4020 1.9162 3.6124 4.1652 1.7817 3.1407 1.6470 1.3038 1.4820 1.3370 1.7345 1.8102 0.9164 0.9811 0.8254 0.9501 0.8131 1.0000 0.7333 0.5330 0.7438 0.7203 0.7391 0.3401 0.8161 0.8998 0.7013 0.8463 0.9381 1.9398 1.6971 1.7926 1.9445 1.8574 3.3801 0.9114 2.1623 2.6725 0.8874 0.6174 5alpha-androstan-3alpha,17beta-diol monosulfate (2) 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 1.5556 1.1294 0.8947 1.3849 1.1766 1.2837 0.3426 0.3426 0.5883 0.5184 0.3426 0.5184 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.6719 0.3426 0.6686 0.3426 0.5131 0.6548 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 7.6245 8.0224 7.4037 8.2146 7.9841 8.1475 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3915 0.3426 1.7901 1.9739 2.3331 2.1706 1.7439 1.8748 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3524 0.3426 0.3426 0.3426 0.3426 1.4225 1.5854 1.4395 1.3487 1.3672 1.8929 0.7815 0.3426 0.6430 0.7458 0.6059 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.7873 1.0538 1.1158 0.5532 0.9677 1.0323 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 2.6351 2.4518 2.8012 2.8210 3.0478 2.6012 0.4877 0.3426 0.3426 0.3426 0.3426 0.5115 0.3426 0.3825 0.3426 0.5512 0.5710 0.4623 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.7373 0.8063 0.8003 0.6659 1.0000 0.8295 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.3426 0.5554 0.3426 0.3426 0.3426 0.8776 0.6666 1.1163 1.0880 0.9671 0.6078 5alpha-androstan-3beta,17alpha-diol disulfate 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.9704 0.8784 0.7263 0.8523 1.0634 1.1351 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.6551 0.7209 0.4329 0.7199 0.6941 0.8815 0.9189 0.8826 1.0317 1.0282 0.6966 4.5110 1.8335 4.3807 2.8427 4.5139 2.9059 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 1.3016 0.4329 0.9711 1.2793 1.1604 7.3879 6.9695 6.8623 5.3767 7.5549 4.6146 0.8479 0.8492 0.5603 0.7007 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.6891 0.9585 0.8167 0.4329 1.0661 0.9698 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.8440 0.4329 0.9103 0.9895 0.8831 0.4329 0.4760 0.4329 0.4329 0.4421 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.7779 0.9935 0.4329 0.5247 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 2.4624 1.7683 2.1328 2.2203 2.3882 0.4329 0.4329 0.4329 0.5425 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.4329 0.6403 0.7525 1.0124 1.1088 1.0105 1.0810 0.5722 0.4329 0.4329 0.4329 0.4329 0.4329 0.5912 0.4329 1.8348 1.4384 1.6160 0.4329 0.4329 0.4329 0.4329 0.4329 0.5566 1.3703 1.2876 1.0165 0.9617 0.9561 1.0654 1.3235 1.0065 1.6009 0.9710 1.0824 5alpha-androstan-3beta,17beta-diol disulfate 0.7788 0.7489 0.6923 0.4563 0.4578 0.5819 0.9510 0.8619 1.0000 0.7576 0.8963 1.7310 1.5159 1.1742 1.3632 1.4210 1.5690 0.3278 0.5315 0.4887 0.5541 0.4224 0.5757 0.6511 0.6199 0.6540 0.6886 0.6632 0.6445 2.0998 1.9311 2.1572 1.4815 1.8246 1.7083 3.3962 3.4719 3.1813 3.3019 3.3063 2.9279 5.8028 5.1237 5.7561 5.3325 5.4877 5.2031 0.6518 0.6955 0.6401 0.6348 0.6730 0.5243 1.2657 0.8431 1.0358 1.2471 1.2175 3.8083 3.2889 3.8893 2.8307 3.9205 2.5940 0.7919 0.7391 0.7380 0.7317 0.6066 0.8233 0.8834 0.7844 0.8913 0.8869 0.8747 0.1871 0.1707 0.1623 0.2016 0.1813 2.9942 3.5065 2.9896 2.5376 4.0637 3.7452 1.1946 1.2008 1.2890 1.1865 1.2952 1.3431 3.9280 2.4604 3.1687 3.4894 3.9921 0.7976 0.7243 0.7845 0.7733 0.8629 0.8608 0.5560 0.6770 0.7037 0.4768 0.6612 0.7596 1.5604 2.0482 1.8260 1.1444 0.6201 0.8144 0.2803 0.2533 0.2651 0.2782 0.6063 0.5972 0.5766 0.5931 0.6645 1.1591 1.7507 1.5836 1.8374 1.3906 0.9489 1.3201 1.0630 1.2531 1.1888 0.9324 1.2393 1.5300 1.6431 1.3219 1.0575 1.5268 0.8482 0.8594 1.0125 0.8780 1.0572 0.8094 1.1604 0.9579 1.2962 1.2712 0.8766 1.1581 0.8622 1.0043 0.9235 0.9148 0.9187 1.0569 0.9555 0.9957 0.9491 0.9875 0.8721 1.0300 0.9513 0.7553 1.4455 1.4825 1.4246 0.5332 0.6875 0.6675 0.6093 0.6747 0.7605 2.8646 3.1652 2.7332 3.1512 2.7301 1.7203 1.3388 1.5921 2.0026 1.2445 1.3008 5alpha-androstan-3beta,17beta-diol monosulfate (2) 0.4787 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.5490 0.3292 0.3292 0.3292 1.3804 1.0826 0.9525 1.0234 1.0950 1.1704 0.3292 0.3292 0.4140 0.3292 0.3292 0.5326 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 1.2752 1.2190 1.2421 0.3292 1.0711 0.7043 1.1156 1.3781 1.1682 1.0072 1.0552 0.9589 1.7006 1.7061 1.5351 1.6059 1.5397 1.8807 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 1.4384 0.7080 1.0830 1.6581 1.4685 1.9800 1.1448 1.9171 0.8652 2.0946 0.9559 1.0803 0.7919 0.9125 1.0712 0.6077 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.5540 0.8379 0.6944 0.4443 0.9928 1.1185 0.5427 0.3292 0.3292 0.3292 0.3292 0.3292 2.0209 0.6473 1.0142 1.6943 1.8214 0.7671 0.6555 0.6686 0.7965 0.7844 0.7144 0.3292 0.3292 0.3397 0.3292 0.3292 0.3292 1.1404 0.7803 0.8632 0.5821 0.3292 0.5342 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 1.2176 1.2166 1.3586 0.8042 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.6463 1.3717 1.9613 0.6790 0.3644 1.2533 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.8467 0.6843 1.1868 1.3849 0.5515 1.1385 0.9858 1.0508 1.0744 0.9556 1.2946 1.2031 0.3292 0.3292 0.3292 0.3292 0.3292 0.3292 0.6290 0.5122 0.7041 0.7249 0.5869 0.3292 0.3292 0.3292 0.3292 0.3292 0.5402 0.9192 0.9136 1.1627 0.9199 0.8554 1.8013 0.7369 1.2801 1.7443 0.3292 0.4473 5alpha-pregnan-3beta,20alpha-diol disulfate 0.6244 0.5177 0.6120 0.4738 0.3781 0.5759 2.7138 3.3264 2.7841 1.6240 2.4332 1.1883 1.0000 0.8330 0.9480 0.8883 1.0799 0.3736 0.3288 0.4250 0.3311 0.4051 0.3988 0.3811 0.3976 0.3565 0.3646 0.3916 0.4359 0.6098 0.6020 0.6381 0.6281 0.7508 0.6478 6.9038 4.6477 6.3990 9.9714 8.1697 8.8533 0.9909 0.6021 1.0116 0.6527 0.8735 0.7595 0.8418 1.1293 1.0556 1.1910 0.7699 0.8939 1.1961 1.4505 1.4069 1.2868 1.3096 2.7407 3.1071 2.5467 2.5578 2.1545 2.3879 2.3208 1.5257 1.0158 1.0417 1.2306 0.6196 0.7856 0.6155 0.6185 0.7921 0.6228 1.1107 0.9951 0.9860 0.9423 0.9373 1.0845 1.1887 1.2067 1.0314 1.2693 1.0188 0.3081 0.2738 0.3334 0.2366 0.2748 0.2481 8.4916 13.0738 14.9868 11.5578 13.1425 0.5618 0.4470 0.4320 0.4984 0.5864 0.5300 0.3700 0.3539 0.3056 0.3757 0.3548 0.2909 0.5260 0.7754 0.7054 0.5042 0.5645 0.5062 0.2002 0.2686 0.2991 0.2438 1.4431 3.7696 8.2901 2.3531 2.3681 2.4342 2.7696 2.7106 2.7357 2.6037 0.8997 1.3219 1.1992 1.3192 1.2667 0.9629 9.2594 6.4463 4.1268 10.5409 10.5503 5.6085 1.4114 1.3590 1.1763 0.9407 1.4013 1.4143 2.2523 1.7606 2.3700 2.4266 1.9546 2.2245 0.8904 1.0042 1.0648 0.9496 0.9286 0.9958 0.8558 0.8312 0.8148 0.7706 0.7954 0.8421 14.2532 7.9177 37.5084 37.8270 34.7133 0.2658 0.1950 0.1690 0.3112 0.2421 0.2498 6.4507 2.0779 4.3242 0.9790 2.8706 5.0240 11.8026 6.2950 6.4583 8.6104 6.9352 5alpha-pregnan-3beta,20alpha-diol monosulfate (2) 0.4239 0.5479 0.4088 0.2806 0.3191 0.4256 1.7017 2.2539 1.3421 0.8090 1.0379 1.2223 1.0762 0.8333 1.0572 1.0266 0.6683 0.2806 0.2806 0.2806 0.2806 0.2806 0.2806 0.2806 0.2806 0.2806 0.2806 0.2806 0.2806 0.2806 0.3313 0.2806 0.3211 0.5976 0.3223 7.7903 4.9428 5.9084 7.7344 6.6539 6.3327 1.3171 0.8134 0.8465 1.1125 1.3126 0.8303 0.2806 0.2806 0.9034 0.4416 0.3874 0.2806 1.3294 1.3490 1.0901 1.5814 1.2483 1.2649 1.7618 1.1904 1.2229 0.9947 1.6679 2.6987 1.0988 0.7743 0.9923 0.5541 0.2806 0.2806 0.3311 0.4436 0.2806 0.2806 1.3353 1.1368 1.2815 0.8741 1.0821 0.5033 0.7383 0.5702 0.2806 0.9909 0.4392 0.2806 0.2806 0.2806 0.2806 0.2806 0.2806 8.4181 11.2738 13.4079 9.8261 11.3579 0.9375 0.3642 0.2806 0.4915 0.3879 0.7336 0.2806 0.4851 0.5833 0.2806 0.2806 0.3087 0.6242 0.7982 0.6613 1.3363 0.6203 0.7526 0.2806 0.2806 0.2806 0.2806 0.9495 3.2851 8.1918 2.6826 2.0818 0.6216 0.7578 0.8892 0.6864 0.7278 0.2806 0.8007 0.5025 0.4651 0.6892 0.4920 9.0483 7.5545 5.8477 9.4444 7.7558 6.5648 0.7111 0.7476 0.5923 0.5870 0.5145 0.7033 1.0330 0.8146 1.1108 1.0000 0.6805 1.0767 0.7360 0.9990 1.0010 1.1442 0.8994 1.4201 0.2806 0.2806 0.2806 0.3652 0.2806 0.4136 11.6003 6.7833 47.1450 35.7525 28.1627 0.2806 0.3316 0.2806 0.2806 0.2806 0.2806 3.1993 1.6546 3.0179 0.6040 2.7117 6.3477 11.9036 7.6801 8.4300 10.3320 9.3243 5alpha-pregnan-3beta,20beta-diol monosulfate (1) 0.5834 0.6191 0.3679 0.3737 0.4965 0.4565 1.6793 2.5183 1.9384 1.1017 1.7467 1.7429 1.3928 1.1942 1.2537 1.1580 1.2746 0.3116 0.2861 0.4510 0.2861 0.2861 0.2861 0.2861 0.2861 0.2861 0.3716 0.2861 0.2861 0.2861 0.7138 0.5494 0.5651 1.0833 0.6344 10.2374 5.3287 6.4901 8.0809 7.4450 8.2162 0.7783 0.8115 0.7080 1.0293 1.1059 0.8165 0.3429 0.5439 0.6662 0.5790 0.3753 0.2861 1.8792 1.6221 1.9699 1.9717 1.9838 1.1559 1.1560 1.0923 1.1342 0.9902 0.9303 2.0892 0.8454 0.5188 0.6527 0.2861 0.6134 0.6022 0.5274 0.7268 0.5941 0.5514 1.1607 0.9887 0.9755 0.9437 0.7227 0.5661 0.5599 0.6988 0.3979 0.7494 0.4265 0.2861 0.2861 0.2861 0.2861 0.2861 0.2861 8.0198 11.4947 11.6274 10.1809 10.7248 0.6792 0.2861 0.2861 0.2861 0.2861 0.2861 0.6528 0.5842 0.5467 0.6205 0.5056 0.4339 0.6872 0.7088 0.8903 1.0113 0.2861 0.6524 0.2861 0.2861 0.2861 0.2861 1.0098 4.0981 9.5396 2.9420 2.3587 1.0151 1.0148 1.1938 1.2450 1.4078 0.5447 0.8001 0.7330 0.8002 0.9288 0.6737 7.7926 8.6141 5.4207 11.5962 10.4090 7.8755 1.0802 1.0811 0.8451 0.7527 1.0550 1.0965 1.2828 1.5178 1.2697 2.1845 1.1858 1.8473 0.7026 0.7398 0.8945 0.8988 0.8079 0.9652 0.7004 0.7918 0.6496 0.9038 0.7065 0.9628 6.5307 3.1809 19.3318 17.9223 15.5188 0.3802 0.2861 0.2861 0.3811 0.2861 0.2861 3.9661 1.6471 4.1396 0.8434 2.6333 8.9644 15.9131 10.2005 11.5413 12.1526 7.5138 5alpha-pregnan-diol disulfate 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 1.0000 0.8601 0.3515 0.6637 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 2.1046 0.7771 1.3750 2.6326 1.4907 1.7643 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3285 0.3218 0.3218 0.3218 0.4369 0.9649 0.6304 0.5474 0.3218 0.3218 0.3218 0.4854 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 3.1856 4.5596 4.5365 4.0026 5.6785 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 1.7166 4.3041 1.0000 0.7577 0.7453 0.6231 0.8708 0.8962 1.0002 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 3.5021 3.4858 1.3090 5.0565 4.3955 2.7251 0.8118 0.5844 0.4504 0.3345 0.5469 0.4530 0.5120 0.5978 0.6619 0.5527 0.5167 0.4695 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 1.4958 0.7010 7.3226 4.5163 4.5699 0.3218 0.3218 0.3218 0.3218 0.3218 0.3218 1.9074 0.9485 1.3707 0.3218 0.9851 2.0544 4.1897 2.9687 3.0992 3.4244 1.9435 5-dodecenoate (12:1n7) 1.6597 0.8950 0.2385 0.8988 0.8155 0.3824 1.4476 1.4125 0.3221 0.8969 0.6448 1.8851 1.1440 1.2492 1.3385 0.7754 2.0033 1.1215 0.3228 1.2207 0.5466 1.2027 1.2673 1.4121 1.2316 0.6648 0.5136 1.4221 2.1125 0.7799 0.4892 0.9338 1.0024 0.4942 0.8020 2.2995 1.1014 1.7331 1.4675 1.3511 1.3826 0.3554 0.3909 0.4398 0.4576 0.4191 0.8979 0.9213 0.3245 0.7816 1.0122 1.1501 0.9732 1.1226 1.3932 1.3414 1.5203 0.3115 0.3185 0.5095 0.7534 0.9704 0.5713 0.7259 0.5941 0.7130 0.6375 1.0529 0.6441 1.0000 1.5124 0.6986 1.8337 1.4748 1.1074 0.8206 0.8140 1.3697 1.7214 0.6587 1.5664 0.2432 0.6534 1.5716 1.8770 1.0371 0.6134 0.6633 0.5290 1.0467 0.7189 1.1844 1.2063 1.2714 1.1806 1.6338 1.2387 1.7414 0.9764 0.8300 1.7758 0.7570 1.5626 0.9741 0.7286 0.8631 1.0298 0.3300 0.4912 1.2411 0.7284 0.2825 0.6494 0.7284 1.0244 1.9077 1.6448 1.1231 1.6990 1.0195 0.8375 1.5380 1.1798 1.8760 1.2162 1.1528 0.3539 1.3073 0.9754 0.6714 0.9885 0.5140 0.3854 0.6848 0.9976 0.9257 0.6247 1.0735 1.2705 1.7242 1.6814 0.7700 1.2059 0.9779 0.4762 1.7958 1.2405 0.5372 0.9150 0.7061 2.1341 0.9557 1.0526 1.1347 1.1495 1.2643 0.8312 1.8442 1.6697 0.7344 2.0531 0.4850 1.2758 0.6554 0.7024 1.6287 1.6656 0.3309 1.6818 1.0482 1.5795 0.3728 2.0184 2.7759 1.5493 3.8992 0.6008 0.3064 0.5121 0.4352 0.6682 1.4550 1.7627 0.7593 1.6078 1.3033 0.8372 5-methyluridine (ribothymidine) 0.9869 0.8444 1.0051 1.0445 0.9861 0.9892 1.0260 1.0433 1.0000 0.9388 1.1837 1.2100 1.1350 0.9838 1.0724 1.1542 1.1414 0.9404 0.9993 1.0270 1.1255 1.1015 1.1300 0.8226 0.8409 0.8454 0.8689 0.9211 0.9328 0.9817 1.0136 1.0285 1.0073 0.9466 0.9518 0.7760 0.9370 0.8992 1.0336 0.9097 0.8650 1.1931 1.0341 1.1720 1.0716 1.0556 1.0116 1.0255 1.0019 1.1231 1.0842 0.9967 0.9016 1.1035 1.1614 1.1467 1.1103 1.0649 0.8712 0.9690 0.9497 0.9289 0.9709 1.0167 1.0566 1.0007 0.9786 0.9880 0.9715 1.1084 1.0638 1.0078 1.0643 1.2233 1.1481 1.3946 1.3914 1.2783 1.2280 1.2814 1.0044 0.8963 0.9563 0.9593 1.0932 0.9626 1.0403 1.0586 1.0784 0.9769 1.0439 1.0300 0.8259 0.7280 0.8349 0.8469 0.8283 0.9374 0.9001 0.9484 0.8787 0.9787 0.9337 1.2554 1.2808 1.2657 1.3271 1.2422 1.4189 0.8429 1.1234 0.9529 0.8294 0.8893 0.8046 1.1476 0.9863 1.1466 1.0531 1.0657 1.0864 1.0775 1.0292 1.1078 0.7197 0.7775 0.7210 0.8266 0.7994 1.3069 1.3859 1.2967 1.3732 1.3816 1.2961 0.7230 0.6554 0.7860 0.8785 0.7364 0.8062 1.1192 1.1890 1.1637 0.8782 1.2399 1.2248 0.8675 0.7495 0.9799 0.8582 0.8356 0.9286 0.9692 0.9887 1.0098 1.0285 0.9889 1.0696 1.1521 1.0444 1.1210 1.0651 1.0861 1.1644 0.9906 0.8541 0.9580 1.0154 1.0365 0.8209 0.8106 0.9706 0.9364 0.9337 1.0095 0.7743 0.7885 0.8110 0.7907 0.9015 0.9720 0.9385 0.8707 1.0206 0.9296 0.8136 5-oxoproline 1.4335 1.4697 0.9638 0.8735 0.6834 0.9651 1.2951 1.3675 1.3907 0.7737 0.8900 1.6139 1.4246 1.5232 1.4997 1.5625 1.6031 0.3910 0.5981 0.5326 0.6548 0.4309 0.7728 0.9845 0.8745 0.6842 0.8988 0.9195 1.2596 1.3685 3.7859 1.2673 0.5925 0.8190 0.7036 1.0000 1.0137 1.0596 0.9196 0.8318 0.9277 1.3645 1.3466 1.3650 1.3059 1.4504 1.2176 1.1703 0.9928 0.5468 0.5517 1.0574 0.5007 0.8688 0.5328 0.5270 0.8870 1.1779 0.8975 0.7828 1.0901 0.7434 0.9773 0.7142 1.0305 1.0961 1.0776 1.0433 1.0532 1.2024 0.7641 0.6781 1.2341 0.8016 1.3967 1.2523 1.2305 0.8518 1.0900 1.2239 0.6111 0.8470 0.6002 0.5745 1.3034 1.2634 1.1434 0.9979 1.0795 1.6277 1.1450 1.2340 1.0315 0.7188 0.7664 0.9934 0.8134 1.1267 1.1354 1.2564 1.1552 1.1361 1.2503 0.7291 0.9250 1.0903 0.7579 1.0358 1.2146 1.3774 1.3452 1.7359 0.7618 0.7643 0.8725 1.4975 0.5569 0.6731 0.6395 1.1032 1.1139 1.0614 0.8407 0.9978 0.7256 1.1597 1.0355 1.0231 0.7324 0.7242 1.0513 0.5300 0.7496 0.9575 0.6772 0.8706 1.0734 1.3504 0.9928 0.7565 1.2692 0.8616 0.9960 1.4064 1.0536 1.3628 0.9116 0.9810 0.8193 1.0029 1.3097 0.9222 1.5972 1.0007 1.0667 0.9277 0.9948 1.0036 1.0813 1.1070 1.1227 1.1189 1.1020 1.0865 1.2524 0.5730 0.5129 0.9993 1.0883 1.0548 0.5427 0.8346 0.9987 0.6622 0.6005 1.0208 0.4412 0.6481 0.4095 0.8777 0.4814 1.1332 1.1067 1.0894 1.2376 0.8069 0.7346 6-bromotryptophan 0.9526 0.9909 1.0398 0.4812 0.5366 0.8287 0.8996 0.8121 1.0334 0.6247 0.7444 1.2870 1.2602 1.1101 1.1794 1.1168 1.2870 0.5464 1.1916 0.7640 1.1474 0.7322 1.1792 1.3872 1.1750 1.2884 1.7020 1.1286 1.4999 1.3793 1.4659 1.5217 0.8989 1.0902 0.9366 1.1262 1.3818 1.2383 1.1813 1.0527 1.0254 1.8883 1.7716 1.8856 1.9441 1.8634 1.8567 1.0863 1.2514 0.7432 0.6094 1.0539 0.5555 0.9724 0.4317 0.5412 0.9624 0.9545 1.2729 1.0812 1.2668 0.8715 1.2471 0.8409 0.5712 0.5401 0.3671 0.4839 0.5149 1.0020 0.6385 0.7606 0.9467 0.8001 1.1571 1.2559 1.2096 1.0000 1.0368 1.0656 0.9285 1.5069 1.1667 0.7550 1.5646 1.4596 0.4207 0.4074 0.4610 0.4254 0.4407 0.5034 1.5894 1.0953 1.3280 1.4673 1.6412 1.0179 1.0085 0.9844 0.9915 1.0935 1.0762 0.7038 0.8977 1.2195 0.6012 1.2454 1.2034 0.9761 0.9556 1.1923 0.7896 0.5718 0.6995 1.2605 0.7080 1.0047 0.7166 0.7921 0.9696 0.7201 0.8853 0.8073 0.5844 0.9297 1.0230 0.9495 0.7230 0.5009 0.8271 0.6166 0.9185 0.8106 0.5481 0.5985 0.8257 0.8426 0.5705 0.4175 0.7819 0.7077 0.8229 1.0395 1.0798 1.0641 0.6904 0.8569 0.7109 1.1471 0.9319 0.7531 0.9687 1.0868 1.1796 1.0958 1.1658 1.0829 1.1933 1.6231 1.3019 1.5141 1.4035 1.4541 1.4853 0.6891 0.6107 1.6180 1.5398 1.3427 0.8944 1.5367 1.3365 1.0642 1.1359 1.5422 0.3861 0.8669 0.4752 0.7819 0.4754 1.1956 0.8439 1.2314 1.3968 0.9094 0.9444 6-hydroxyindole sulfate 0.8372 1.0036 0.8763 0.7242 0.6720 1.0000 1.6910 1.6950 1.7563 1.0832 2.5431 1.6505 1.6630 2.0154 2.0001 2.2298 1.5745 0.1179 0.5010 0.5691 0.3727 0.4276 0.5487 1.1576 0.8865 1.3085 1.0407 0.8648 0.7682 1.3956 0.9544 1.1078 0.7829 1.2070 0.8736 0.8581 0.9058 0.9712 0.5045 1.4269 0.6404 0.9172 1.3441 1.3250 1.2688 1.2241 0.8642 2.6970 1.9974 1.9040 1.3529 2.3103 0.7498 1.6241 0.7489 1.2151 2.3390 1.7561 1.1069 1.7008 1.4724 1.0464 1.3114 0.9545 0.7551 0.7228 0.5624 0.5236 0.7498 0.3220 0.5604 1.0253 0.4677 0.7382 0.6554 0.7793 1.0476 0.8484 0.9146 0.8373 0.2553 0.5088 1.0849 0.5357 0.7588 0.4511 0.8178 1.2052 2.3459 1.1705 1.3912 1.5442 0.7421 0.6672 1.4145 1.3381 0.9593 2.2089 1.8374 1.7130 2.0518 3.1560 1.9726 0.9028 1.0705 1.1351 0.7854 1.1720 0.9962 1.7909 1.8402 1.5452 2.5137 0.7861 1.0420 0.6108 0.6252 1.1908 0.5028 0.8795 1.8801 1.1310 0.6129 0.9473 0.3435 0.5997 0.4445 0.8033 0.7468 0.6248 0.6938 0.6897 0.7378 0.7017 0.6561 1.1685 1.0608 0.9599 0.9343 0.7472 1.0795 0.9302 1.5981 1.1118 1.8521 2.6064 1.2502 1.0416 0.8007 1.0129 1.1105 0.7426 1.0707 0.4268 1.4590 1.0675 1.8169 0.7517 1.3629 0.4961 1.2111 1.5061 1.2268 1.1940 1.2301 0.7075 0.5705 1.1219 1.4939 1.2794 0.5372 1.5282 1.5950 0.8604 2.0041 1.4981 0.2970 0.3340 0.2500 0.2591 0.3764 0.7267 0.4725 0.8183 1.0706 0.4989 0.5045 6-oxopiperidine-2-carboxylate 0.8481 0.8465 1.0456 0.8740 0.8292 1.2681 2.0032 1.4106 2.2312 0.9960 1.5724 0.9613 1.0593 1.0075 1.1129 0.9589 1.0744 0.6813 1.0283 1.0096 1.4767 0.8265 1.1518 1.1323 1.0265 1.0526 0.7933 0.8164 1.0644 0.9239 2.0529 1.0020 0.7957 0.8315 0.6773 1.0486 1.3574 1.2130 0.9772 0.9900 0.8331 0.9983 1.0650 0.7513 0.9604 0.9466 0.9136 1.9139 1.7895 1.4226 1.3263 1.3711 0.9253 1.0568 0.5566 1.0067 0.7144 1.3756 0.9135 0.7380 1.0246 0.9715 1.1573 0.7330 1.1258 1.0072 0.8414 1.1453 0.8228 1.0017 0.7891 0.7082 0.9497 1.1878 0.8890 1.4961 1.9267 2.0727 2.0721 2.2368 0.7722 1.3975 0.9272 1.0274 1.2637 1.1955 0.9473 0.8583 0.9462 1.0636 0.9149 1.0321 1.1249 1.1992 0.6227 1.0762 0.6468 1.1337 0.8237 0.9472 1.0751 0.8140 1.1570 1.2274 1.4733 1.3399 1.2527 1.8800 1.4405 0.9421 1.1897 1.2155 0.3382 0.6325 0.8670 0.9417 0.7596 0.9935 0.5593 0.9980 0.9891 0.8005 1.1412 0.9081 0.3382 1.0504 0.7983 0.7831 0.3382 1.0135 1.8612 1.1465 2.0011 1.9731 1.3360 0.6881 0.4979 0.6591 0.4889 0.4926 0.7235 0.9515 0.8093 0.9093 0.8141 1.1909 0.6303 1.0280 0.4784 0.5860 0.4701 0.8660 1.0735 0.9220 1.1539 0.8633 0.7816 0.9670 1.1522 0.9974 0.8795 0.9557 1.0212 1.2128 0.7333 0.5806 0.5425 1.8115 1.6197 1.2594 1.1609 2.1273 2.8508 1.6715 1.2784 1.9517 1.0229 1.6008 0.6650 1.4325 0.6588 0.8751 0.7665 0.8051 1.0195 0.6768 0.3382 7-HOCA 1.3573 1.0387 1.0451 1.0248 0.7154 0.9025 1.0040 1.0096 1.1410 0.7018 0.8020 1.1540 0.8339 1.0588 0.9757 0.7671 1.1471 0.7020 0.7430 0.7493 0.7744 0.8935 0.9097 1.1019 0.9303 0.7559 0.9943 0.9695 1.3630 2.5315 1.6306 2.5365 1.1789 1.3019 1.4333 1.3308 1.0578 1.2465 1.0821 0.9141 1.0557 0.7649 0.6883 0.7163 0.7031 0.6733 1.1285 0.7843 0.8162 0.5965 0.8404 0.7665 0.6376 0.6960 0.5576 0.4793 0.9388 0.7590 1.0313 1.0582 1.1033 0.9620 1.2442 1.0199 0.9113 1.0046 0.8112 0.9954 0.7707 0.8404 0.6472 0.5482 0.8581 0.9136 1.0985 1.7415 1.4202 1.3266 1.2344 1.2879 0.8091 0.8608 0.6773 0.7023 1.1926 0.8652 1.5532 1.0452 1.4676 2.2449 2.0983 1.8536 1.8372 1.2830 1.5246 1.7531 2.0851 2.0813 1.1602 1.3361 1.3773 1.1708 1.3978 1.0839 1.2112 1.1936 1.3333 1.1148 1.3127 1.0000 0.8221 0.9012 0.6581 0.5787 0.7225 0.9717 0.7293 0.8235 0.7855 0.5548 0.6723 0.6838 0.7424 0.6981 0.7865 0.9540 1.0479 0.7633 0.7901 0.8819 0.9003 0.8494 1.1505 0.8248 0.7956 1.1724 1.2691 1.4666 1.2051 1.0117 1.5144 0.9559 1.2510 1.3539 1.1347 1.5466 1.0883 1.2362 1.2905 1.6398 1.8590 1.1625 1.9805 1.2360 1.3869 1.2535 1.1357 1.6589 1.2996 0.8728 1.0328 0.7062 0.8599 0.6913 0.8325 0.6909 0.7610 0.8271 1.3724 1.0625 1.4014 0.9354 1.6093 1.2571 1.1849 1.6935 0.4811 0.5657 0.5741 0.5400 0.5442 0.7183 0.7313 0.6822 0.8611 0.6856 0.6079 9,10-DiHOME 0.5486 1.0242 0.4486 0.6342 0.4486 1.0764 1.0553 1.0194 0.4486 0.7594 0.6721 0.7004 1.1677 1.1115 0.6765 1.3376 0.8176 0.8502 0.9129 2.1349 0.4486 1.1132 1.2059 0.4486 0.8280 1.4305 0.4486 0.4486 1.1259 0.4486 0.4486 0.8461 0.4486 2.2391 0.4486 1.1616 0.6022 1.0789 0.4486 1.7701 0.6146 1.1461 0.4486 0.4486 0.7744 1.9171 0.4486 0.9053 0.4486 1.1466 1.0384 0.8152 1.7277 0.4486 0.4486 0.4486 0.8163 0.4486 0.4486 1.0622 0.7674 1.1394 0.9042 0.4486 0.4486 1.0495 0.7106 0.4486 0.4650 0.6123 0.9139 0.5120 0.7609 0.9181 0.4486 0.8313 0.7375 1.4846 1.3171 0.4486 0.8844 0.4486 1.3764 0.7277 1.3359 0.7629 0.4486 0.4486 0.9346 0.4486 0.4486 0.4599 0.4486 1.4069 1.2961 0.7641 1.0470 0.9994 0.9877 0.5624 1.1466 1.1548 0.7622 1.3351 1.1955 0.9139 1.3923 0.4486 0.7771 0.6667 0.4486 0.4486 1.2843 0.4486 1.1206 1.2590 1.2260 1.1605 0.9128 1.1150 0.4486 1.0044 0.9935 1.9545 0.4486 1.1322 0.4486 0.4486 0.4486 0.7104 0.8448 1.9628 1.0006 0.6514 0.6044 1.2824 0.4486 0.8339 1.3013 0.9421 0.4486 0.7871 2.0737 1.0977 0.4486 0.6994 0.9903 2.1872 0.9955 0.4486 1.4737 0.5327 1.0810 0.4486 0.5856 0.4535 1.9042 0.6096 1.5117 0.4486 1.7818 1.5703 0.4486 0.9025 1.4642 0.4486 0.4486 0.4486 0.4486 0.4486 1.0292 0.4486 0.8650 0.4486 0.8004 1.0864 0.5818 0.4486 0.4486 0.7677 1.0537 1.1261 0.9783 0.7217 1.2931 1.0000 1.1024 9-hydroxystearate 1.1783 0.8454 0.1939 0.8481 1.0101 0.5970 1.1135 2.3087 0.1939 0.9446 0.8042 0.5227 0.5929 0.6561 0.2913 0.4589 0.6474 1.4760 0.1939 1.9864 0.6365 2.1594 1.9091 1.1509 1.3023 0.9882 0.1939 1.8736 2.0256 0.8700 0.1939 0.8432 0.6127 0.9580 0.9661 2.0424 1.1613 1.4797 1.1236 1.3436 1.2185 0.1939 0.4898 0.5778 0.4330 0.6307 0.5710 0.7203 0.1939 0.7031 0.8752 1.3317 0.7918 1.1481 0.9581 0.9659 1.6399 0.3893 0.1939 0.8012 0.1939 0.7879 0.8123 0.4601 0.8366 0.8520 0.9225 1.1183 0.9083 0.9944 1.3896 0.5876 1.3419 0.9384 1.1352 1.0710 1.1066 1.7336 1.5833 1.0241 1.3026 0.2479 0.8539 1.1888 1.8342 1.2350 0.6484 0.6211 0.4679 1.1041 0.8661 0.8085 1.9796 2.0257 1.9703 2.0465 1.1909 2.8458 0.9368 1.0118 1.6048 0.9471 1.9849 1.0374 0.6796 0.1939 1.0997 0.2424 0.3616 1.5038 0.8635 0.5943 1.4957 0.9424 2.1139 2.4293 1.1834 1.0056 1.1192 1.5063 1.5403 1.9551 1.5019 1.4064 0.9277 1.3628 0.3862 1.1394 1.2208 0.7896 0.6943 0.1939 0.8646 0.5384 0.6238 0.9722 0.3373 0.9512 1.1349 1.0429 1.0889 0.7061 0.9597 0.7848 0.4664 0.9555 1.1032 0.6021 0.9029 0.5329 2.2155 0.5385 0.7100 0.9529 0.9795 1.4816 1.0577 1.5114 2.1149 0.5897 1.1580 0.6644 1.5813 0.1939 1.2306 1.2364 0.6871 0.1939 1.2233 0.9670 1.3159 0.1939 1.6330 2.2152 1.8662 4.0171 0.4299 0.1939 0.3299 0.5171 0.1939 1.7735 1.6498 1.0915 1.9740 1.8017 1.9369 acesulfame 0.7294 0.7845 0.7294 0.7294 0.7294 0.7294 0.7294 1.2155 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.8715 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 1.4768 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 1.5888 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7410 0.7294 0.7294 0.7294 0.7294 1.1285 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 0.7294 acisoga 0.8638 1.0226 0.9721 0.5158 0.5195 0.5158 0.5158 0.5158 1.0041 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 0.5732 0.6540 0.8805 0.8907 0.7972 0.5158 0.5158 0.5158 0.8184 1.0463 1.2584 1.2425 1.2765 1.2431 1.7343 1.5309 1.5114 1.1990 1.0731 0.8082 0.5158 0.5158 0.5158 0.5158 0.5158 0.5158 1.6631 0.5158 0.9135 1.4945 0.9912 0.6882 0.7694 1.0034 0.5158 1.1417 0.5158 0.9335 0.7318 0.9367 0.6193 0.8130 1.3191 0.5158 0.5361 0.7687 1.5318 1.7401 1.1313 0.8897 1.0702 0.9144 0.9541 0.5158 0.9959 0.5158 0.5158 0.8462 1.3996 1.7585 1.7777 1.9550 2.6678 1.8559 1.6736 1.8122 0.7869 0.6647 1.2073 1.0098 0.9290 0.7753 0.5158 0.5158 0.9091 0.9445 0.5359 0.5158 1.0410 0.8101 0.5158 0.9934 0.9165 1.2660 0.9243 0.5158 0.5158 0.6803 0.5158 0.5158 0.5158 0.8085 1.7884 1.2763 1.1700 0.9166 1.0008 0.5158 1.1611 0.6141 0.8020 0.5158 0.9001 1.1831 0.5158 0.7652 1.1853 0.8666 0.5158 0.5158 0.9257 0.5158 0.5158 1.2812 0.5158 0.5158 0.5158 0.6626 0.5158 0.5158 0.7653 0.6537 1.2433 1.4872 0.8185 1.4963 0.7815 0.5158 0.9992 0.5158 0.7739 0.5158 1.5272 1.1832 1.2969 1.1136 1.5970 1.5563 0.5158 0.5158 1.1397 1.4015 1.1147 0.5158 1.9252 2.1828 1.0943 0.9341 1.2234 0.5158 0.5158 0.5158 0.5846 0.5158 0.5158 0.5158 0.5719 0.5158 0.5158 0.5158 aconitate [cis or trans] 1.2341 1.1257 0.6599 1.4584 1.2425 0.9133 1.2995 1.2954 1.0444 1.0329 0.9992 1.1997 1.0125 1.1367 1.0504 0.8674 1.1686 0.8796 0.5593 1.0919 0.4638 1.0345 0.7590 0.6385 0.7523 0.5740 0.5330 0.9383 0.7461 0.9486 1.0145 0.9671 0.9274 0.8253 0.8397 1.1849 1.0347 1.1933 0.9056 0.4451 1.0439 0.7864 0.7828 0.8092 0.7973 0.8833 0.7928 0.7993 0.9786 0.8653 1.3417 0.9962 1.0583 0.9223 1.1867 1.0746 1.0408 0.7667 0.5659 0.8268 0.9159 0.7494 0.8332 0.7537 1.0395 1.4246 1.2671 1.1212 1.1462 1.1473 1.5305 1.2682 1.3362 1.5192 1.3487 1.1411 1.0098 0.6338 0.9907 1.0813 1.4856 0.7318 1.0765 1.1795 1.1201 1.1151 1.1286 1.0792 1.1527 1.3292 1.2901 1.3071 1.0693 0.9985 1.0644 1.0815 1.0143 1.1752 1.1078 1.1586 1.1231 1.3414 1.1070 1.2653 1.4311 0.8766 1.3386 0.7422 0.9270 0.8582 0.9969 0.7292 0.9889 0.7209 0.9477 0.9462 0.9619 0.8794 0.9509 1.2382 1.0378 1.0107 0.7157 1.1186 0.6606 0.8646 0.5940 0.7269 0.8611 0.9149 0.8765 0.8696 0.5673 0.7732 1.0610 0.8618 0.8883 0.9822 1.1065 0.8285 1.0249 0.8472 0.8626 0.8670 0.6347 1.0272 0.9346 1.1392 1.2200 1.0907 1.6211 1.1915 1.5801 0.9196 1.0015 1.0065 0.9485 0.9727 0.9651 1.0844 1.1384 1.0640 0.9202 1.0651 1.1204 1.1672 0.9512 0.7379 1.0687 1.0831 0.9588 0.7739 1.2101 1.1942 0.8921 1.1538 0.8077 0.6585 0.7800 0.8843 1.0132 0.8709 1.3459 0.7876 1.0000 1.2296 0.9964 adrenate (22:4n6) 1.9642 1.1086 0.3213 0.9537 0.9270 0.4103 1.3281 1.1456 0.4854 0.8734 0.6995 2.5961 2.1772 0.7131 1.1540 1.3605 1.4693 0.8866 0.4182 2.7131 0.4924 3.0978 0.9920 0.9548 0.6715 0.7517 1.1633 3.3471 1.8401 0.7530 1.7070 0.9907 1.7087 1.9102 0.6376 5.4341 3.0554 2.1238 1.3198 1.9424 1.2551 1.0469 0.9139 0.7098 0.9080 1.2980 1.5436 0.6328 0.6035 2.1560 2.9203 2.6720 2.0937 0.8185 1.0818 1.1982 0.9067 0.5495 0.2899 0.4889 0.7983 0.7972 0.6354 0.7918 1.0537 0.8579 1.0657 2.8302 1.0009 0.8361 1.5977 0.5958 2.6468 1.1213 0.7795 0.7279 0.7083 1.1607 0.8666 0.7680 0.9247 0.3017 0.7043 0.9776 2.0643 0.6877 0.7380 0.5947 0.7376 1.3519 0.8867 1.2573 0.9058 0.8493 0.8037 0.7715 0.8514 2.9814 1.0720 1.2312 1.5453 0.7838 1.9940 0.7253 0.6384 0.7342 1.6994 0.3331 0.7512 1.3472 0.6988 0.7513 1.5946 0.8899 1.6623 3.6478 2.2407 1.1300 1.5911 1.1606 1.1622 1.3168 2.0549 0.9991 0.7535 0.8216 0.5906 1.1467 1.6002 1.4725 2.0440 1.9999 0.8029 1.4049 2.2803 0.7537 0.5029 0.9645 2.1143 1.2652 1.0083 1.2153 2.4755 0.7694 0.4941 0.8693 0.8198 0.7108 0.8539 0.7580 4.2265 0.8655 0.7735 0.9293 0.8563 1.0587 0.7431 1.3228 2.8497 1.0448 1.9241 0.5803 1.9346 0.8635 2.7750 1.1266 0.9110 2.6253 3.1338 0.7269 0.6686 0.5279 1.1631 1.0989 1.1645 2.8503 1.1471 0.4206 1.3168 1.3041 1.0122 0.5899 1.0000 0.8129 1.1967 1.1580 0.5989 alpha-hydroxycaproate 2.0060 0.9849 0.3358 1.7883 1.1330 0.8378 0.8500 0.3358 0.8338 1.0490 0.3358 0.5800 0.3358 1.0204 0.5796 0.3358 0.3358 0.3358 1.4755 0.8535 1.1707 0.3358 1.0513 0.8778 1.6975 0.3358 0.3358 0.3358 0.3358 0.7857 0.7262 0.6446 0.3358 0.3358 0.4549 0.3358 0.7917 0.6069 0.3358 1.4090 0.6193 0.6059 0.4562 0.6590 0.4553 0.3358 0.9113 0.7492 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.6127 0.3358 0.8510 0.3358 1.3290 0.9691 0.3358 0.3358 0.3358 0.3358 0.3358 0.6085 1.1453 0.3358 0.3358 1.3922 0.3358 0.6684 0.3358 0.3358 1.5471 0.6889 0.3358 0.3358 1.0759 0.6660 0.9069 0.3358 1.2887 1.0000 0.3358 1.9177 1.1446 0.3358 0.3358 0.3358 0.3358 1.7419 0.3358 0.3358 1.0151 2.9531 0.3358 1.0384 1.2676 0.6700 0.3358 0.3358 0.3358 0.3358 0.3358 1.8678 1.2182 1.2683 1.6094 0.3358 0.3358 0.7332 0.3358 0.3358 0.3358 1.0265 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 0.3358 1.5265 1.0441 0.7537 0.3358 0.3358 0.8195 0.3358 0.9121 1.4330 0.3358 0.3358 1.4021 0.3358 0.3358 0.3358 0.3358 0.3358 0.7721 0.3358 0.3358 0.3358 0.4554 0.3358 0.3358 0.3358 1.0447 1.1789 0.3358 0.3358 0.3358 0.3358 1.3370 0.3358 0.5429 1.3187 0.3358 0.3358 1.2077 0.3358 0.6569 0.3358 0.3358 0.3358 0.3358 1.2590 0.3358 1.0672 0.3358 0.3358 alpha-hydroxyisocaproate 1.1750 0.9426 0.4775 1.4007 1.1751 0.9370 1.2245 0.9556 0.7254 0.9753 0.9936 1.4447 1.8505 1.9012 1.7759 1.6171 2.1011 1.3980 0.8883 2.0430 1.2742 1.7358 1.5547 0.5494 0.9454 0.6218 0.5265 1.0059 0.6501 1.4238 1.0510 1.2146 1.1530 0.9607 1.3851 1.0673 1.0000 1.0435 1.0549 1.0719 0.9702 1.0601 0.8559 1.0465 1.0221 1.0929 0.9886 0.6007 0.3021 0.7475 0.8083 0.6026 0.5578 0.7372 0.8584 0.8336 0.6844 0.6369 1.0235 1.9519 1.9306 2.0554 1.7615 2.0012 1.0137 1.0397 0.8302 0.7893 0.8545 0.5558 0.8783 0.5360 0.4580 0.7481 0.6128 1.2260 1.2748 1.1729 0.9429 1.2902 0.9636 0.4489 0.7656 0.7330 0.7626 0.6159 1.3781 1.6498 1.9036 1.7436 1.5990 1.6955 1.1167 1.1988 0.9193 1.2829 0.9509 0.8358 0.7710 0.8877 0.8531 1.2513 0.9264 1.6914 2.1860 1.4615 1.9360 1.2795 1.8894 0.7735 0.8835 0.5701 0.8003 0.7405 0.8968 0.8934 1.3269 1.0979 1.2828 0.4761 0.5965 0.3490 0.4656 0.5181 1.1375 0.8330 0.6169 1.0307 1.1200 1.8560 1.1778 1.4337 1.0621 1.2863 1.6929 0.9449 0.6674 1.0420 1.6582 1.0810 1.0300 1.3823 1.5209 1.2080 0.8647 1.6425 1.7632 1.0128 1.0585 0.8100 0.9915 1.2768 1.0513 1.0013 0.9800 1.2150 0.9799 1.1822 1.2487 0.7831 0.6041 0.8741 0.8389 0.9987 0.9285 0.9776 0.9516 0.3742 0.6953 0.9812 1.0844 0.6014 1.2198 1.1949 0.8676 1.3639 0.7074 0.5264 0.6543 0.6830 0.9514 0.7326 1.6843 0.4531 0.8543 1.2491 1.1236 andro steroid monosulfate C19H28O6S (1)* 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 1.1697 1.0785 0.7349 1.0695 1.1498 1.2388 0.3991 0.3991 0.3991 0.8575 0.3991 1.0231 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.6499 0.3991 0.3991 0.3991 1.0618 0.7231 0.8195 0.7963 0.8227 0.8183 0.9623 1.1135 0.9556 0.9995 0.9539 1.0942 0.3991 0.5540 0.3991 0.3991 0.3991 0.4285 1.1497 0.7163 0.3991 1.3110 0.6585 1.8024 0.6625 2.1676 1.4538 1.8939 1.2097 1.6208 1.8347 1.3709 1.6268 1.3671 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.8810 0.7115 1.0113 0.8808 0.6381 0.8593 1.5940 1.0877 0.9747 1.3299 1.4132 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.6941 1.0434 0.3991 0.5625 0.7476 0.3991 0.3991 0.6718 0.8433 0.6265 0.3991 0.6822 0.3991 0.3991 0.5314 0.3991 0.6352 1.0190 1.2298 0.6474 0.6337 1.1458 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.5746 0.3991 0.8563 1.0673 0.3991 0.7940 0.8577 1.0000 1.0957 0.8982 1.0465 1.1894 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.3991 0.5065 2.6131 4.2507 3.0196 2.7295 2.4016 1.0005 1.5677 0.9237 1.0525 0.6493 1.6195 androstenediol (3alpha, 17alpha) monosulfate (2) 0.9054 1.1288 0.5966 0.6182 0.4828 0.9534 0.3653 0.3653 0.8358 0.3653 0.3653 0.9657 1.2899 0.9852 1.3342 1.3422 1.2707 0.6358 0.9584 0.6589 0.9934 0.8515 1.0000 0.3653 0.3653 0.3653 0.3653 0.3653 0.3653 1.1683 1.9131 1.2678 0.9241 1.3075 1.1161 0.7952 1.1578 1.1770 1.4311 0.5319 0.9486 2.3243 2.2275 1.6207 2.1705 1.6360 1.7583 0.3771 1.0856 0.6322 0.3653 0.3653 0.3653 2.5808 1.2078 1.3779 2.1179 3.9418 1.4595 1.5585 2.4522 1.5082 2.3201 2.0282 1.1519 0.9189 1.4751 0.7197 0.9765 0.5728 0.6608 0.4947 0.6053 0.7500 0.6892 1.2231 0.9365 0.4768 0.9690 0.8907 1.1540 1.0578 1.1040 0.7219 1.4395 1.2275 0.7815 0.4271 0.6415 0.4628 0.6428 0.7383 1.4175 1.1535 0.7615 0.8066 0.5701 1.0571 0.8814 1.1269 0.7214 0.9881 0.8770 0.6253 0.7988 1.0706 0.8798 0.6389 1.0249 0.9127 1.0000 0.7580 0.7210 0.3653 0.4506 0.3653 0.3653 0.3653 0.3653 1.1034 0.9090 1.0633 0.7721 1.0626 0.9568 0.8992 1.1704 1.6275 1.1898 1.4131 2.4577 1.6389 1.2252 1.9572 1.5264 0.9070 0.7538 1.2630 0.8815 0.6887 1.4286 0.9049 0.9348 1.1325 0.7826 1.4329 0.8691 1.3430 0.8877 1.5342 1.8749 1.0627 2.0510 0.7988 1.1622 1.3664 0.9289 0.7905 1.0995 0.4318 0.3872 0.3653 0.4803 0.5271 0.4548 0.3653 0.3653 0.9394 0.3653 0.4547 0.9671 1.0395 0.9169 0.9502 0.9844 1.2584 1.2916 1.8484 1.0546 1.8292 1.2964 2.4106 1.9446 1.9930 2.4369 1.6656 1.2876 androstenediol (3alpha, 17alpha) monosulfate (3) 0.8356 0.6915 0.6621 0.6796 0.6780 0.7147 0.3705 0.3178 0.3814 0.3389 0.3671 1.5075 1.5576 1.1903 1.2839 1.4100 1.3696 1.4921 1.6166 1.9286 1.4450 2.0069 1.6705 0.5323 0.5231 0.6332 0.7130 0.8438 0.5720 2.0078 2.6382 2.3187 2.1925 2.7886 2.0896 1.2717 1.2426 1.2040 0.9692 1.1144 0.9637 1.4335 1.3185 1.3229 1.3486 1.3649 1.3332 0.4141 0.5648 0.5959 0.5474 0.5019 0.4797 1.5736 1.6308 1.5765 1.6796 1.8114 2.2449 2.4544 2.2890 2.2253 2.2790 2.2324 0.9791 0.7196 0.8322 0.8724 0.6958 0.8207 0.8150 0.6346 0.8931 0.8683 0.8060 0.5052 0.6370 0.4856 0.4853 0.5704 1.0725 0.9667 1.1602 1.0037 1.2714 1.0000 0.6258 0.5891 0.7789 0.6871 0.6576 0.6880 0.9795 0.7775 0.7456 0.8238 1.0161 0.7827 0.5446 0.5744 0.5902 0.6137 0.7007 0.9094 1.0186 0.9347 1.1318 0.8974 1.0443 1.1859 1.1742 1.5652 1.4025 0.8649 1.1125 0.3068 0.3188 0.3158 0.2383 0.5428 0.5634 0.6153 0.6734 0.5742 1.0663 1.2322 1.6662 1.6037 1.4554 1.1999 1.7449 1.5460 1.5653 1.5608 1.2956 0.5273 0.5865 0.5799 0.6425 0.4346 0.6659 1.6317 1.5575 1.3806 1.2684 1.4581 1.3020 2.4385 2.1742 2.9424 3.2709 2.1557 2.3866 1.6461 1.5990 1.7060 1.6253 1.6978 2.1417 0.5751 0.5766 0.5376 0.5772 0.5466 0.6736 0.7395 0.7051 1.3398 0.9839 0.7348 0.4101 0.4803 0.4077 0.5604 0.5600 0.5691 1.0911 1.0766 1.3877 1.0572 1.1370 1.9209 1.6820 2.0612 2.3011 1.5117 1.2933 androstenediol (3beta,17beta) disulfate (1) 0.5160 0.5278 0.5036 0.3937 0.3880 0.4615 0.6164 0.5588 0.6440 0.5327 0.5922 1.0135 0.9151 0.8113 0.8779 0.8743 0.9681 0.7143 1.0920 1.0064 1.1929 0.9036 1.2101 0.3549 0.3193 0.3335 0.3670 0.3541 0.3493 2.9793 2.7098 3.0197 2.0219 2.4625 2.2469 3.2926 3.3304 3.1650 3.1223 3.0831 2.8497 1.4417 1.6025 1.5155 1.5617 1.5486 1.5536 0.7420 0.7581 0.6409 0.6568 0.6549 0.5913 1.2326 0.8711 0.9700 1.3359 1.2379 3.0585 2.5698 2.9619 2.3735 2.9906 2.1232 0.5443 0.5436 0.5141 0.5284 0.4517 1.0000 1.0568 0.9426 1.0636 1.1520 1.0367 0.3756 0.3679 0.3376 0.3662 0.3680 1.0376 1.1308 1.0205 0.8927 1.3364 1.2862 1.4938 1.5238 1.7287 1.7068 1.8350 1.7861 2.4999 1.4633 1.9116 2.2125 2.4107 0.5425 0.4854 0.4939 0.5395 0.5646 0.5436 0.2864 0.3119 0.3807 0.2616 0.3554 0.4128 1.4755 1.8394 1.7728 1.1933 0.8708 1.0970 0.2024 0.2019 0.2039 0.1767 0.7400 0.7878 0.7784 0.7428 0.7668 1.1001 1.5885 1.4649 1.6451 1.2742 1.4294 2.1807 1.5733 2.0232 1.9206 1.4182 0.7315 0.9719 1.0338 0.7660 0.6119 0.9496 1.0641 1.1694 1.3308 1.2381 1.4180 1.0648 1.2413 1.0009 1.5206 1.5011 1.0191 1.4553 0.5610 0.5772 0.5616 0.5416 0.5692 0.6184 0.9220 1.0104 0.9236 0.9936 0.8269 0.9790 0.5638 0.5521 0.7494 0.7979 0.7491 0.3237 0.3788 0.3623 0.3679 0.3723 0.4093 2.9473 3.7713 3.1166 3.6343 3.1722 1.7638 1.3518 1.5411 1.8163 1.2479 1.2926 androstenediol (3beta,17beta) disulfate (2) 0.7918 0.7570 0.7056 0.5631 0.5317 0.6403 0.3364 0.3280 0.4188 0.2970 0.3348 1.4175 1.2284 1.0331 1.1670 1.1567 1.2986 0.8997 1.1850 1.0343 1.0850 1.0611 1.2321 0.4429 0.4098 0.3573 0.4539 0.4991 0.4670 1.6590 1.7233 1.7192 1.0981 1.4597 1.2691 1.7661 1.6794 1.7099 1.7706 1.5817 1.4781 2.1005 1.9181 1.8837 1.9652 1.9192 1.9291 0.4772 0.5980 0.5460 0.3692 0.4500 0.3952 2.2676 1.3833 1.3686 2.2122 2.1413 2.4490 1.9948 2.4564 1.9384 2.3787 1.7860 0.8609 0.9536 0.9231 0.9996 0.8807 1.2042 1.0261 0.9660 1.0914 1.1081 1.1307 1.0932 1.0310 0.8356 0.9614 1.0000 0.8754 0.9315 0.8079 0.8105 1.0571 0.9328 1.0370 0.8668 0.9474 0.9225 0.8889 0.9149 1.3645 1.0782 0.9974 1.2271 1.2558 0.7726 0.7323 0.7689 0.7800 0.7940 0.8291 0.5212 0.6321 0.6759 0.5474 0.5984 0.6805 0.7272 1.2000 0.9981 0.6354 0.4596 0.5553 0.2640 0.2892 0.2892 0.2718 0.7635 0.9383 0.9395 0.9547 1.0208 0.9533 1.1674 1.1538 1.5042 1.1722 1.5300 2.0646 1.6813 1.8568 1.9457 1.7571 0.6888 0.8931 1.0431 0.7951 0.6431 0.9213 1.2584 1.1257 1.2844 1.0912 1.5529 1.0986 1.3952 1.0862 1.8898 1.8334 1.1759 1.6571 0.9281 0.9548 0.9595 0.9205 0.9052 1.0762 0.9237 1.0020 0.8946 1.0004 0.8287 1.0398 0.4678 0.4201 0.9273 0.7695 0.7696 0.5970 0.7613 0.6341 0.6585 0.6636 0.7855 1.9687 2.7744 2.2149 2.6609 2.3322 2.2484 2.4153 2.1941 2.4120 1.7168 1.5798 androstenediol (3beta,17beta) monosulfate (1) 1.1267 1.0483 0.9664 0.6576 0.6610 0.7788 0.4951 0.5565 0.6709 0.4420 0.4745 2.2279 1.8384 1.6465 1.6619 1.6456 1.9630 0.6656 1.2768 1.2828 1.2802 0.9535 1.4966 0.2428 0.2099 0.2347 0.2472 0.2942 0.2076 1.5218 1.4835 1.4781 0.8655 1.5468 1.0689 2.8260 2.4778 2.4233 2.1203 2.0759 1.8370 1.8322 2.3286 1.6586 2.2012 1.7735 2.2932 0.5776 0.7528 0.7915 0.6286 0.6053 0.5585 1.5913 1.1734 1.3292 1.6614 1.6408 2.3602 1.6841 2.1522 1.5676 2.0874 1.4731 0.6137 0.5674 0.5855 0.6145 0.4380 0.7671 0.6681 0.6310 0.6442 0.6255 0.6193 0.8042 0.7260 0.6836 0.7543 0.7821 0.8838 0.8912 0.9117 0.7289 0.9438 0.8968 1.0276 1.0259 0.9247 1.1729 1.0551 1.0510 1.3259 0.9173 0.9261 1.0884 1.2699 0.5920 0.5320 0.5492 0.6671 0.6417 0.6609 0.5565 0.6439 0.8697 0.5131 0.6736 0.9269 1.6535 1.2619 1.4165 1.4046 1.1484 1.2599 0.1788 0.1776 0.1914 0.1816 0.7382 0.9118 1.0290 1.0549 0.9821 1.0167 1.2685 1.5324 1.7271 1.3067 1.2128 2.0258 1.5225 1.6963 1.9329 1.2840 1.3210 1.8965 2.7691 1.2588 0.9172 1.7998 0.9025 1.0000 1.2145 1.3505 1.5632 0.7989 2.0498 1.5137 2.8806 3.0257 1.4922 2.6573 0.9542 0.9098 0.9142 0.8213 1.0136 0.9864 0.4011 0.4477 0.3526 0.4060 0.3254 0.4614 0.4836 0.4576 0.4625 0.3888 0.3542 0.5621 0.7379 0.4978 0.5435 0.6527 0.6422 2.1603 2.2806 2.3355 2.2674 2.5557 2.5296 1.6268 2.6946 2.8367 1.6829 1.5278 androstenediol (3beta,17beta) monosulfate (2) 0.7114 0.6235 0.5736 0.4219 0.4100 0.5250 1.2188 1.0167 1.0629 0.7876 0.9352 1.0454 0.9088 0.7297 0.8457 0.8396 0.8120 0.3758 0.5458 0.4748 0.8307 0.4115 0.8038 0.5806 0.3935 0.5218 0.6081 0.5689 0.5124 2.2707 1.7996 2.3054 1.6294 1.8490 1.7974 3.3827 3.8366 3.6514 3.5315 3.5121 3.5207 2.5890 3.3784 2.7942 2.9784 2.7416 2.8681 0.8750 0.6706 0.5346 0.6118 0.8670 0.5475 1.7549 0.8289 1.0267 1.6164 1.4184 1.9552 1.8324 2.2091 2.0740 2.4129 1.9493 1.1133 0.9324 0.8362 0.9255 0.8084 1.1847 1.0416 0.9243 1.1330 1.1176 1.1822 0.4204 0.4147 0.2571 0.3681 0.4153 1.1711 1.2570 1.0000 1.2220 1.7624 1.7097 0.7647 0.8075 0.9484 0.8863 0.9357 0.8546 6.2061 3.9241 4.4949 5.3883 5.1396 1.4375 1.2253 1.4047 1.3769 1.4213 1.5668 0.2944 0.3508 0.5178 0.2619 0.4335 0.6369 2.0808 2.3567 1.8407 1.2740 0.8980 1.4107 0.2571 0.2571 0.2571 0.2571 1.1909 1.2899 1.2516 1.3015 1.4065 1.0557 1.8042 1.4686 2.0681 1.1969 0.6350 0.9616 0.6052 0.6934 0.8414 0.5863 1.5189 1.8290 2.2824 1.6982 1.1755 2.3553 0.5041 0.5933 0.8425 0.5776 0.7537 0.6230 0.5031 0.3894 0.6432 0.7084 0.4248 0.5471 0.5096 0.5154 0.4198 0.4984 0.5216 0.5485 0.9082 1.0792 0.9557 1.1292 0.9733 1.1177 0.8011 0.6872 0.8022 1.0359 0.9198 0.7728 0.8782 0.8732 0.9297 0.8292 1.1226 3.7782 3.9275 3.8015 4.5665 3.1452 3.1413 2.2566 2.4573 3.0679 1.9224 1.8680 androsterone glucuronide 0.8976 0.8689 0.7738 0.7375 0.6260 0.8401 0.3460 0.3220 0.6260 0.3385 0.3920 1.8933 1.8592 1.5194 2.1127 2.0556 1.8349 0.6248 0.6879 0.6136 0.7846 0.6882 0.8347 0.1204 0.1704 0.1418 0.1475 0.1492 0.1204 0.9519 1.2190 1.0122 0.9074 1.0233 1.0004 0.6993 0.9212 0.7754 0.8500 0.6811 0.7878 2.6872 2.6440 2.1558 2.9355 2.4183 2.2452 0.2894 0.4695 0.3959 0.1863 0.2626 0.2064 1.4472 1.1077 0.9514 1.6321 1.9077 1.3081 1.3489 1.7398 1.2556 1.6023 1.4493 2.1702 2.0229 1.8238 1.3633 1.6877 0.5261 0.6170 0.5184 0.4966 0.8094 0.5222 1.0072 0.8486 0.7270 0.8361 0.8955 1.8628 1.5432 1.6574 1.5391 1.9438 1.5881 0.9741 0.6943 0.8062 0.7104 0.8001 0.7583 1.7049 1.5745 1.1585 1.2425 1.0000 1.3112 1.3318 1.2901 0.9920 1.4726 1.3062 0.6504 0.7979 0.8524 0.8407 0.8238 0.9434 0.9486 1.1675 1.0000 1.1163 0.6735 0.8684 0.1204 0.1204 0.1204 0.1204 0.8601 0.9384 1.0169 0.8457 1.0418 0.9853 0.7625 0.8720 1.3352 1.0214 0.9510 1.5169 1.1694 1.0684 1.5305 1.2373 1.3278 1.3266 1.6311 1.2922 1.1143 1.8138 1.0827 0.9484 1.0706 0.6832 1.2828 1.0792 1.2842 1.1302 1.3914 1.6205 1.0257 1.6103 0.9795 1.3266 1.2561 1.0291 0.9738 1.3751 0.4327 0.3223 0.3051 0.3415 0.3599 0.3593 0.4887 0.3989 0.8080 0.5981 0.5998 0.9798 0.8215 0.9073 1.0278 0.9914 1.1466 2.1948 2.0600 1.9853 2.2657 1.8822 1.5436 1.7914 1.4208 1.6945 1.3361 0.7802 androsterone sulfate 1.1570 1.0000 0.9186 0.4720 0.5077 0.7419 0.5751 0.5318 0.5777 0.3299 0.4816 1.8448 1.4470 1.4527 1.2814 1.4209 1.7737 0.4873 0.7752 0.7613 0.7747 0.6523 0.8805 0.8207 0.7789 0.7385 0.9572 0.8936 0.8699 1.4045 1.4089 1.4566 0.7672 1.3252 0.8866 2.3189 2.2691 2.1849 2.1174 2.0616 1.8768 2.6342 2.1745 2.4530 2.4308 2.4901 2.5404 0.5376 0.6366 0.4489 0.4095 0.6126 0.4138 1.6625 0.9328 1.1289 1.8767 1.6832 2.7710 1.9842 2.9846 1.8458 3.1421 1.5082 1.7489 1.5246 1.5366 1.6056 1.2962 0.6854 0.6349 0.5031 0.7429 0.7926 0.7026 0.5661 0.5627 0.5798 0.6298 0.6661 1.2293 1.3577 1.3307 1.1268 1.9452 1.6468 0.4787 0.4205 0.4570 0.4691 0.5274 0.4930 3.0239 1.3566 1.7026 2.5746 2.5135 1.1992 1.1215 1.1236 1.1474 1.2057 1.2761 0.6773 0.8137 1.1648 0.6744 1.0129 1.3077 1.7884 2.0796 1.8631 1.1792 0.7758 0.9516 0.3083 0.2687 0.2537 0.2318 0.7868 0.8661 0.8462 0.9068 0.8888 0.7027 1.4996 1.4711 1.7431 1.0196 0.3038 0.5500 0.3924 0.4980 0.5157 0.3293 1.0232 1.6636 1.7348 0.9513 0.7125 1.7736 0.5856 0.5567 0.6928 0.6160 0.8335 0.5277 2.0007 1.4550 2.7098 3.0108 1.3922 2.3213 1.7316 1.8185 1.8748 1.7862 1.8330 2.1495 0.9674 0.9605 0.8855 0.9675 0.8683 0.9854 0.6281 0.5320 1.0146 1.0210 0.8442 0.5180 0.8803 0.7529 0.6362 0.7320 0.9886 2.4859 2.3907 2.3152 2.1996 2.0009 2.4525 1.2940 2.0875 2.5744 0.8702 0.5223 arachidate (20:0) 1.1811 1.0509 0.6071 1.0291 0.9936 0.9125 1.0167 0.9457 0.9946 0.9436 0.9916 1.1744 1.4395 0.8460 0.9457 1.2739 0.9994 1.0461 0.9615 2.6612 1.0628 2.4423 1.1594 0.8843 0.6899 1.0358 1.0594 1.8938 0.7691 0.7372 1.0781 0.8292 1.1594 1.9253 0.8125 1.6829 1.6225 0.8748 0.8422 1.1246 0.8998 1.3942 1.2772 1.0134 0.9806 1.2377 1.1404 0.7284 1.0000 1.5876 2.0247 1.7742 1.3185 0.8073 0.9004 0.9285 0.8380 0.9378 0.5829 0.7577 0.7153 0.8542 0.7062 0.8055 1.0224 0.8523 1.0071 1.3503 0.9929 0.8687 1.0562 0.7233 1.6537 0.9580 0.9747 0.9139 0.8635 1.2480 0.8923 1.1601 0.9955 0.7169 1.1641 1.0712 1.1425 0.8120 0.9350 0.9111 1.4572 1.0618 1.0218 0.9768 0.9795 0.8320 0.9904 0.7581 0.7777 1.9170 1.1052 0.9413 1.0632 1.1490 1.3625 0.9942 0.9506 0.9223 1.7183 0.7415 1.0773 1.2190 0.8848 1.1147 2.5026 1.0430 1.7086 1.8809 1.2922 1.0416 0.9771 0.9711 1.2197 1.2025 1.5835 0.9901 0.8449 0.8098 0.9660 0.9640 1.1418 1.0203 1.2105 1.6265 0.9905 1.3577 1.4422 0.8036 0.6192 0.9225 1.1557 0.8535 0.8710 1.7424 2.4845 0.9335 0.7832 0.8906 0.9943 0.8709 0.8790 0.7821 1.7511 0.7728 0.8649 0.9785 1.1002 1.0718 1.1396 1.0698 1.8158 0.9128 1.0688 0.8425 1.2211 1.0080 1.8011 0.8805 0.7343 1.6052 1.5993 0.7600 0.7351 0.7914 0.7076 1.1122 1.3033 1.7054 1.0594 0.8248 1.3771 1.1535 1.2137 0.8975 1.2075 1.1054 1.1209 1.1300 0.6970 arachidonate (20:4n6) 1.9508 1.1878 0.4481 1.2292 1.1527 0.6259 1.1463 0.9617 0.5144 0.6502 0.6146 2.0746 2.2538 0.8707 1.2660 1.3707 1.5627 0.9184 0.8797 2.3435 0.3762 2.4160 1.1788 0.6639 0.7891 0.7907 1.4052 2.4300 1.1028 0.7861 1.5645 0.9420 1.3306 1.6028 0.7599 2.8413 2.2366 1.5007 1.1557 1.1476 1.0210 1.2541 1.0674 0.7463 0.9786 1.0036 1.2129 0.5946 1.1816 1.2449 2.1624 2.1179 1.8144 0.6174 0.8503 0.8285 0.9191 0.9036 0.2550 0.3770 0.5770 0.6733 0.4303 0.7361 0.9921 0.7674 0.9553 1.7376 0.7467 0.6681 0.9252 0.3749 1.4129 0.8895 0.7255 1.0103 0.7142 1.1992 0.9850 0.9449 0.8633 0.4353 0.8534 1.1601 1.2933 0.6358 0.8696 0.6906 1.1761 1.4055 0.8431 1.2517 0.8327 0.7054 0.6654 0.6973 0.8831 1.6715 1.0079 1.0561 1.1603 1.2093 1.5678 0.9250 0.8747 0.7522 1.8223 0.4726 0.7934 1.1285 0.5536 0.9733 1.9905 0.4776 1.4954 2.2633 1.8831 1.4171 1.4925 0.7985 1.7889 0.9337 1.0312 0.8885 0.5759 0.6641 1.1125 0.9173 1.2444 1.8847 1.4898 1.5096 1.2780 1.4122 1.7454 0.8974 0.5467 0.7736 1.6228 1.1569 1.0888 1.3301 1.5983 0.5637 0.4419 0.7974 0.7044 0.8846 1.0000 0.8678 2.6391 0.8548 0.8969 1.0371 0.9283 1.1441 0.9723 1.2345 1.9152 1.3281 2.2065 1.0239 1.6426 1.4575 2.5897 1.2054 0.8935 4.3866 3.6916 0.8576 0.5633 0.6349 0.4910 1.3440 1.3993 2.6281 0.8417 0.5388 1.2320 0.9693 1.0113 0.5260 0.8420 0.9158 1.0961 1.0911 0.5009 behenate (22:0)* 1.2086 1.1726 0.5643 1.3824 0.8629 1.3279 0.9536 1.0034 0.9101 1.0171 0.9113 0.6850 1.0710 0.9311 1.0092 1.2805 0.9598 0.9443 1.2688 3.3792 1.3399 2.8338 1.5095 1.0999 0.6369 1.5931 1.3238 1.1949 0.5910 0.7622 0.6969 0.5599 0.7390 2.9478 0.9917 1.0132 1.2843 1.0486 0.3467 1.0946 1.0288 1.0596 1.2743 0.8906 0.8589 1.6942 1.2231 0.6810 0.9726 1.3962 2.0213 1.7795 0.8787 0.6442 1.0624 0.6491 0.9978 0.6804 0.5992 0.7687 0.4652 1.0535 0.4720 0.5383 0.8579 1.1628 1.5316 1.5443 0.6702 0.8734 0.4498 0.8880 1.3461 0.9696 0.9836 0.8873 0.8604 0.7046 0.8422 1.0085 0.9944 0.5738 1.4589 0.5040 1.4079 0.8215 0.7327 1.0739 1.0700 1.1395 1.4065 0.6987 1.2750 0.7773 1.2336 0.7312 0.5925 1.3756 1.4265 0.8484 1.0471 0.9659 1.3152 1.0828 1.1650 1.0618 1.6260 0.7916 1.2239 1.0279 0.9034 1.0145 2.7481 0.9300 1.4290 1.1828 0.8445 0.6978 0.8853 1.2077 0.8017 1.5411 1.0776 0.7473 1.0752 0.6520 0.5800 1.2226 1.6823 0.4991 0.7353 1.0092 1.0903 0.7391 0.9074 0.9398 0.7132 0.9416 1.0465 0.7866 0.6937 1.8297 2.5160 1.0214 0.7083 0.4459 1.0106 1.1280 0.9287 0.7777 1.9032 0.7059 0.8404 1.2517 1.0022 0.8445 1.4706 0.5607 1.7642 0.9320 1.6459 1.2534 0.8676 1.2871 2.2335 0.5959 0.4881 0.8822 1.1545 0.9303 0.8230 0.8354 0.8454 1.0616 1.4502 1.5691 1.0076 0.6061 1.4142 1.0593 1.1917 0.7823 1.1414 0.7659 1.2404 1.0000 0.5546 benzoate 1.1029 1.0604 0.7865 1.1169 1.0034 1.0000 0.9517 0.8838 0.9809 0.8146 0.9526 1.2560 0.8859 0.9737 1.0019 0.9421 1.0554 1.0021 0.8880 1.0187 1.2225 0.8832 0.9405 1.0005 0.9231 0.8887 0.8857 0.8480 1.1226 0.9339 1.1874 1.0049 1.0037 0.9515 1.0108 1.0798 1.0832 0.9241 0.9204 0.9069 1.0538 0.8668 1.0844 1.3908 0.6399 0.8363 0.9053 1.0625 1.3480 1.0493 0.9846 0.9163 0.9814 0.8463 1.2514 1.0173 0.9816 0.8983 1.0726 0.9049 0.3457 0.8912 0.8847 0.9079 1.0522 0.9050 1.0744 1.1003 1.2570 1.0572 1.1118 0.9832 0.9383 1.3057 0.9985 1.0819 1.2157 1.4955 1.2264 1.3737 1.0659 0.8849 0.9667 0.8965 0.8495 0.8747 1.1662 1.1220 0.9557 0.9606 0.8270 1.1632 0.9397 0.8603 0.9899 0.9995 1.0362 1.1770 0.8934 1.1275 1.0470 0.9140 1.0230 1.0570 1.2378 0.9786 1.1831 1.1142 1.3142 1.0474 0.9705 1.0183 0.9645 1.0127 1.0354 0.9945 0.9050 0.8952 1.0512 0.9270 0.5369 2.4096 1.3393 0.8121 1.1052 1.7880 0.9448 1.1078 1.0947 0.8172 1.1613 0.8590 0.9887 0.9771 2.3306 1.2966 1.0714 1.0320 1.1380 1.3578 1.2115 0.9844 0.9630 0.9832 0.9988 1.1010 0.9755 0.9143 0.9113 1.1058 2.2095 0.9142 0.9870 1.0527 1.0429 1.1599 1.1749 1.1662 0.7806 1.1139 1.2634 1.0228 1.2261 0.8419 1.1482 0.3317 0.8296 0.9194 0.8541 0.8758 1.0046 0.9508 1.0233 1.0713 1.0686 1.2375 0.9096 1.0098 0.9776 1.1095 0.9612 0.9458 1.1464 0.8438 0.7272 0.8754 0.9542 beta-citrylglutamate 0.8955 1.1876 0.7722 1.0250 0.8249 0.8121 1.5887 1.7469 2.1875 1.3410 1.7387 1.0835 0.9441 0.8023 1.1441 0.6183 0.9033 0.6521 1.2048 1.1699 0.4482 1.3714 1.2915 0.4848 0.8333 0.6597 0.5571 0.7993 1.1361 1.0947 0.9675 1.1597 0.4032 0.9029 0.7028 1.3325 1.6511 1.7869 0.6750 0.2936 1.2302 1.5732 1.2859 1.1460 1.3870 1.4431 1.2203 0.5795 1.4216 0.5689 0.7240 1.2958 1.0672 1.4386 1.1822 1.0681 1.5917 1.3461 0.7368 0.7022 0.8431 0.7389 0.9189 0.5416 1.2286 1.6549 2.1003 1.4382 1.5760 0.8487 0.8917 0.4065 1.0975 0.7928 0.8034 0.6346 0.5892 0.2508 0.5273 0.7762 1.2889 1.0447 1.2480 1.1069 1.1793 1.3670 0.7228 0.7213 0.8329 1.2951 0.7689 0.7470 1.7118 1.1485 1.2674 1.5748 1.9547 0.6432 0.9759 0.9168 0.8819 0.8929 0.6733 0.7493 0.6270 0.7407 0.4850 0.8786 1.0009 0.8470 1.2197 1.2198 1.0273 0.3389 1.1989 1.1488 0.5994 0.8585 0.5893 0.9423 1.1485 1.2045 0.2508 0.9899 0.4579 1.2365 0.9582 1.1105 0.8896 0.5922 0.5921 0.5672 0.7193 0.5843 0.6563 0.8862 0.8915 1.2465 1.2983 0.7111 1.0392 0.9252 0.9854 0.8022 1.2080 1.0350 0.6610 1.0420 1.1243 1.2567 1.8102 0.8263 1.6373 1.0101 1.3535 1.3574 1.0203 0.9463 1.1818 1.5326 1.4254 1.5679 1.8108 1.5423 1.3676 1.5278 0.7711 1.4841 1.3435 1.3408 0.7415 0.9991 1.1146 1.0450 1.2792 0.8897 0.5724 0.6334 0.6278 0.7148 0.3552 0.9914 1.0681 3.3062 1.6409 0.9208 0.7323 beta-hydroxyisovalerate 0.8917 0.9190 0.5363 1.3934 1.1269 0.8759 0.7923 0.6953 0.5215 0.8154 0.8460 1.6523 1.4596 1.5818 1.3644 1.4758 1.5811 0.9296 0.5370 1.0967 0.8293 0.8708 0.9436 0.7877 0.7526 0.7227 0.4446 1.2968 0.6696 1.3895 1.0658 1.4267 1.3916 1.2002 1.1121 0.8363 0.7398 0.7602 0.6668 0.6158 0.5776 1.1314 1.6410 1.0480 1.4942 1.3026 1.3634 0.6867 0.3551 0.7367 0.8162 0.7499 1.0617 0.9169 1.5040 1.7402 0.9703 0.5277 0.9075 1.4325 1.3220 1.6999 1.2425 1.4020 0.4624 0.5816 0.4716 0.4401 0.6174 0.5522 0.8973 0.3328 0.6865 1.2429 0.5878 0.6795 0.6576 0.5969 0.7389 0.6839 1.5689 0.4908 1.0238 1.3634 0.8518 0.7487 1.5295 1.7646 1.6515 2.2587 1.7341 2.1324 1.1300 1.2067 1.2361 1.3393 0.9715 1.1378 0.8978 1.0113 0.4301 1.1521 1.1281 1.5392 1.4142 1.2735 1.5955 1.0000 1.2019 0.7011 0.6906 0.6298 0.5593 1.2030 1.1521 0.9409 1.3678 1.1987 1.3891 0.3528 0.4050 0.3819 0.2970 0.4064 1.6926 1.3142 0.8907 1.4236 1.7553 1.7534 2.0743 1.4548 1.3195 1.8920 2.0993 3.4355 3.3571 4.1110 4.1142 3.3654 4.9319 1.5493 1.4244 1.0005 0.8988 1.4097 1.5613 0.6553 0.9612 0.5886 0.8799 1.0508 0.7631 0.8114 0.9375 0.8495 0.8487 0.5323 1.0381 0.8713 0.9156 0.9141 0.8717 0.6619 0.9412 1.6475 1.4832 0.6321 0.9887 0.8472 1.1752 0.8136 1.3312 1.8100 1.2218 1.6070 1.6525 0.8898 1.5962 1.3215 1.2634 0.7197 1.2346 0.5092 0.4036 0.9298 0.7237 bilirubin (E,E)* 1.4394 1.1561 0.8366 0.8280 0.9268 0.6995 1.1866 1.1189 0.7597 0.5723 0.5919 1.6291 0.9882 0.6485 0.8814 0.4986 1.2842 0.6439 0.6873 0.6921 0.6635 0.6310 0.7985 1.3754 1.2410 0.9999 1.0165 1.8624 0.4902 1.3897 1.4237 1.7092 1.2521 0.9606 0.7271 2.4936 1.3744 1.7721 1.6531 1.0000 1.3976 1.2194 1.5418 1.1632 1.3268 1.1216 2.0337 0.8789 0.6989 0.4206 0.8086 0.8616 0.9707 1.0960 1.2517 0.9660 1.1375 0.7935 1.1173 1.0865 1.5782 1.3388 1.3568 1.2812 0.6168 0.6162 0.5999 0.9041 0.4572 1.3333 1.1320 0.7677 1.0888 1.3495 1.1645 1.2331 1.3818 1.4089 1.9493 1.6145 0.8417 0.7163 0.5531 0.9671 1.0344 0.8083 0.7059 0.5800 0.4438 0.2623 0.7565 0.8223 0.7215 0.6506 0.3653 0.7464 1.0774 0.8635 0.6276 0.6421 0.9181 0.6117 1.0587 1.0795 0.7174 1.4984 1.0052 1.2282 1.5410 0.6412 0.5178 0.4820 0.2511 0.6294 0.5854 0.5614 1.6065 1.5503 1.8079 2.2245 1.4212 1.4877 1.6740 2.3304 0.6474 1.1002 0.7778 1.2579 0.7270 1.4876 2.2980 1.1668 1.8309 2.3496 2.1138 0.5084 0.4474 0.4985 0.7536 0.7080 0.6662 0.3593 0.3829 0.4968 0.4587 0.7442 0.4724 1.3737 1.6061 1.6864 2.2227 1.5279 1.5750 0.8299 1.1694 1.0960 0.7591 1.9763 1.6853 0.9081 1.2562 0.6486 1.0001 0.6209 0.4117 1.0004 1.2539 1.2331 1.2916 0.8855 1.0434 1.0894 1.0091 1.0505 1.0613 2.1391 0.3812 0.3927 0.3479 0.4798 0.2005 1.0785 1.1819 0.1361 1.1479 0.7305 0.7411 bilirubin 1.3301 1.3642 1.4003 0.8303 0.6504 1.1994 1.2938 0.9274 1.3627 0.7511 1.1908 1.4355 1.5846 0.9534 1.6399 0.9675 1.6864 0.7766 0.9468 0.6527 0.8591 0.7660 0.7266 0.6229 1.0098 0.9298 1.1675 1.3752 0.0512 0.9683 1.7354 1.3886 1.0450 0.8042 0.6473 1.8077 1.9502 1.1256 1.6045 1.3734 1.6647 1.0000 1.7023 1.1453 1.3946 1.2529 1.6571 0.7372 0.9674 0.3343 0.7306 0.7764 0.8536 1.2051 0.7607 0.8062 1.2500 1.2156 1.3873 1.0754 1.2739 1.3284 1.1465 1.2628 0.5049 0.4422 0.4356 0.5290 0.3706 0.7396 0.6497 0.8716 1.2103 0.5449 0.4303 2.4309 2.3966 1.5872 1.7132 1.2784 0.5321 0.7281 0.3202 0.3020 0.3771 0.2680 0.5833 0.6301 0.5080 0.0559 0.4669 0.5999 0.9064 0.5508 0.4858 0.5052 1.0524 0.7475 0.8699 0.9555 1.0721 0.9447 0.9831 1.0976 1.2033 2.0339 1.0470 1.5001 1.5541 0.3401 0.4164 0.8660 0.5537 0.9222 0.9659 0.0512 2.0400 3.0944 1.7893 2.5618 1.8925 1.0648 2.1219 2.0761 0.4009 0.8103 1.0367 1.2135 0.7014 1.5721 2.6917 1.4240 2.7413 2.9180 1.5787 0.5512 0.7968 0.5844 0.9399 0.6593 0.8444 0.5216 0.5579 0.7401 0.6952 1.0451 0.8798 2.4084 2.1588 2.4653 1.7304 1.3980 0.9585 0.7590 1.2157 1.1713 0.9902 1.5703 1.4483 1.0997 1.3161 0.9468 1.4770 1.0736 0.1997 1.1810 0.7461 1.3757 1.5222 1.0299 1.5701 3.0401 1.0702 2.1764 2.3878 3.2262 0.7333 0.7812 0.8276 0.8505 0.1377 0.8445 0.8324 0.0512 1.0349 0.4188 0.5306 branched chain 14:0 dicarboxylic acid 0.8131 1.0907 0.6495 0.5264 0.5851 1.0301 0.8689 1.1130 0.7012 0.8266 1.1748 1.2627 1.0944 1.9065 0.9358 1.1580 1.2670 0.1648 0.5843 0.5909 0.4049 0.7167 0.6207 1.1257 2.2015 1.1324 0.6336 0.9748 0.7780 1.2885 0.3888 0.6490 0.3315 1.1627 1.1016 0.4096 1.2062 0.5268 1.8827 0.7084 0.5187 3.5042 1.8079 1.0606 1.2157 1.2076 1.0034 1.1628 0.6123 1.6690 1.1078 0.7415 0.3030 0.6771 0.1548 0.3895 0.5480 0.3496 1.1945 2.3691 1.3622 1.3213 1.7722 1.2191 0.5226 0.6716 0.6351 0.7887 0.1083 0.2582 0.8926 1.3714 0.4461 0.5994 0.9583 0.7762 0.9722 0.8358 1.0114 1.1857 0.4168 0.5407 0.9311 0.3920 0.8393 0.9886 0.6470 0.3734 0.7019 0.2601 1.0622 0.4102 1.3263 0.6987 1.2399 0.9086 0.6346 1.6593 1.0712 0.7950 0.8713 1.1127 1.0912 1.1637 1.8794 1.9488 1.9508 1.6497 3.0339 1.0395 1.4097 1.3136 2.2846 1.3933 1.3947 0.7086 0.6180 0.8197 0.6444 2.2296 2.0287 1.9063 1.0252 1.6471 0.4276 1.5606 0.6990 0.8539 0.8736 1.3173 1.8743 2.0037 0.6392 0.7888 2.3695 0.9117 0.6420 1.1878 0.7938 1.5834 0.8014 0.5720 1.2828 1.8426 1.5338 2.0021 1.0248 2.3539 0.9959 0.8970 1.3254 1.9749 2.4604 1.4151 1.8877 0.9447 1.4192 0.9464 1.2903 0.2491 1.6890 1.3308 1.5420 1.2988 0.9707 1.2281 1.6118 2.0495 2.3180 2.8046 0.7135 0.9355 1.5775 0.9007 0.9157 1.1432 0.5568 1.0000 0.8351 1.7985 1.4902 0.2952 0.2303 0.7596 0.6839 0.9277 1.3167 branched-chain fatty acid 18:0 (2) 3.6280 3.7204 0.7367 1.8274 2.2255 1.7010 0.7735 0.7856 0.8604 0.8541 1.1111 1.0186 0.8281 1.0935 0.4545 0.6816 0.8236 1.4752 0.9549 1.4388 1.3808 1.4425 1.1181 0.8280 0.2850 0.8581 0.5586 0.2850 1.0000 0.3647 1.0822 0.5490 0.9642 1.0493 0.8497 1.6453 3.8760 0.9089 1.7116 1.5023 2.3873 0.9382 0.9651 0.6442 0.7609 0.8376 0.9379 0.7259 0.9035 0.4460 0.2850 0.2850 0.2850 1.2312 1.1124 1.4651 1.5306 0.8321 0.4030 1.0195 1.0017 0.8144 0.8998 1.0536 0.7093 0.7381 0.3487 0.2850 0.4563 2.0574 4.5772 3.9901 2.2778 1.3194 1.5253 1.0482 1.3684 1.1103 0.8384 1.4767 0.8756 0.6566 0.5529 0.2850 0.2850 0.5011 0.7780 1.7749 1.0271 1.6909 1.2224 1.3446 0.7865 1.0012 1.1380 0.4712 0.7121 0.2850 0.7084 0.8479 0.9289 0.7007 0.8896 1.9056 2.1114 1.6085 1.3638 1.7403 1.6529 0.3856 0.2850 1.0000 1.6071 0.8472 0.9335 0.2933 0.7213 0.9272 0.5925 1.6378 1.1974 0.5412 1.3916 0.2850 1.1378 0.9618 1.3049 1.3069 1.7556 0.5116 0.7626 0.7663 0.6745 0.5597 0.2959 2.5712 2.4804 1.3257 1.1840 3.4955 1.4008 1.2284 0.8928 0.8668 0.7250 0.4973 1.2008 0.6152 0.5801 0.7886 0.2850 0.5081 0.6224 1.4981 1.4625 1.4436 1.0640 1.5103 1.3686 0.9722 1.2205 0.9185 1.0584 0.9962 1.3469 0.9843 0.8166 1.3371 1.2429 0.5750 1.9194 1.0828 1.3866 1.3281 1.1780 1.9471 1.1531 0.3824 1.0383 0.4383 1.0546 1.0744 0.6953 0.6384 0.7592 0.7412 0.7291 branched-chain, straight-chain, or cyclopropyl 10:1 fatty acid (1)* 1.0360 1.1501 0.4328 0.7245 0.7851 0.8787 0.5883 0.8347 0.1825 0.5070 0.8711 1.1951 0.5874 0.6856 0.8291 1.2326 1.1463 1.2791 0.3777 2.0001 0.5055 1.1296 1.8632 0.9752 1.1741 0.6553 0.3697 1.0470 1.5848 0.6237 0.4114 0.7616 0.7970 1.2446 0.5912 1.7258 1.2714 1.8116 1.2051 1.8104 1.2916 0.7647 0.7629 0.5398 0.6256 1.4764 1.0304 0.9878 0.2422 0.4871 0.4920 0.5564 0.5181 0.6220 0.4358 0.9797 0.6286 0.2572 0.2950 0.9138 0.8769 0.5612 0.8018 0.8646 0.3881 0.5860 0.8299 0.8144 0.8416 0.9450 1.2180 0.6561 1.1981 1.0000 1.1633 1.0215 1.2555 1.1972 1.9544 0.9146 0.8349 0.2336 0.7274 1.2704 1.6519 1.2611 0.9587 0.8942 0.8539 1.0022 1.2848 0.7200 1.2965 1.4865 1.5254 1.1281 1.4341 1.3463 1.1963 1.1012 1.2871 1.0200 1.5287 0.8171 1.1039 0.8024 1.2857 0.4792 0.9909 0.8854 0.5810 0.7179 0.6423 0.8159 1.1116 1.8774 1.5188 1.4727 1.6263 1.5202 1.8240 1.7650 1.8677 1.4326 0.9978 1.3843 0.7934 2.0272 1.6339 0.7258 1.6435 1.3860 0.5735 0.9399 1.3195 0.7135 0.5028 1.4151 1.1591 1.1181 0.7320 0.7592 1.5903 0.6082 0.4234 1.5830 1.2107 1.0760 0.7352 0.5721 1.0815 1.0051 1.4500 0.7274 1.6404 0.8302 1.2874 1.6921 1.4985 1.0450 1.3194 0.9042 0.9731 0.7408 1.1162 1.1829 0.9832 0.2670 1.4262 1.1732 1.5443 0.5496 2.3424 2.4535 2.1503 3.0765 0.8577 0.2938 0.5230 0.6522 0.5846 2.1932 2.4107 1.3440 2.0425 1.8772 1.5861 branched-chain, straight-chain, or cyclopropyl 10:1 fatty acid (2)* 1.2951 1.0401 1.0435 1.2279 0.9574 0.9728 0.6232 0.9580 0.7280 0.7162 1.2142 1.6219 1.0903 0.7982 1.2733 1.8552 0.8317 0.9287 0.7731 1.4451 0.4451 0.9540 0.9294 1.0536 1.1473 1.0375 1.1532 1.4469 0.9050 0.5510 0.9397 0.7869 0.6587 1.5126 0.7060 1.5336 1.0048 1.3512 0.9616 0.9435 0.9021 1.1591 0.9308 0.8787 0.9804 1.7921 1.0707 0.6231 0.6986 0.8930 0.8795 0.7112 1.1606 0.9085 1.0484 1.3495 0.7031 0.5961 0.7381 1.2185 0.5800 0.6895 0.6379 0.7896 0.6103 0.9433 0.5453 0.9186 0.7043 1.1628 1.3650 1.3747 1.5110 1.2790 1.0668 1.2761 1.1078 1.1578 0.9961 1.2461 0.7937 0.5342 0.7974 0.8092 0.8749 0.7502 0.7873 0.6333 0.9775 0.6609 0.8616 0.7013 0.6280 0.8479 1.4028 0.8309 0.9426 0.9459 0.8018 0.8473 0.8719 1.2633 1.0218 0.8361 1.4124 1.0201 0.9167 0.8766 0.8867 0.5450 0.4147 0.9154 1.0258 1.0034 1.1280 1.0515 0.7990 1.3141 1.0753 1.1831 1.6898 1.6671 1.1542 1.2052 0.9893 1.0696 1.0339 1.0971 1.8598 0.7773 1.0139 1.4738 1.1736 1.1643 1.0898 0.9096 1.1568 0.8386 0.9497 0.8098 0.9526 1.2352 1.7616 0.4487 1.1084 1.1293 1.1505 1.8167 0.9888 1.5023 0.9979 0.9468 1.2971 1.1360 0.9222 1.3325 1.5354 1.1919 1.7719 1.4858 1.5639 2.0884 1.1053 1.2673 1.3380 1.3862 1.1105 1.0646 1.0107 0.5936 1.3703 0.9668 0.7745 1.1107 0.8380 1.1868 1.0000 0.8232 1.1516 0.8370 0.9772 0.9618 1.0038 1.1619 1.5914 1.5065 0.9967 branched-chain, straight-chain, or cyclopropyl 10:1 fatty acid (3)* 0.2546 0.2546 0.2546 0.2546 0.8651 0.2546 0.9536 0.9818 0.3345 0.7200 0.4201 0.2546 0.9104 1.2155 1.3110 0.2546 1.6729 1.0000 0.2546 1.5842 0.5044 0.2546 1.4252 1.6060 1.2692 0.6253 0.4538 1.4567 1.7270 0.2546 0.7194 0.9821 0.9152 0.2546 0.2546 1.8057 0.9755 1.6350 0.9975 0.2546 0.2546 0.9544 0.7738 0.4468 0.7948 0.9468 1.3786 0.2546 0.6209 0.6975 0.2546 0.9566 0.9580 0.2546 0.2546 1.1145 1.2157 0.2546 0.4593 0.9195 0.9780 0.2546 0.8713 0.9786 0.9627 1.0419 0.7435 0.2546 0.7206 0.6696 0.7104 0.2765 1.1445 0.8502 0.8272 0.7836 0.3765 0.9786 1.1053 0.2546 1.0500 0.2546 0.2546 1.2064 1.4868 1.1917 0.2546 0.2546 0.7590 0.2546 1.0595 1.5508 0.5010 0.7959 0.2546 0.2546 0.2546 1.2876 0.9324 0.2546 1.9755 0.8989 1.4657 1.1216 1.0547 0.9945 1.2119 0.2546 0.2546 0.2546 0.2546 0.4562 0.2546 1.0101 1.1063 1.8388 1.3092 1.3144 0.2546 1.5290 0.2546 1.7021 0.9364 1.2915 0.8244 1.1400 0.2546 0.9846 1.0320 0.2546 1.2753 0.2546 0.2546 0.2546 1.0260 0.2546 0.7321 1.1395 0.2546 1.9100 0.2546 0.2546 1.2536 1.0075 0.7104 1.8282 1.2233 1.2101 1.1346 1.0606 0.2546 1.3156 0.2546 1.0441 0.7648 1.0036 0.6834 1.4824 1.3624 1.0525 1.7110 0.7870 0.8823 0.6402 0.2546 0.2546 0.2546 0.2546 1.1229 0.2546 0.9547 0.2546 0.4646 1.0034 0.4727 0.8086 1.2729 1.0025 0.2546 1.1768 0.2546 0.2546 0.8394 0.2546 1.1175 1.2724 0.6832 branched-chain, straight-chain, or cyclopropyl 12:1 fatty acid* 2.6201 0.9706 0.1241 1.4730 0.9338 0.4260 1.1480 0.8751 0.2084 0.4948 0.5699 2.9961 1.6603 1.5440 2.1740 1.0000 2.9687 1.7196 0.1967 2.0326 0.4681 1.9416 1.6899 1.3278 1.2616 0.5341 0.3429 1.5167 1.7108 0.7407 0.5346 1.1250 1.0813 0.4977 0.9877 2.6464 1.1756 1.8537 1.5397 1.4049 1.3711 0.5742 0.6621 0.5579 0.6562 0.5821 1.1791 0.6064 0.3977 0.8147 0.9799 1.3017 0.9725 0.7445 1.3822 0.9042 1.1106 0.2133 0.2486 0.7845 1.0778 1.5846 0.8605 1.1935 0.9984 0.9302 0.7969 1.5977 0.7868 0.6063 1.0044 0.4353 1.0977 1.1396 0.7057 0.7877 0.6238 1.4658 1.6449 0.4590 1.5566 0.1193 0.3938 1.3675 1.4511 1.0508 1.0521 0.8467 0.7242 1.5438 1.0534 1.9909 0.5446 0.9600 0.6999 0.9909 0.8979 1.2631 1.0436 1.0120 2.5209 1.0415 1.9583 1.4475 1.2713 1.0350 1.9041 0.3599 0.8073 1.1895 0.4649 0.2951 0.6683 0.7246 0.9208 1.2004 1.4817 1.2796 1.8683 1.0016 0.7378 1.3567 1.2760 1.5431 1.0816 0.6394 0.2384 0.7598 0.8649 0.8144 1.4720 0.7599 0.3789 1.1487 1.5200 0.9850 0.6568 1.2010 1.8269 1.8114 1.8602 0.9797 1.0946 1.0585 0.4669 2.0813 1.1688 0.4830 0.9011 0.5129 1.9791 1.2736 1.3265 1.1742 0.8112 1.1684 0.5863 1.8203 1.4560 1.2378 2.8674 0.6039 1.5320 0.8974 0.9356 0.7655 0.9809 0.1838 1.0874 0.4883 1.2649 0.2296 1.1632 1.9912 0.9898 2.4039 0.8242 0.1656 0.6163 0.6174 0.9592 0.5732 1.4291 0.2471 1.0384 0.9101 0.6317 butyrate (4:0) 0.8171 0.8960 0.6209 0.8576 0.7688 0.7982 2.2171 1.9544 1.6581 1.5090 1.3458 0.9750 0.8964 0.9529 1.1042 1.0314 0.9306 1.0444 1.0433 1.3417 1.0151 0.7751 1.0281 0.9709 1.0530 0.9168 1.0484 0.9678 0.9856 0.8292 0.8373 0.8795 0.9333 1.0203 0.8621 1.2215 1.3102 0.9644 0.9641 1.0000 0.9607 0.9621 1.2657 1.1319 1.2254 1.2525 1.2443 1.2336 0.8778 1.4797 1.2961 1.1583 0.7317 1.5901 1.0083 1.1916 1.3874 0.8863 1.1058 1.1810 0.9235 0.9678 0.9173 1.1852 0.7859 0.8202 0.7477 0.7334 0.7377 0.5897 0.9186 0.7288 0.9049 1.1669 0.8585 0.7395 1.0933 1.1579 1.1773 1.1143 0.7445 0.9868 0.8263 1.9159 1.0534 0.7296 0.9178 1.0761 0.5454 0.8449 0.9559 0.9923 1.0355 0.7141 0.8249 0.9149 1.0091 0.8383 1.1778 0.9893 0.7291 0.9538 1.0451 1.4485 1.0479 1.7962 1.2132 0.9497 2.3762 0.8625 0.9764 0.9174 1.1779 1.2456 1.0769 0.9984 0.9878 1.1136 0.9345 1.8807 1.8513 1.3438 0.8304 1.5660 0.6849 1.1322 0.8978 0.9683 0.8458 2.2370 1.1366 1.1444 1.2240 1.0117 0.8373 0.8775 0.9806 1.2092 0.8766 1.1004 1.0124 1.0150 1.3184 1.1725 0.9924 1.3659 1.2308 0.9672 1.0193 0.9294 1.1729 0.9945 1.3326 1.1759 1.4446 1.7813 1.1009 1.0723 1.1333 1.1212 0.8704 0.9282 0.9271 0.7122 0.9721 1.3154 1.0235 1.0077 1.1226 1.1529 0.7533 0.8453 0.9474 2.1732 1.0557 0.9336 0.9086 0.8476 1.0045 1.1933 1.1923 1.0298 0.9116 0.9421 0.9710 0.7079 0.7564 butyrylglycine (C4) 0.3542 0.3542 0.3542 0.3542 0.3542 0.3542 0.3542 0.8585 0.3542 0.5929 0.6003 0.7554 0.9947 0.6059 0.3542 0.9028 0.3542 0.7763 0.3542 0.8331 0.6325 0.6772 0.9444 0.9073 0.3542 1.0652 1.0945 1.1436 0.8757 0.3542 0.3542 0.3542 0.7508 0.7238 0.7137 0.3542 0.3542 0.3542 0.7946 1.1605 0.3542 0.3542 0.3542 1.0315 0.3542 1.1325 1.3734 1.1659 0.8701 1.0654 0.8516 0.9236 0.8226 1.0745 0.3542 0.3542 1.0364 0.3542 0.4230 1.1879 1.0443 1.1790 0.7547 0.8053 0.4808 0.3542 0.7988 0.8088 0.3542 0.3542 1.0804 0.9126 0.8622 0.3542 0.8890 0.3542 0.9767 0.3542 0.6499 1.1101 0.3542 0.3542 0.3542 0.9454 0.9360 0.3542 0.8651 1.0361 0.3542 0.9230 1.5740 0.3542 0.3542 0.3542 0.3542 0.8957 1.3514 0.8410 0.9973 1.1575 0.7275 0.8058 1.0027 0.3542 0.5519 0.9007 0.9264 0.3542 0.3542 1.5381 0.9238 1.0447 0.8787 1.3722 1.2134 0.7708 0.6999 0.3542 0.3542 1.5954 2.0798 1.3940 2.0574 1.1289 1.0462 0.6330 1.0239 0.4326 0.6633 1.3761 1.1293 0.3542 1.1520 1.3749 1.0824 0.3542 0.3542 0.9580 0.3542 0.9403 1.2586 0.8625 1.4563 1.5749 0.9458 1.8018 1.1887 1.3454 1.1524 0.3542 1.4747 0.9933 1.6267 1.3363 1.1451 1.7828 0.9121 1.1912 1.2463 1.3651 1.0179 0.5737 0.3542 0.9111 1.1759 0.8145 0.9802 0.9587 1.2560 0.9711 1.3444 0.8768 1.5270 1.0812 1.3099 1.2122 0.3542 1.0053 1.2426 1.2406 1.1029 1.1083 0.7745 1.3537 1.0338 1.1920 0.8397 caprate (10:0) 1.2681 0.9091 0.5420 0.8525 1.0223 1.0907 1.2060 1.0039 0.5696 0.9391 0.8492 1.1860 0.9748 1.5424 0.9511 0.8652 1.3785 1.3352 0.6484 1.6774 0.9537 1.6072 1.4305 1.0075 0.8474 1.0442 0.6411 1.2012 1.2026 0.8522 0.7017 0.9931 0.7917 0.9364 0.9857 1.3558 1.0799 1.2119 1.0000 1.0761 1.0433 0.6989 0.7864 0.7603 0.7825 1.1970 0.8972 0.9409 0.5891 1.0203 0.9180 1.1266 0.8729 0.8587 0.7894 1.0174 1.0886 0.6080 0.6376 1.1853 0.8054 0.8850 0.9531 0.7594 0.8819 0.8920 0.8289 1.0069 0.8851 0.7533 0.8587 0.8034 0.8817 0.7937 0.8535 0.8479 0.7940 1.0950 1.2985 0.7483 1.0782 0.4366 0.9938 0.9124 1.1460 0.7944 0.8370 0.7752 0.9302 0.9003 0.9637 0.9826 0.9808 1.2563 1.3350 1.1423 1.2204 1.2822 0.9466 0.9451 1.0981 1.1928 1.1816 1.0218 0.9236 0.8990 0.9244 0.5966 0.7933 1.1964 0.9411 0.6092 1.0804 0.9619 1.0992 1.9221 1.5975 1.4354 1.4733 1.2077 1.0263 1.4042 1.2189 1.4174 0.9469 1.0214 0.5622 0.9664 0.8657 1.2386 1.2725 1.2842 0.8855 1.1467 1.2135 1.1984 0.6692 1.3979 1.0797 1.5322 1.2997 0.7931 1.6386 1.1687 0.5916 1.2759 1.4419 0.9142 1.0534 0.6889 1.3535 0.8598 1.2350 0.9579 1.1679 1.3401 0.9831 1.1214 1.4032 1.0485 1.2676 0.9068 1.1226 0.7920 0.9143 1.0342 1.0405 0.5688 1.1876 1.1120 1.0763 0.5881 1.3898 1.6307 1.3151 2.1628 0.9489 0.5324 0.7902 0.8557 1.0801 1.1681 1.2764 0.7689 1.2396 1.2400 1.1404 caproate (6:0) 1.0557 1.0745 0.7426 0.9271 0.8417 1.0811 1.8159 1.6088 1.3230 1.1155 1.4294 1.0164 0.9681 1.0331 0.9109 2.6189 1.0690 1.0536 1.1038 1.4820 0.9125 1.3401 1.2488 0.9974 0.9137 0.9286 0.7600 1.0557 1.3631 0.9024 0.7601 0.9629 1.0919 1.0279 1.0498 0.9493 1.0239 1.2650 1.0071 0.6735 0.9464 0.7618 0.9132 1.1714 0.9003 0.9987 1.0614 1.2255 0.6327 0.9454 0.8542 0.8092 0.8069 0.9600 0.8588 0.9447 0.9115 0.8047 0.9019 1.1158 0.5819 0.7305 0.9277 0.7480 1.0102 0.9770 0.8733 1.3648 1.0065 0.9345 0.7421 0.7883 0.8300 0.9173 3.2855 0.8829 0.9317 0.9819 0.7528 0.7854 1.1659 0.8185 0.9820 0.9565 1.1545 1.0000 0.8892 1.0253 0.9374 1.1987 0.9687 0.9893 1.0559 1.3088 0.9219 1.0428 1.5579 1.2107 1.1283 1.0776 1.1351 1.0014 1.0158 0.8664 1.0010 1.5767 0.7862 0.8492 2.3514 1.4888 1.0153 1.1028 1.2815 1.1480 1.1858 1.4984 1.2781 1.0430 1.1095 2.3578 0.9986 1.3963 1.4484 0.9730 0.8624 0.8403 2.5736 0.9983 1.0248 1.1865 0.8666 0.8448 1.8957 1.0290 0.9614 0.9790 0.8895 0.9872 1.1232 0.9784 1.1658 0.8709 1.0924 0.9318 0.8367 1.1334 1.0341 1.0011 0.9735 0.8097 1.1958 0.9727 1.2701 0.9748 1.0623 1.1230 1.0205 1.0140 1.1886 0.8534 1.2214 0.8335 1.0556 0.9718 1.0602 0.8312 0.9197 0.6981 0.7032 0.9520 0.8915 0.7335 1.1788 1.0996 1.1763 1.3590 0.9732 0.8310 0.8757 1.0484 1.0708 1.1308 0.9614 1.2003 1.0951 0.8922 0.9786 catechol sulfate 1.3231 0.8042 0.6061 0.2818 0.8286 1.0310 0.7445 0.9570 0.3080 1.5268 0.9510 1.0280 0.7897 0.7234 1.1399 0.5693 1.0591 0.7283 0.5997 0.7022 1.1904 1.0661 1.4535 1.1989 0.6956 0.7883 0.5983 1.3794 1.1287 1.4384 0.6908 1.1200 0.2683 1.4942 1.5534 0.7863 1.9666 1.5809 1.2042 1.3089 1.6508 1.3105 1.3877 1.2360 1.2945 1.1408 0.9374 1.4328 0.7756 0.8686 1.1621 1.3408 0.6545 0.5852 0.1367 0.2560 0.7050 0.3203 0.5652 0.9175 0.7500 0.8484 1.1109 0.6396 0.7513 0.8349 0.8799 0.5066 0.6035 0.3393 0.5384 0.6347 0.5360 0.6733 1.0801 1.1081 1.7471 0.4862 1.2554 1.0526 0.8350 0.7705 1.7331 0.4959 2.0329 1.2162 0.8693 1.4320 0.9422 0.5043 1.4952 1.2175 1.1553 0.8224 0.8893 1.0746 0.4286 1.4240 1.0941 0.8775 0.5301 1.2294 0.6310 0.5123 0.7969 1.2265 0.7551 0.6226 1.3119 1.3841 1.6628 0.7307 1.2193 1.2752 1.3917 0.9727 0.7695 0.5605 0.8037 1.5851 1.3214 1.6043 0.8144 1.7904 0.4066 1.3656 0.7136 1.2756 0.4519 1.3464 0.9198 1.2492 0.5668 1.1410 0.9851 0.5547 0.4662 1.1775 0.9106 0.6014 0.7880 1.3303 1.0099 1.6922 0.9633 1.9735 2.0168 1.0081 0.7617 0.9824 0.9775 0.9481 1.9775 1.4729 1.7792 1.3368 1.2201 0.6571 1.3719 1.9619 1.0149 1.3783 1.5893 1.6479 2.2215 0.8597 0.7158 1.0356 1.9325 2.1033 0.6142 0.5849 1.5344 0.9918 1.0110 0.9734 1.0000 1.1247 1.0923 1.5049 1.0671 1.6691 0.3575 0.7860 1.7784 0.9240 1.3610 C-glycosyltryptophan 1.1959 1.1298 0.8828 0.8682 0.7645 0.8957 1.1624 1.1765 1.2161 0.9712 1.0140 1.0929 0.8863 0.9347 0.9074 0.9272 1.0929 0.6545 0.8509 0.6619 0.7341 0.9085 1.0577 1.0209 1.0249 0.8252 0.8166 1.0342 1.0834 1.2539 1.1720 1.3426 0.7861 0.9434 0.8212 0.9538 1.1125 1.1635 1.1009 1.0060 1.1585 1.3398 1.2264 1.1307 1.2489 1.3016 1.2243 0.9248 0.8814 0.7395 0.7703 0.9236 0.7517 1.2651 0.9649 1.0492 1.3285 1.1643 0.7453 0.7963 0.9754 0.8485 0.8760 0.7259 0.9354 0.9076 1.0976 1.0351 0.8647 1.1157 0.9256 0.9746 1.2658 1.1829 1.2087 1.0882 0.9824 0.8894 0.9690 0.9035 1.0420 1.0928 1.1161 0.9696 1.4414 1.1992 1.1884 1.1907 1.1410 1.2188 1.2170 1.1945 0.9831 0.7383 0.7912 0.9504 1.0116 1.1647 1.0715 1.0939 1.2510 1.0536 1.1062 0.6766 0.7545 0.8357 0.7854 0.7408 0.9854 1.1414 1.3995 1.2936 1.0057 0.8838 1.0445 0.9346 0.7488 0.9000 0.7111 1.0400 0.9934 0.9876 0.9560 0.9472 0.6508 0.8628 0.8027 0.8733 0.7561 0.6103 0.7923 0.7203 0.7358 0.9385 0.7770 0.8984 0.9681 0.9171 1.0904 0.8000 1.1192 0.7214 0.7733 0.7880 0.6535 1.0288 0.7644 0.9288 0.9433 1.2187 1.3655 0.8386 1.3098 1.0490 0.8992 1.0553 1.0066 1.1968 1.0112 1.1676 1.3589 1.1999 1.1719 1.1702 1.1661 0.8306 0.7365 1.1241 1.1176 1.0825 1.0784 1.2543 1.5832 1.2110 1.0000 1.6717 0.9118 1.0353 0.9084 1.0743 0.7377 1.1103 1.1313 1.0797 1.3437 0.9194 0.7665 chenodeoxycholate 1.0704 0.0466 0.0466 0.8126 0.7832 0.6991 0.7108 0.6297 0.0466 0.6016 0.7691 0.9805 3.3031 1.5988 1.3757 2.7589 6.1783 0.2672 0.2585 0.6373 0.7804 0.3707 0.0466 3.3400 1.1925 0.9898 0.9148 1.0523 2.5588 3.4037 0.0466 1.4377 2.9135 1.1215 1.0120 2.2809 2.1662 2.0167 2.2769 2.4510 0.8442 0.0466 0.0466 0.3635 0.1096 0.0466 0.0466 0.0466 0.0466 0.7166 0.0754 0.7055 0.0466 0.3491 0.3126 0.0466 0.0466 0.0466 0.0466 2.8260 0.0466 0.0466 0.0466 0.0466 0.0466 0.0466 0.0466 0.0925 0.0466 0.4025 0.0466 0.0466 0.7418 0.0466 0.9323 1.9780 1.4194 0.9049 1.8425 1.0889 1.2013 0.0626 0.3970 0.2961 0.0466 1.0164 1.8913 1.3810 2.7649 1.3745 1.5253 1.6536 1.2256 0.8808 1.0000 0.7432 0.5366 3.2675 1.9097 2.5598 3.0669 2.9730 3.3981 0.0466 0.0466 0.0714 1.2961 0.0466 0.0466 0.0466 0.4084 0.5324 0.0466 0.0466 0.0855 1.0248 0.8783 0.0466 0.7870 0.0466 0.1345 0.8488 0.0466 0.1284 0.0466 0.7640 0.0466 0.4286 2.5814 0.0466 0.0466 0.0466 0.6611 0.0466 0.0466 2.5773 1.4577 1.7699 2.5307 1.7366 1.8191 0.0466 6.4719 0.7651 0.0466 0.8165 0.0466 5.1693 5.2923 1.6314 3.9378 2.0162 4.7363 0.0466 0.8617 0.8660 0.9481 0.0466 0.0466 0.0466 0.0466 0.0466 0.0466 1.0305 0.9167 0.8123 0.0466 0.9697 0.5264 2.5134 1.1559 0.9836 0.9643 0.6728 0.9005 1.6187 0.7571 0.8125 0.0466 1.0983 0.5865 0.5102 4.1032 0.0466 2.4556 0.0466 1.4349 cholate 0.4037 0.4315 0.5936 0.8196 0.7405 0.5244 1.3383 1.0774 1.1944 1.3981 1.2675 0.9640 5.3310 1.0770 3.3296 5.4141 11.7794 0.3700 0.5786 1.8374 1.3084 1.0352 0.5618 1.0322 0.8223 0.4897 0.8437 0.6863 1.4537 0.8754 0.8496 0.5451 0.8498 0.9023 1.1849 1.5793 1.3961 1.0993 1.1583 1.3337 0.8781 0.6594 0.3618 0.9270 0.3596 0.9310 0.4944 0.9372 1.0000 1.1093 1.4475 1.0468 1.4155 1.0503 0.6911 0.8507 1.0473 0.8783 0.9749 6.0586 1.5299 2.4951 1.7099 1.6019 0.3633 0.4701 0.3380 0.3881 0.2267 0.8212 0.7394 0.8267 0.9889 0.8976 1.1010 1.6416 1.1524 1.2407 1.2732 0.8646 7.5096 0.2244 1.0581 0.8460 0.2134 2.7648 1.8386 1.4786 5.7178 1.1144 1.0127 1.3003 0.7149 0.6765 0.9425 0.6898 0.6275 1.1164 0.9888 1.0708 1.2959 1.0057 1.1658 0.7481 0.5142 0.8149 0.6239 0.6996 0.6976 0.9576 0.6197 0.5596 0.5185 0.8058 1.1071 0.6369 0.7722 0.6239 0.5248 0.5011 0.2134 2.8235 0.4611 0.2134 0.5990 0.7734 0.4231 0.6925 5.5796 1.7593 1.4130 0.8340 1.5026 1.8544 1.7960 9.9482 0.9913 1.1111 2.8324 1.3328 1.2515 0.8269 23.9586 0.9123 0.7188 0.4573 1.4321 16.8341 7.3786 1.4517 3.2739 1.8453 3.2800 0.9021 0.9792 0.8463 2.3300 0.9589 1.3037 0.8296 1.2072 0.9943 1.3538 2.2506 1.5544 1.3889 0.2812 1.0075 1.0862 2.0694 0.5849 0.5418 0.5191 0.6567 0.4336 0.4512 1.3605 1.1070 1.5158 1.4420 1.1618 1.7162 2.0842 1.3789 1.6081 0.9894 1.1000 cinnamoylglycine 0.1449 0.1449 0.1449 0.1449 0.1449 0.1449 0.5688 1.1426 0.1698 0.6270 0.5355 1.9926 0.7871 0.4758 1.1689 0.5068 1.6578 0.1449 0.1449 0.1449 0.1449 0.1449 0.1449 1.2356 1.9281 0.5686 0.6618 1.3784 0.8552 0.9095 0.3611 0.6857 0.1449 0.1449 0.8941 1.9810 1.0000 1.2402 0.6581 1.6186 0.9178 2.6977 2.6251 2.4092 1.7077 2.4741 2.6033 2.3317 0.5243 0.7133 1.0546 2.3747 0.4496 1.5061 0.4948 1.0157 2.6485 0.6697 1.0420 2.5215 3.1775 3.5238 3.6993 3.1217 0.1449 0.1449 0.1449 0.1449 0.1449 0.6294 1.5649 1.5998 0.9874 2.5209 2.2575 2.3377 2.5435 4.1930 4.1570 3.5824 0.2584 0.1449 0.3217 0.3963 0.9425 1.1147 1.0379 0.7331 0.8844 0.6407 0.8633 0.7033 0.3544 1.0495 1.0000 0.6139 0.5593 0.3710 0.2627 0.1449 0.7234 0.3215 0.3359 0.2999 0.3323 1.2070 0.4629 0.4826 1.8457 1.3991 0.7654 0.1658 1.5738 1.3132 1.0605 0.6244 0.9938 1.0669 1.4480 12.4531 14.5957 12.9225 4.6762 7.8164 1.4485 2.9461 0.5997 2.0149 1.2153 2.4219 3.5934 3.1274 0.6762 2.8356 5.2258 1.4033 0.2203 0.7772 1.4198 0.9269 0.7184 1.3152 1.2052 0.9595 0.6492 3.3195 1.0000 0.1449 0.1449 0.1449 0.2621 0.1449 0.2054 0.1449 1.7014 0.6010 1.8677 1.1876 0.9634 0.3095 0.9984 0.4791 0.7447 0.7005 0.9209 0.9913 1.5871 0.2873 1.9577 2.0686 0.5889 0.3567 2.7056 1.9681 1.1829 0.9088 0.7614 0.2353 0.4700 1.5864 0.7373 0.1563 0.1449 0.1449 0.1449 0.1449 0.1449 cis-4-decenoate (10:1n6)* 2.1950 1.3252 0.2297 1.4369 0.8503 0.7002 1.0416 0.9539 0.2475 0.5321 0.6413 2.0918 1.0517 1.0523 1.2842 1.5540 1.6937 0.9817 0.2120 1.5799 0.5319 1.2320 1.2356 1.1926 1.1126 0.6783 0.4354 1.1756 1.4459 0.7508 0.3936 0.9415 0.8340 1.0446 0.6684 1.5286 0.8056 1.1808 0.9225 1.0959 1.1331 0.6157 0.5764 0.4985 0.6570 0.8766 0.9658 0.8651 0.3932 0.8629 0.9954 1.2483 0.8784 1.1729 1.0654 0.9807 1.1184 0.1562 0.2843 0.9184 0.8745 1.0969 0.7306 0.8868 0.9621 1.0343 0.8471 1.4179 0.8232 0.5046 0.5238 0.3376 1.0205 0.7246 0.5887 0.5704 0.3819 0.7152 0.8974 0.2872 1.0946 0.1427 0.6776 1.0782 1.4355 1.0323 1.0893 0.9710 0.8781 1.2572 1.1048 1.6337 0.6554 0.9819 1.3792 1.1793 1.2556 1.2677 1.0056 0.9800 1.4275 1.0980 1.3042 1.1197 1.1810 1.0743 1.2375 0.3136 1.0519 1.3320 0.7553 0.4110 1.0698 0.9469 1.2125 2.0619 1.4813 1.4224 2.0761 0.9770 1.0891 1.6422 1.0429 1.5806 1.0429 0.9944 0.2014 0.9742 1.1853 1.0246 1.5337 1.0774 0.5946 1.4404 1.4909 1.3249 0.9214 1.3979 1.6107 2.6594 2.9575 1.0087 1.3907 0.7613 0.4307 1.5447 1.0000 1.5368 1.5132 1.3949 4.2201 2.0065 2.6092 0.8798 0.7352 0.8642 0.7466 1.1824 1.2805 1.0552 1.8214 0.8099 1.2282 0.7725 0.8296 0.3200 0.3177 0.0910 0.4908 0.2459 0.6827 0.1050 0.4920 0.7462 0.3202 0.8970 1.7611 0.3885 1.5124 1.5613 1.8303 0.5384 0.9185 0.3923 1.0316 0.6901 0.5374 citrate 1.1284 0.9709 0.8000 1.1634 1.0027 0.8836 1.1499 1.1424 0.9633 0.9684 0.9646 1.1154 0.9894 1.0224 0.9730 1.0045 1.0825 1.0358 0.7267 1.1019 0.9171 1.1001 1.0227 0.8890 0.8705 0.7728 0.7721 1.0447 0.9777 1.0060 0.9890 0.9981 0.9967 0.8845 0.9977 0.9743 0.8832 0.9735 0.9332 0.7780 0.9857 0.9308 0.8408 0.9643 0.8959 0.9234 0.9041 0.9960 0.9364 1.0012 1.1653 1.0620 1.0561 0.9138 0.9790 0.9711 0.9734 0.7709 0.6929 0.9056 0.9492 0.9140 0.9116 0.9047 1.2308 1.4000 1.2494 1.3617 1.3635 1.1858 1.3519 1.1565 1.1418 1.4050 1.3625 1.2078 1.1956 1.3687 1.0991 1.0015 1.1970 0.8007 0.9554 1.0013 1.0757 1.0984 0.9404 1.0211 1.0615 1.1727 1.0483 1.0539 0.9544 0.9961 0.9753 0.9998 1.0295 1.1498 1.0007 1.0367 1.1199 1.1705 1.1028 1.2415 1.2356 1.0012 1.3574 0.8882 1.0932 1.0640 0.9455 0.8074 0.8995 1.0015 1.0689 0.9452 1.1572 0.9189 1.0751 1.3116 1.2767 1.2513 1.4237 1.3101 0.9683 0.8793 0.7451 0.8358 0.9612 1.0400 1.0002 0.8685 0.7531 0.8968 1.0708 0.8615 0.8570 0.9634 1.0414 0.9472 0.9514 1.0185 0.9514 0.9281 0.7656 1.1183 1.0469 0.9632 0.9783 0.9526 1.0791 1.0472 1.1377 0.9796 0.9677 1.0462 0.9971 1.0633 1.0025 0.9858 1.1001 1.0286 0.9721 1.0552 1.0063 1.0645 1.0546 0.8136 1.0843 1.0768 0.9547 0.7777 1.0019 1.1025 0.8741 1.1540 0.9466 0.8548 0.9430 1.0000 1.1246 0.8593 1.1408 0.7135 0.8986 1.0231 0.9119 cortisol 0.9786 1.1910 0.7876 1.3944 1.1460 1.4021 0.7582 0.7000 2.3328 1.0245 0.9359 0.4511 0.7295 0.7817 0.7617 0.8489 0.8931 1.3040 0.8914 0.9106 0.8708 1.3407 0.8365 0.9708 0.8572 1.0880 0.6435 1.0441 1.0190 0.9721 1.7489 0.8746 1.2633 1.0146 1.4736 0.4970 0.8323 0.9402 1.1775 0.8058 1.0795 1.0070 0.8873 1.0106 0.9934 0.9787 0.4347 1.0280 2.1525 1.7848 0.9544 0.8753 1.2533 0.6323 1.0664 0.3019 0.4452 1.7166 0.5297 0.9722 1.1322 1.0025 1.0063 1.3142 1.2631 1.2486 1.5808 0.3986 1.1777 0.7659 1.5813 0.9461 1.0717 2.1191 1.5133 1.4993 1.0535 0.4701 1.3168 1.2232 1.4463 0.9426 1.2599 1.1131 1.0835 0.8832 1.0186 0.6683 0.9574 0.5175 0.8679 1.0577 1.1028 1.3291 0.6888 0.6606 0.5284 1.2517 1.1343 1.3213 0.8307 1.3851 0.9573 0.6839 0.9394 0.7531 1.0670 0.6225 0.6728 1.2220 1.4263 1.2500 1.4179 1.0124 1.1448 1.1956 1.1732 0.8382 1.0666 1.0870 0.9288 1.3128 0.7609 1.0948 1.1747 0.6584 1.1645 0.9975 0.9205 1.0268 1.4833 1.3183 0.5850 0.9954 1.2216 0.9234 0.6759 0.8603 0.8684 1.0226 1.0454 1.6677 1.3664 1.1743 0.9133 1.3981 1.4591 0.7090 0.6212 0.6112 0.6069 0.5728 0.7042 0.5974 0.8939 0.8198 0.7948 0.3152 0.8374 1.0886 0.6139 0.6991 0.9126 1.0570 0.8576 1.3158 1.1437 1.9019 0.9257 1.1863 1.2324 0.8927 0.8995 1.0775 1.0426 1.0000 1.1251 1.3948 0.7393 0.8730 0.9061 0.9124 1.4738 1.2291 0.6262 1.0481 0.6660 cortisone 1.1497 0.9988 1.1432 1.0827 1.0568 1.1227 0.9239 0.7559 1.0909 0.8536 1.0205 0.6424 0.8779 0.9082 0.9135 0.8997 0.9447 1.0334 1.1898 1.0597 1.1925 1.2657 1.0469 0.9737 1.0422 1.1197 0.9507 1.0731 0.8078 0.8698 0.8883 1.0487 0.8834 1.0049 0.9046 0.6638 1.0263 0.9247 1.1014 0.8525 0.9020 0.9962 0.9962 1.0415 0.9999 1.0991 0.5863 1.0510 1.2247 1.1991 0.8160 0.9745 1.0139 0.8346 0.8100 0.3633 0.8017 0.9192 1.0061 1.0784 1.0299 1.1360 1.0392 1.0279 1.1948 1.1153 0.9864 0.4503 0.9070 1.0174 1.2071 1.0151 1.1462 1.2650 1.0647 1.1226 1.2787 0.8012 1.1214 1.0158 1.0185 0.8638 0.9314 0.9705 1.1407 0.9479 0.9817 0.8734 0.9995 0.5932 1.0297 1.0005 1.4290 1.3993 1.0225 1.0892 0.8301 0.8789 0.8066 0.8429 0.7270 0.9415 0.8816 1.2994 1.3081 1.4356 1.3956 0.9932 1.4281 1.0118 0.9885 0.9735 0.9515 0.9091 1.0024 0.6376 0.8254 0.9691 0.8434 1.1203 1.1294 1.3374 1.0397 1.1783 1.0833 0.8045 0.9179 1.3212 0.9569 1.3058 1.4321 1.2824 1.1609 1.5085 1.2604 1.0510 0.7749 1.1745 1.1384 0.9728 1.1260 1.1807 1.3993 1.3457 0.9184 1.1930 1.0866 1.0207 0.8066 1.0000 1.0791 0.7515 0.8737 0.8237 0.9501 0.8895 0.8667 0.5873 1.1470 1.1001 0.8248 0.7924 1.2250 1.0169 0.8193 0.9018 0.7984 0.9665 0.9856 0.9591 1.0140 0.9741 0.9133 1.0540 1.0976 1.0939 1.1086 0.9695 0.8346 1.1184 0.8710 0.9464 0.8564 0.9060 0.8674 0.9173 0.6705 cortolone glucuronide (1) 1.3393 1.0565 0.8727 0.9673 1.0356 1.0518 0.7461 0.6266 0.4721 0.6692 0.8626 0.8345 0.8636 0.7241 0.8874 0.8557 1.0000 0.6949 0.7112 1.0324 1.0125 0.8910 0.9165 1.1966 0.7744 1.0023 0.8179 1.1275 0.8756 1.2046 1.0854 1.1826 0.9147 1.1800 0.9918 1.1455 1.5968 1.6471 1.2810 1.6135 1.1835 1.3661 1.5980 1.3069 1.4390 1.2557 1.1662 0.7990 0.8328 1.2629 0.9600 0.9167 0.6013 1.2274 0.9647 1.2761 1.7605 1.4244 0.8442 0.6859 0.8517 0.6741 0.7367 0.5771 1.0953 0.9697 0.9589 0.6508 0.9065 1.2720 1.0085 1.0180 1.0663 0.9623 0.9565 0.9385 0.9315 0.5635 0.7075 0.7333 0.9304 1.1806 1.1090 0.9832 1.2487 1.1104 1.0301 1.0343 0.9498 1.0861 1.0433 1.0592 1.1015 0.8699 0.7323 1.0542 0.6753 1.2809 1.3057 1.3117 1.0520 1.5692 1.6947 0.5364 0.4326 0.3484 0.3864 0.4389 0.4466 1.4599 1.6996 1.4995 1.4485 1.5448 1.3216 0.6034 0.5078 0.6417 0.5106 0.5390 0.5865 0.8184 0.6962 0.7604 0.7700 0.8925 0.8242 1.1948 1.0667 0.9059 1.5140 1.0195 1.2874 1.2972 0.9943 0.9694 0.8196 0.9100 1.1537 0.8474 1.3246 0.8998 0.9391 0.8008 0.7235 1.0068 0.9242 1.2365 1.4429 1.2826 1.7856 1.4017 1.5413 0.9138 1.1999 1.0417 1.0322 1.0226 1.3446 1.2743 0.9977 1.3497 1.0693 0.9523 1.2544 0.6975 0.7516 0.8480 0.9186 0.6940 1.1193 1.2240 1.2517 1.2542 1.2965 1.4990 1.0524 0.9728 1.1442 1.4855 1.2759 0.9734 0.7864 0.9593 1.2483 0.8388 0.7628 daidzein sulfate (2) 1.1489 0.8511 0.1441 0.6475 1.4494 1.4779 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 0.1441 dehydroepiandrosterone sulfate (DHEA-S) 0.9136 0.8013 0.8212 0.6158 0.6057 0.7470 0.2662 0.2593 0.3682 0.2539 0.2976 1.4789 1.3121 1.0571 1.2129 1.2383 1.3170 0.9765 1.6823 1.5011 1.4849 1.3180 1.6162 0.2319 0.2480 0.2793 0.2678 0.3465 0.2418 0.9564 1.2210 1.0454 0.7930 1.1377 0.9452 1.6604 1.4843 1.4606 1.3330 1.3161 1.1957 1.4080 1.4265 1.1959 1.4503 1.3739 1.4843 0.5745 0.8020 0.7695 0.6279 0.6138 0.5736 1.3224 1.0956 1.0800 1.3632 1.5909 2.6675 2.0235 2.4182 1.9092 2.2392 1.8643 0.8655 0.8194 0.7823 0.8977 0.6483 0.6682 0.6207 0.5750 0.6130 0.6366 0.5580 1.0421 0.9895 0.9001 0.9527 0.9820 0.9885 1.0386 1.0068 0.8780 1.0347 0.8794 0.8230 0.7290 0.8349 0.8482 0.8007 0.8553 1.3409 1.2189 1.0756 1.2025 1.3056 0.7171 0.6157 0.6304 0.7037 0.7255 0.7071 0.6583 0.8448 0.9888 0.7081 0.9178 1.0806 0.9972 1.1024 1.3174 1.0366 0.8167 0.8393 0.2203 0.2366 0.2285 0.2135 0.7030 0.9146 1.1132 0.9891 0.9396 1.0109 1.1246 1.5251 1.5746 1.2788 1.1139 1.6448 1.3144 1.5359 1.5794 1.2176 1.0290 1.3974 1.2909 1.0490 0.9024 1.3521 1.0000 1.0002 1.1462 0.9948 1.3250 0.9069 1.6444 1.2889 2.3762 2.4078 1.2838 2.0704 1.1973 1.2880 1.2788 1.2710 1.3155 1.5180 0.5226 0.5439 0.4379 0.5059 0.4783 0.5898 0.4662 0.4525 0.7706 0.5927 0.4774 0.4928 0.5752 0.3831 0.4820 0.5552 0.5368 1.9969 2.1404 2.2382 1.7648 2.2562 1.5699 1.5592 1.9499 1.9064 1.4194 1.1111 delta-CEHC 0.7670 0.4793 0.4793 0.5361 0.4793 0.9762 0.9142 0.4793 0.7102 1.2675 2.5541 1.3170 1.3996 1.9192 1.3811 2.4423 1.6759 0.4793 0.4793 0.8329 0.4793 0.4793 0.4793 0.8440 1.0000 1.5640 0.4793 1.4792 0.9634 0.9743 0.7087 1.0500 0.8419 1.1845 0.8176 0.4793 0.6569 0.7907 0.4793 1.3816 0.8250 1.0459 0.9383 0.8039 0.4793 1.9747 0.4793 1.2716 0.4793 1.8256 0.9325 1.2286 0.4793 0.6883 0.6280 1.9445 1.1259 0.4793 0.4793 2.2333 1.1424 1.5917 1.1363 1.2413 0.7238 0.8091 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.8661 0.6742 0.8915 0.7517 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.4793 0.7964 0.4793 0.4793 0.4793 0.8888 0.4793 0.8892 0.4793 1.1817 0.7750 0.6733 1.8166 1.0165 1.3822 0.4793 0.8996 0.4793 0.7239 0.4793 1.1133 0.4793 0.4793 0.4793 0.4793 0.6878 0.6091 0.9187 1.7802 0.8099 0.4793 0.4793 0.7050 1.0449 0.4793 0.9728 1.8446 1.0943 0.4793 1.8822 0.4793 0.7181 1.1624 0.9842 0.4793 0.4793 0.9760 0.6944 1.0156 0.9792 1.6937 0.8453 0.4793 1.0603 1.3754 1.7615 2.1679 0.6487 1.3852 1.3791 1.2943 0.8483 1.0497 1.1356 1.8806 0.5098 1.2029 0.9386 0.4793 1.0317 0.8640 0.7070 0.4793 1.4769 0.4793 0.8327 1.5109 1.1579 1.0073 0.6415 1.1077 1.9825 1.6328 1.5446 0.6598 0.4793 0.5945 0.4793 1.1289 0.9927 0.9827 0.4793 1.2370 0.7833 0.7874 deoxycholate 1.7621 1.8908 0.4258 0.4155 1.0840 0.8513 2.3570 2.0212 0.9632 1.3882 1.1333 1.9171 5.2876 2.4442 4.0767 4.4879 7.8791 0.4632 0.2496 0.7002 1.1684 0.6377 1.2214 1.9167 1.8724 0.7727 0.6286 1.0981 1.2573 2.1574 1.0319 2.0058 0.8614 0.5435 1.5031 1.2472 1.5903 1.1724 0.7740 1.4266 0.7211 1.8281 2.1421 2.4339 1.4985 2.7819 0.9361 0.4283 0.1239 0.5178 0.7585 0.4329 0.4103 0.2679 0.0644 0.1041 0.7221 0.1990 0.3472 2.3550 1.0453 1.1534 1.2510 0.6821 0.8199 0.7080 0.4833 0.4363 0.5157 0.2866 0.4874 0.7685 0.6790 0.6020 1.3745 3.3853 3.3148 1.6160 3.0678 1.4578 0.5981 0.3605 0.4896 0.3628 1.2717 1.0000 2.1576 1.3974 2.2050 0.8427 1.8588 1.7647 0.7425 1.0595 1.0185 0.8642 0.3856 5.0693 3.4689 2.5260 2.4170 3.5254 3.4782 0.8612 0.9673 1.0533 0.9906 0.3972 1.9784 1.1387 1.2807 0.5489 0.6437 0.4300 0.7103 0.7945 0.8096 0.3362 0.4547 0.1935 0.2630 0.5688 0.0847 0.1239 0.1887 0.7047 0.2192 0.5465 0.8541 0.6052 1.2180 0.6027 0.3219 0.9815 0.7963 3.1542 1.1966 1.9333 2.5270 2.3495 2.1590 0.3774 1.5601 0.6247 0.2152 0.6402 1.3992 2.1689 3.1720 0.7895 1.7785 1.8067 2.9851 0.9237 1.9809 2.5603 1.7365 1.1359 1.6088 1.8817 2.0403 1.9892 2.2481 4.3156 3.5228 0.9212 0.4928 1.4408 2.1719 3.6585 0.7367 0.8547 1.3506 0.8965 1.2506 1.4880 0.1328 0.1846 0.1737 0.8799 0.2968 0.5218 2.3713 0.6119 1.7458 0.3956 0.8802 deoxycholic acid (12 or 24)-sulfate* 1.3083 1.5710 0.3705 0.2271 0.8011 0.6438 1.2625 0.8900 0.6324 1.0818 0.6719 0.8778 0.8880 0.7564 1.0060 0.7762 0.8506 0.2271 0.2271 0.2271 0.4060 0.2271 0.6207 1.2731 2.2129 0.7544 1.0830 1.1887 1.4502 1.9679 3.9450 2.0041 0.7996 0.4872 2.3643 1.2230 2.1482 0.8933 0.7407 1.1817 0.9712 1.1425 1.1003 1.4351 0.9940 1.3232 0.5519 0.8674 0.5579 0.9436 1.2008 0.8668 0.2271 0.2271 0.2271 0.2271 0.7763 0.2271 1.4951 2.4282 1.5376 1.3322 1.6637 1.0000 0.5778 0.3243 0.2271 0.2271 0.4104 0.2271 0.2271 0.8458 0.2271 0.2849 0.5118 1.7659 2.1858 1.2173 2.2486 1.0913 0.2271 1.1203 0.2271 0.2271 1.3891 0.5272 2.0985 1.3296 1.1652 1.2917 3.0394 2.7727 0.7938 1.3235 1.1069 1.0952 0.7801 0.9497 1.2470 0.4992 1.2170 0.6830 0.6876 0.2271 0.4515 0.2271 0.2271 0.2271 0.2271 1.1260 1.3510 0.6314 1.3300 0.5295 0.6991 0.2271 0.2271 0.2271 0.2271 0.4358 0.4294 0.5625 0.2271 0.2271 0.4399 1.3045 0.6598 0.7533 0.5930 0.9315 1.5384 0.9790 0.8457 1.4316 1.0702 1.4308 1.5537 0.9901 1.6451 1.6354 1.8201 0.2271 0.2271 0.7412 0.2271 0.9266 3.0726 5.1357 7.2121 4.8518 4.7981 7.4187 6.2896 0.4165 0.8749 1.6442 0.6711 0.6043 0.9024 0.8962 1.2497 0.8438 0.9654 1.8806 1.2283 0.3653 0.4565 4.9391 2.1508 1.3610 0.2271 0.6864 0.4117 0.4362 0.6161 0.5254 0.2271 0.7222 0.2271 0.9532 0.4540 0.9443 1.5466 2.8224 3.4901 1.2713 1.9499 deoxycholic acid glucuronide 0.7397 0.7240 0.4847 0.1293 0.4802 0.7655 0.6501 0.6701 0.7028 0.4162 0.4906 0.4963 0.5360 0.3594 0.5334 0.6829 0.6846 0.1293 0.1553 0.2497 0.1293 0.1293 0.1930 3.1037 1.3841 1.4096 1.7399 1.2497 1.8100 4.6803 2.9693 2.8205 2.2427 2.3622 1.7295 0.8092 0.8910 0.7207 0.6132 0.5938 0.4943 2.3219 1.9874 1.6959 1.2617 1.7834 0.9736 0.1293 0.1293 0.5146 0.3347 0.1293 0.2912 0.4698 0.1293 0.3238 0.6421 0.5098 1.2347 1.5740 1.5010 1.2406 1.9563 1.3940 0.4115 0.3387 0.2817 0.3062 0.2859 1.0325 0.5173 1.2470 1.2513 0.9592 1.5702 3.7597 4.2731 3.3486 4.1212 2.8839 0.8207 1.7590 0.9990 0.7533 1.8861 1.7361 0.5877 0.5225 0.7149 0.3750 0.5101 0.4130 0.9173 0.5484 0.7310 0.6426 0.4742 2.1996 1.6772 1.6027 2.1238 2.1279 2.1577 0.2984 0.5330 0.3795 0.3098 0.3426 0.4187 1.2356 1.0044 1.4362 0.9336 0.5790 1.1201 0.8589 0.7111 0.6655 0.4725 1.3198 1.1590 2.3306 0.4353 0.6444 0.4512 2.5603 1.2814 1.5704 1.3013 0.7076 0.9954 0.8095 0.8757 0.9455 0.7341 2.3277 1.5932 2.0041 2.0765 1.4222 1.3130 0.7807 2.1093 1.0308 0.7604 1.0010 2.0357 6.8054 5.9603 6.6916 6.7923 5.3122 6.3871 0.5816 1.0046 0.9737 0.8446 0.6578 0.8428 1.4850 2.2740 1.5475 2.1114 2.4462 2.2935 0.4968 0.1293 1.0843 0.6014 1.0331 1.1655 2.2215 2.3280 1.5128 2.6988 2.2680 0.1293 0.6100 0.2940 0.7481 0.6704 1.9341 1.8451 2.0421 2.5603 1.0229 1.6677 desmethylnaproxen 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 1.0000 0.8953 2.3115 1.0598 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 0.6940 1.0000 0.6940 0.6940 0.6940 0.6940 0.6940 desmethylnaproxen sulfate 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 1.0060 0.9581 2.1668 1.0000 0.7124 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.6448 3.0869 0.9400 1.9361 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 0.3869 6.7104 0.9511 1.6688 3.1425 0.8847 1.0000 dihomolinoleate (20:2n6) 1.7638 1.0616 0.1468 1.0550 1.2155 0.3353 1.4404 1.3130 0.3138 0.9180 0.6754 1.6963 1.6208 0.6950 0.8459 0.9912 1.0419 0.9947 0.2971 2.7772 0.5170 3.3279 1.1337 0.9540 0.7052 0.8319 0.7022 3.0958 1.3260 0.5345 0.8216 0.6972 1.3880 1.5343 0.5578 5.6517 2.7898 1.6685 1.4662 1.8102 1.1199 0.8997 0.7206 0.4963 0.6686 0.6632 1.2413 0.6668 0.4262 2.3220 3.4574 2.9128 2.0521 0.7651 1.1247 1.1918 0.9410 0.2813 0.2927 0.5394 0.9142 1.1830 0.6195 1.0092 0.7775 0.6887 0.9272 2.2763 0.9690 1.1030 1.8428 0.6100 3.8092 1.6683 1.2400 0.6248 0.6138 1.6977 0.9689 0.7252 0.9502 0.1992 0.5639 1.1752 1.6867 0.7704 0.6141 0.6816 0.7378 1.5504 0.7127 1.1596 1.0026 1.0453 0.9740 1.1104 0.8478 3.0356 1.0409 0.7249 1.5190 0.7564 2.3312 0.7582 0.5569 0.6053 1.7795 0.2341 0.5923 1.7456 0.5689 0.5625 2.2915 1.0000 2.0193 4.4062 2.5281 1.1866 1.2458 1.0970 0.9099 1.6212 2.4883 1.1869 1.1554 1.0134 0.4341 1.2553 1.4893 1.0704 1.6964 1.5360 0.6853 1.3521 1.6661 0.8030 0.3268 0.7643 1.7705 1.1465 0.9603 1.8866 3.0666 0.7825 0.4030 1.2122 0.8776 0.5259 0.9592 0.6462 4.5464 0.8605 0.9344 0.9974 0.9477 1.0145 0.7913 1.5411 2.4371 0.8579 1.5676 0.4906 1.5581 0.7423 1.9900 0.9270 0.9321 1.1182 2.0894 0.4908 0.4119 0.2145 0.3869 1.0222 0.7800 1.8943 1.1575 0.2742 1.7324 1.5248 1.3447 0.6468 1.5685 0.7684 1.4033 1.5082 0.5111 dihomolinolenate (20:3n3 or 3n6) 1.7518 1.1052 0.3016 0.9301 0.9789 0.3592 1.6781 1.4389 0.6968 0.9701 0.8178 1.8505 1.9096 0.7123 1.0509 1.1619 1.2851 0.7581 0.6942 2.1376 0.3880 2.2952 1.0253 0.8600 0.8633 0.8912 1.6118 3.0219 1.4277 0.9725 1.7723 1.1167 1.5577 1.9883 0.7685 3.8246 2.6443 1.6122 1.2896 1.4580 1.0989 0.7857 0.8194 0.4454 0.7117 0.6274 1.0000 0.6106 0.8719 1.4839 2.1373 2.4250 1.6620 0.6766 0.8022 0.8457 0.9683 0.8246 0.2814 0.3794 0.6206 0.7782 0.4386 0.7218 0.8671 0.6780 0.8451 1.8457 0.6705 0.9255 1.3592 0.4696 2.6586 1.2475 1.0681 0.6059 0.5407 1.2214 0.8410 0.6847 0.8561 0.4990 0.8566 1.1763 1.5815 0.7830 0.8299 0.7213 1.1563 1.6189 0.9986 1.3298 1.0014 0.7565 0.7516 0.7667 0.8515 2.3243 1.0590 0.9777 1.4297 1.0577 2.1270 0.6675 0.5977 0.6286 1.4148 0.4351 0.6795 1.7434 0.8227 1.3131 2.7826 0.7999 2.1076 3.5392 2.1604 1.2684 1.3165 0.7387 1.1830 1.0024 1.2321 0.8700 0.6575 0.7922 0.9643 1.0218 1.2786 1.2778 1.5772 1.3938 1.0902 1.3871 1.6638 0.8966 0.5303 0.8574 1.8817 1.2327 1.1881 1.7392 2.6351 0.9300 0.6920 1.2392 0.9442 0.7556 0.9586 0.8717 3.8755 0.8560 0.9679 0.9439 0.8909 1.0583 0.8864 1.2854 2.0938 0.9795 1.7894 0.6867 1.5775 1.0379 2.2986 1.1790 0.9568 5.0719 4.4515 1.0406 0.5520 0.7475 0.5642 1.3909 1.4325 2.7583 0.7692 0.4221 1.1475 1.1144 0.9120 0.8619 1.1921 1.4077 1.5659 1.2954 0.6531 docosadienoate (22:2n6) 1.3824 1.0896 0.2574 0.9252 1.0012 0.4055 1.2186 1.2125 0.5131 0.8276 0.6359 1.7564 1.5940 0.7404 0.7964 1.0000 0.9898 0.7795 0.3743 1.9747 0.5923 2.4148 1.0807 0.9960 0.7533 0.8967 0.9508 2.8952 1.1940 0.6954 1.0868 0.9086 1.3520 1.8703 0.6737 4.3664 2.9584 1.4924 1.4069 1.4927 1.0881 1.1913 1.0849 0.7096 0.9697 0.9736 1.6105 0.6860 0.5969 2.0574 2.9720 2.3846 1.7539 0.8642 1.1258 1.0751 0.9952 0.4917 0.3887 0.5556 0.7951 1.0040 0.5319 0.8296 0.9165 0.7333 0.9823 1.9473 0.9194 1.2214 1.6405 0.6248 3.1713 1.4933 1.2091 0.7476 0.6640 1.4195 0.8077 0.7978 0.9801 0.3209 0.6480 1.2686 1.8950 0.9147 0.6693 0.7326 0.9288 1.4252 0.8751 1.1257 1.0753 0.9215 0.8593 0.9230 0.9804 3.0077 1.1868 0.9284 1.4730 1.0244 2.2410 0.8085 0.5785 0.7666 1.4522 0.4007 0.9323 1.5135 0.6448 0.7893 2.2391 0.9538 1.8511 3.2579 1.7472 1.0053 0.9033 1.2167 0.9766 1.4419 2.2431 1.1689 1.1318 1.1142 0.7030 1.3768 1.4821 0.8796 1.2805 1.1331 0.7192 1.2053 1.2202 0.7641 0.4088 0.8042 1.3904 1.0131 0.9500 2.0997 2.9093 0.8719 0.5377 1.1667 0.9071 0.6072 0.9623 0.8540 3.3401 0.8678 0.9651 1.0121 0.9267 1.0412 0.8659 1.4057 2.2351 1.0611 1.4291 0.6039 1.5652 0.8746 2.2169 0.8763 0.7959 1.3812 1.9884 0.5392 0.5819 0.4709 0.5928 1.2165 1.0032 2.1503 0.9665 0.4115 1.5307 1.5340 1.0588 0.8934 1.6194 1.0202 1.5422 1.5047 0.6419 docosahexaenoate (DHA; 22:6n3) 2.8396 1.2654 0.3676 1.4382 1.2668 0.6566 1.1273 0.9006 0.3761 0.6153 0.5668 2.3375 2.5110 0.9572 1.2549 1.6557 1.6440 0.9605 0.7052 2.8840 0.5270 3.1638 1.3107 0.6548 0.6235 0.7243 1.0978 2.5053 0.9797 0.5304 1.0932 0.6019 0.9007 1.2822 0.5452 3.5848 2.3709 1.4199 1.0108 1.2381 0.9312 1.2604 1.1497 0.7931 0.9759 1.0969 1.3497 0.5429 0.8984 1.3720 2.4138 2.4549 1.5536 0.4420 0.6773 0.6622 0.6814 0.5561 0.2418 0.5002 0.6943 0.8089 0.4801 0.7858 0.7347 0.5125 0.6026 1.1997 0.4367 0.6035 0.8998 0.3511 1.5431 0.8589 0.7527 1.1852 0.9199 1.5857 1.1698 1.1030 0.8762 0.3295 0.8131 1.1115 1.6117 0.6904 0.8807 0.7574 1.5202 1.6035 0.9625 1.4502 1.4996 1.3694 1.4390 1.3193 1.5081 1.7660 0.6834 0.7078 0.9240 0.8172 1.3351 1.1404 1.2449 0.9450 2.9252 0.5308 1.1267 1.6079 0.6219 1.0026 2.7223 0.5807 1.9004 3.1682 2.3886 1.3520 1.4358 0.5728 1.1598 0.7749 0.9572 0.6396 0.8001 0.8801 1.0785 1.2573 1.7400 1.3151 1.1635 1.1612 0.7887 1.0203 1.2506 0.6878 0.3446 0.5839 1.2788 0.7926 0.7681 1.7842 3.1810 0.8424 0.5494 1.2042 1.0000 0.7040 0.8350 0.6567 3.3252 0.7598 0.8268 1.3088 1.1165 1.5007 1.2805 1.6566 3.0189 1.5742 2.7168 1.1206 2.1777 1.7083 3.5046 1.1847 0.9074 4.3884 4.8482 0.9060 0.4649 0.3527 0.4106 1.2365 1.1296 2.5598 0.6360 0.3404 1.0517 0.7741 0.9482 0.3328 0.6880 0.4767 0.8001 0.8709 0.3403 docosapentaenoate (DPA; 22:5n3) 1.8830 0.9485 0.1724 0.8799 0.7723 0.2863 1.5356 1.3526 0.4521 0.7017 0.6097 2.5782 2.3946 0.8443 1.2149 1.4825 1.6794 1.1226 0.6054 3.4159 0.5232 4.1904 1.4937 1.0765 0.8506 0.8849 1.0703 4.0658 1.6612 0.7630 1.7466 1.0177 1.5975 1.8711 0.7681 7.7280 3.3236 2.0985 1.4901 1.8409 1.1665 0.9711 0.9063 0.6248 0.8985 0.8101 1.3929 0.5619 0.6111 1.4874 2.8051 2.9344 1.6656 0.5190 0.7257 0.7083 0.7909 0.4457 0.1989 0.3627 0.6549 0.6926 0.4211 0.6710 0.9022 0.7411 0.8943 2.4002 0.8174 0.8282 1.3716 0.3690 3.3525 1.1848 0.9978 0.7201 0.6057 1.4405 1.0027 0.7219 0.9060 0.3456 0.6823 1.2219 1.8484 0.7653 0.6848 0.6110 0.9823 1.4976 0.7516 1.2606 0.7663 0.7692 0.6976 0.7989 0.6817 3.6726 1.0778 0.8339 1.8190 1.0698 2.9502 0.6901 0.7299 0.6664 1.8372 0.3290 0.6930 1.9824 0.6348 0.8574 2.6601 0.8363 2.2957 4.7445 2.5334 1.1971 1.3249 0.8866 1.1042 1.3951 1.8270 1.1798 0.8950 0.9557 0.6935 1.2251 1.4628 1.2775 1.7845 1.3811 0.7820 1.3710 1.8375 0.9693 0.5084 0.9275 2.2209 1.3905 1.2243 1.2168 2.2144 0.5808 0.3524 1.0099 0.6810 0.7224 1.0954 0.8656 7.1217 1.0000 1.1453 1.1307 0.9346 1.2850 0.8668 1.6489 3.0864 0.9371 1.9355 0.5835 1.7490 0.9065 2.4867 1.2267 1.0707 2.6280 3.9951 0.6289 0.6344 0.4700 0.5679 1.7118 1.3076 3.8149 0.7949 0.2897 1.0983 1.0478 0.9903 0.6500 1.5732 0.9261 1.5768 1.7015 0.5716 docosapentaenoate (n6 DPA; 22:5n6) 2.5159 1.4833 0.3600 1.3495 1.2916 0.6116 1.5586 1.2044 0.5315 0.8122 0.7656 2.8952 2.7230 1.2599 1.7419 1.9312 2.0201 1.1008 0.6060 2.2694 0.5175 2.2000 1.2380 0.8807 0.8481 0.8695 1.3812 2.5657 1.2203 0.8487 1.5095 0.9258 1.1996 1.5038 0.7274 3.0373 1.9341 1.3215 1.0902 1.3937 0.9451 1.0941 1.0079 0.6528 0.8201 0.8900 1.2689 0.6662 1.0940 1.6729 2.2837 2.5929 1.8978 0.6144 0.9459 0.9372 0.8414 0.7263 0.2858 0.5870 0.8545 0.8764 0.5661 0.9281 0.8797 0.6363 0.7379 1.4542 0.5761 0.6307 0.9940 0.3780 1.4740 1.0120 0.8209 0.6551 0.5522 1.0233 0.7178 0.6077 0.9854 0.3368 0.7862 1.1714 1.5771 0.7536 1.0279 0.7914 1.3351 1.6273 0.9344 1.5788 1.3241 1.1922 1.0883 1.1683 1.2180 2.0514 0.9564 1.0249 1.3238 1.1061 1.5558 1.0000 0.9329 0.7951 1.9491 0.4429 0.8717 1.5080 0.6931 0.9963 2.2448 0.7951 1.7335 2.5700 2.2104 1.2862 1.5382 0.8791 1.5793 1.0590 1.4062 0.9595 0.6150 0.5900 0.6608 0.9986 1.1695 1.3798 1.3939 1.3682 0.9899 1.3993 1.5115 0.6773 0.3218 0.6245 1.2293 0.8466 0.8312 1.6953 2.2134 0.9226 0.5563 1.2045 0.9925 0.7131 0.9358 0.7158 2.5543 0.8443 0.9449 0.7148 0.7364 0.7109 0.6650 0.9028 1.4056 1.0014 1.4780 0.5792 1.4505 0.8596 2.0182 1.2148 0.9812 3.6678 3.7428 0.9562 0.6471 0.4954 0.6267 1.4010 1.3271 2.5856 0.9404 0.5243 1.5282 1.2223 1.1219 0.5861 0.9107 0.7997 1.1902 1.1894 0.5065 docosatrienoate (22:3n3) 1.8004 0.7408 0.1955 0.7204 0.6967 0.1955 1.7311 0.8559 0.4390 0.8348 0.7302 1.8153 1.2074 0.7902 0.8313 0.1955 0.1955 0.8718 0.2239 2.9545 0.5898 3.4271 0.8317 1.4880 0.5478 1.2319 1.0000 4.0930 1.8208 0.8202 1.8769 1.1021 2.4262 2.4006 0.7810 3.2490 2.0901 2.0368 1.6043 1.7135 0.9251 0.9062 0.1955 0.4754 1.1688 0.1955 1.7630 0.7922 0.5174 2.2828 3.1120 1.7271 2.0022 0.1955 0.9923 1.4571 1.3240 0.4405 0.2979 0.3531 0.5849 0.7320 0.3911 0.9962 0.7841 0.6095 0.6650 1.4983 0.1955 1.1046 1.8472 0.1955 2.3592 1.6036 0.9614 0.2882 0.1955 0.8467 0.7145 0.4488 1.1076 0.4143 0.5223 1.4392 2.8054 0.7105 0.5662 0.7528 0.9064 2.3272 0.8302 1.7367 1.3958 1.0246 0.9441 1.3193 0.9084 4.0272 0.8089 0.7175 1.5321 0.7718 1.9469 0.4533 0.1955 0.5908 0.9636 0.1955 0.5965 1.5155 0.6025 1.1822 3.1984 1.4789 2.2178 3.0002 2.3577 1.1850 1.1797 0.6681 0.7254 1.1599 1.8598 0.6540 0.8753 0.9669 0.8189 1.2004 1.4135 0.1955 2.4114 2.0167 1.3154 2.1132 2.2185 0.4754 0.1955 0.7248 1.2432 0.4488 0.7683 2.7320 3.2615 1.0047 0.6410 1.4924 1.1187 0.8158 0.7824 0.7778 4.7660 0.9953 0.9120 0.9486 1.1784 0.9963 0.7843 1.0042 3.0268 0.7320 2.0061 0.4284 2.0901 0.9621 2.9591 1.4988 1.1576 1.9580 2.0314 0.3979 0.2418 0.4158 0.4867 0.9909 0.9573 1.7652 0.7286 0.1955 1.0947 1.0455 1.1668 0.6807 1.5485 1.3719 2.0794 1.6850 0.4962 dodecadienoate (12:2)* 2.2669 1.1918 0.2905 1.4825 0.9170 0.7821 0.8308 0.6302 0.2890 0.4949 0.5440 2.2904 1.4474 1.2840 1.7484 1.6767 2.1320 1.2951 0.2781 1.7325 0.5566 1.3767 1.3700 1.1934 1.1206 0.7783 0.4609 1.1872 1.3554 0.7086 0.4083 0.9492 0.7878 0.8736 0.7828 1.9543 1.1309 1.4937 1.2706 1.1684 1.0603 0.9275 0.7572 1.0000 0.9506 1.1497 1.3696 0.8879 0.6704 0.8503 0.9909 1.2245 0.9596 0.5296 0.8771 0.7054 0.7573 0.1786 0.3828 1.3684 1.0151 1.3556 0.7540 1.1785 1.1998 1.1688 0.9387 1.4167 0.7032 0.5687 0.7624 0.5653 0.8276 0.9198 0.6567 1.0069 0.7618 1.2747 1.2370 0.6540 1.2887 0.1847 0.7069 1.2323 1.4046 1.0614 1.0357 0.8058 0.8581 1.1873 0.9229 1.2633 0.6379 0.9282 1.1229 1.0022 1.0298 1.0628 1.0386 1.1270 1.7830 1.4053 1.5475 1.4081 1.5823 1.2497 1.3592 0.5069 0.8935 0.8500 0.4669 0.3416 0.7693 0.6091 0.7892 0.9978 1.1891 1.1827 1.3331 0.7828 0.8080 1.1003 0.9400 1.0535 1.0699 0.7152 0.2428 0.7721 0.9978 0.8648 1.3042 1.1534 0.5140 1.1133 1.4103 1.1441 0.7905 1.0582 1.5411 1.4717 1.5153 1.1021 1.5833 0.8449 0.4875 1.6100 1.1965 1.0403 1.0771 0.8547 2.0521 1.4327 1.4489 0.9946 0.7346 1.0310 0.9160 1.3616 1.2477 1.4573 2.3437 1.0121 1.2722 0.9520 1.0166 0.4991 0.4582 0.1247 0.6642 0.3586 0.7947 0.2374 0.6729 1.0139 0.7238 1.0526 1.1317 0.2663 0.8275 0.9240 1.0511 0.4821 1.0699 0.3845 0.9003 0.8118 0.7128 dodecanedioate (C12) 0.9832 1.0677 0.5377 0.8524 1.1439 1.0583 1.1997 0.6434 0.6080 0.8027 1.0391 1.5933 0.5513 0.9439 0.7395 0.7938 0.9510 1.3341 0.4038 2.9346 0.8328 1.4399 1.0381 1.3618 1.0458 1.1102 0.5137 1.3294 1.3435 0.9414 0.6393 0.8491 0.6044 0.8891 0.7547 1.7813 0.9646 1.1535 0.8875 0.7781 0.6594 0.9262 0.9290 0.8198 1.1528 1.4340 1.5754 0.7766 0.4563 2.7155 1.3966 1.2814 0.8489 0.7614 0.8216 1.1992 0.8089 0.4930 1.4648 2.0519 1.7627 1.8113 2.1358 1.3405 0.6842 0.8940 0.7299 0.7237 0.8606 0.6254 1.0684 0.6609 0.9790 0.6314 0.7313 0.8977 0.9347 1.0000 1.4233 0.8160 1.1847 0.6519 0.5153 0.7269 1.1082 1.0917 0.4403 0.7961 0.9035 1.0024 0.6649 0.8074 1.0715 1.4966 1.4123 1.1798 0.8967 1.5478 1.0145 0.9535 2.0347 1.3692 1.3584 1.1986 1.6495 0.6272 1.6139 0.6175 0.6693 1.3430 0.9782 0.4955 1.2586 1.0437 1.3135 1.1036 1.3299 1.8576 2.1559 1.3365 1.1350 1.1013 1.2518 0.7181 0.9152 0.4454 0.3949 0.7904 0.7725 0.5484 1.2022 0.9976 0.4885 1.1767 1.1846 0.7651 0.3221 0.5691 0.6658 0.8111 0.8259 1.2193 1.4278 1.0954 0.8311 2.0124 1.4480 1.0830 1.3406 0.9409 2.3368 1.3264 1.5668 0.8141 0.7879 0.9934 0.9147 1.2570 1.3381 0.7024 2.0322 0.9825 1.1037 0.9841 1.1007 1.5924 1.9532 0.8277 1.2519 1.2248 1.4281 0.5064 1.6693 2.0917 1.6762 1.9901 0.6706 0.3715 0.2335 0.8860 1.1505 1.1352 3.7600 0.9592 1.5459 1.7985 1.8636 dodecenedioate (C12:1-DC)* 1.2749 1.2982 0.3508 1.0772 1.2125 0.8619 0.7625 0.6356 0.3508 0.5262 0.5391 1.0000 0.3508 0.6041 0.3508 0.4502 0.7119 1.0609 0.3508 3.7226 0.3508 1.5271 1.0694 1.2563 0.9117 0.9087 0.8208 1.9006 1.1422 0.6671 0.7379 1.2996 0.3508 1.5540 0.6607 3.7593 1.0775 1.5257 1.1983 0.9314 0.7419 0.9248 0.3508 0.8775 1.2846 1.2716 1.7383 0.6206 0.3508 3.6825 1.5073 1.0230 0.8562 0.3508 0.7645 1.3462 0.5244 0.3508 0.3508 1.4112 0.3508 1.1144 0.7520 0.9136 0.3508 0.6477 0.3508 1.0747 0.3508 0.6954 0.9243 0.7245 0.8901 1.3652 0.7941 0.7606 0.5239 1.8395 1.4144 0.5846 0.9533 0.3508 0.8067 0.7009 1.0224 0.8740 0.8323 0.3508 0.5876 1.9461 0.3508 1.2686 0.3508 0.8278 0.8886 0.7679 0.3508 0.7556 1.0853 0.8224 2.1821 1.1287 1.1745 1.2574 1.4661 0.5895 2.4697 0.3508 0.5972 1.0041 0.3508 0.3508 0.9161 1.0752 0.9837 0.8259 1.0645 1.4338 1.5103 0.3508 0.7460 1.1463 1.2778 0.9277 0.6582 0.5087 0.3508 0.3508 1.0412 0.9361 1.2633 1.1219 0.3508 1.0417 1.1434 1.0471 0.3508 0.6583 0.9759 0.9603 0.6523 0.8044 1.2282 0.3508 0.3508 1.3769 1.0121 1.2312 1.5513 0.8600 2.2254 1.7605 1.8618 0.8374 0.6463 0.8415 0.9263 1.7361 0.7578 0.3508 1.3863 0.9834 0.3508 0.3508 0.6066 1.0409 1.3092 0.3508 0.3508 1.0000 1.5354 0.3875 0.9913 2.2939 1.2341 1.7770 0.7018 0.3508 0.4710 0.8610 1.1672 0.8097 3.1767 0.3508 1.4157 2.0333 1.5080 dopamine 3-O-sulfate 2.2912 1.8597 1.8780 1.2993 1.4333 1.9220 0.8083 1.0805 0.7846 0.7336 0.9616 1.0855 1.5464 4.4107 1.4524 1.9018 1.3850 0.5671 0.7367 0.6251 1.2177 0.5845 1.0000 1.0127 0.9408 0.8514 0.7606 1.0001 1.0502 1.5318 0.8276 1.4004 0.4198 1.1119 0.6139 0.8345 1.1462 0.9462 1.1386 1.1943 0.9594 1.4376 1.6709 1.6782 1.3814 2.1415 1.0520 0.9947 0.7674 0.6760 0.6720 0.9992 0.5996 1.1912 0.5871 0.7921 0.9030 0.8648 0.7309 1.3496 1.3342 1.4288 1.5667 0.9667 0.9809 0.9954 0.9878 1.0597 1.0487 0.7278 0.5349 0.6586 1.0050 0.7247 1.0526 1.9590 2.0164 1.5530 1.8523 1.9904 0.4546 0.6797 0.9277 0.4420 0.9186 0.7675 2.2295 2.2806 2.8101 1.9036 2.4112 2.3422 1.2459 0.8523 0.8181 1.1932 1.0784 1.2158 0.7205 0.8243 0.6878 1.0653 0.7116 1.0366 1.1222 1.5348 1.1602 1.1488 1.9481 1.0710 1.1976 1.1348 0.9793 0.8228 1.0190 0.8870 0.6017 0.6634 0.4906 1.5980 1.6995 1.5103 1.0466 1.5365 0.4198 0.9484 0.4748 0.7371 0.5386 0.5758 0.9303 0.8532 0.6719 0.9722 0.8664 0.8206 0.8250 1.4598 0.8612 0.6536 1.3005 1.0000 1.2416 1.1067 0.8389 1.2231 1.0603 0.9657 0.6742 0.8274 1.2199 0.8706 1.2889 0.9151 1.2691 0.7674 1.1500 0.4198 0.6940 1.8369 1.2070 1.8652 1.5742 1.4847 1.8457 0.5565 0.4405 0.7020 1.0530 1.4613 0.8210 0.9614 1.7654 0.8817 0.8538 1.4955 0.4198 0.7844 0.5298 0.8744 0.6114 1.1906 0.8458 0.8772 1.2565 0.7632 0.6697 EDTA 1.0670 0.8810 1.2037 0.9474 0.9220 1.1561 0.9511 0.9263 1.0020 0.9609 1.0114 1.0405 0.9226 0.9393 0.9429 1.2870 0.9865 0.8875 0.9509 0.9224 1.6970 0.9560 1.1861 1.5221 0.9838 1.2720 1.4169 0.9774 1.4015 1.2069 1.0439 1.1492 1.1283 1.1029 1.4536 0.9408 0.9451 0.9446 1.4228 2.9071 0.9451 1.1319 1.1722 1.1589 1.0146 1.1644 0.8614 1.4261 0.9670 1.4785 0.8715 0.9660 0.8162 0.8749 0.7992 0.8157 0.8507 0.8628 0.9758 1.0317 0.9660 0.9383 0.9242 0.9210 1.0614 0.9790 1.0223 0.9957 1.0043 0.9647 0.8943 0.8604 0.9332 1.1444 0.9974 0.9119 1.3065 2.5896 1.1383 0.8274 1.0198 1.1823 1.0074 0.9441 1.1777 1.0550 0.9781 1.3436 1.2952 0.9727 1.0176 1.0924 0.9323 1.0055 0.9467 0.9292 0.9895 1.1157 0.8256 0.8331 0.9852 0.9417 1.0125 1.1110 1.1493 1.1716 1.0840 1.1512 1.2935 1.4355 1.0174 1.1093 0.9139 1.8917 0.9860 0.9210 1.1203 0.9479 0.8248 0.9733 1.0388 1.1111 2.2746 0.9712 1.8784 0.8695 1.0752 1.0789 0.9821 1.0695 1.3429 1.0537 1.1326 1.2056 1.0681 0.9063 0.9651 0.9876 0.9964 1.0818 0.9647 1.1454 1.2100 1.2790 1.1878 1.2168 1.1592 1.0000 0.8806 1.1368 0.9660 0.9243 0.9500 1.0090 1.0431 1.0740 1.0447 1.0804 1.1419 0.8535 0.9257 0.9016 0.9389 0.8515 0.8595 0.8410 1.0379 0.9153 0.8874 0.8866 0.9461 1.0577 0.9712 0.9526 0.9990 1.0383 1.0791 1.0582 1.1673 1.0476 1.0579 0.8793 0.9032 0.9211 0.8683 0.7965 0.8131 eicosanedioate (C20-DC) 1.1242 0.8529 0.7669 1.1464 1.2225 0.9864 0.9129 0.7152 0.8496 0.8480 0.7818 1.2022 1.1144 0.9323 1.0334 0.9166 1.2089 0.8988 1.0312 1.2432 1.1034 1.3755 1.3384 0.7605 0.9517 0.9829 0.8766 1.3654 1.1233 0.8608 1.0944 1.2469 0.6771 0.9336 1.0848 1.0458 0.8522 0.8834 0.8155 1.0000 1.0715 1.4071 1.6691 1.7467 1.8116 1.9829 1.9119 0.6336 0.8108 0.6587 0.9593 0.7631 0.5303 0.6746 0.7965 0.7614 1.0579 0.6838 0.8519 0.9122 0.9970 1.1329 0.6853 0.8430 0.4567 0.7690 0.6904 0.6302 0.6060 1.2993 1.3210 0.9977 1.4954 0.9185 1.4836 1.8801 1.7966 1.4960 1.6291 1.3875 1.1886 0.8359 1.0456 0.7124 1.1572 1.0101 0.7651 0.9973 0.8622 0.8559 0.8736 0.9547 0.9136 1.2940 1.1406 1.1236 1.0253 0.9056 0.8700 1.0102 1.0027 0.9577 0.9243 1.6660 1.5240 1.7279 1.2479 1.5074 1.4052 0.8253 1.0066 1.0967 1.1429 0.9592 1.1389 1.1049 0.8417 0.9390 0.9665 1.2533 1.0093 1.1930 1.0149 1.3200 0.6878 0.9871 0.8695 1.1401 0.9315 1.1968 1.1339 1.2110 1.1954 1.3550 1.0221 0.6121 0.7502 0.6742 0.6445 0.8385 0.6822 1.0503 1.0277 0.7000 0.7828 0.8384 0.9845 0.9597 0.9112 0.9368 1.1953 0.7927 1.0461 1.0245 0.8555 1.0654 1.0361 1.0030 1.1226 1.2985 1.2740 1.2518 1.1148 1.2413 1.3439 0.6644 0.6543 0.8058 1.0282 0.8410 1.0363 0.8822 0.5507 1.0708 0.8625 1.0765 0.7494 0.6984 0.9945 0.7307 0.8274 1.0087 1.2962 0.9972 1.1819 1.1508 1.0233 eicosapentaenoate (EPA; 20:5n3) 1.5674 0.8123 0.2404 0.7250 0.6943 0.3164 1.4528 1.3624 0.6871 0.6491 0.6366 2.5691 2.3122 1.0701 1.4096 1.5551 1.9913 1.2522 0.9142 3.1324 0.6197 3.2842 1.7787 0.8658 0.8673 0.6685 1.0003 2.1680 1.5982 1.0472 1.6944 1.2089 1.3323 1.4656 0.8456 6.0125 3.1760 2.2922 1.6875 1.8413 1.3260 0.9244 1.2232 0.6226 0.9000 0.8382 1.2658 0.6453 0.9270 0.9767 1.7350 2.2287 1.2848 0.4681 0.5240 0.5965 0.6204 0.4791 0.1196 0.2552 0.3930 0.4603 0.2587 0.4327 0.7854 0.6411 0.6876 1.3972 0.4732 0.5055 0.8718 0.2829 1.6166 0.7172 0.5856 1.1146 0.8924 1.7389 1.6951 1.0392 0.9717 0.5191 0.6494 1.0229 1.7265 0.8571 0.7876 0.7607 0.9984 1.4448 0.8317 1.3170 0.6789 0.7100 0.6798 0.7914 0.6769 2.5508 0.9838 0.9997 1.5858 1.1066 2.3133 0.8969 0.8650 0.8658 1.6573 0.4157 0.7671 2.0556 1.0000 1.4656 2.7318 0.8191 2.2864 3.8450 2.0719 1.3495 1.4131 0.6206 0.9424 0.8117 0.9161 0.7803 0.7348 0.9508 1.1061 1.2022 1.3480 1.4081 1.6268 1.2072 0.9111 1.3604 1.8151 1.0648 0.6412 1.0650 2.0502 1.5573 1.5235 0.8189 1.8883 0.5847 0.4165 0.9686 0.5956 0.8336 1.0406 0.9238 5.2739 0.8747 1.1123 1.3744 1.2626 1.8440 1.3731 2.1476 3.4205 1.2645 2.7925 0.9986 2.1935 1.2911 3.1286 1.2386 1.0278 3.7012 3.9807 0.8569 0.7562 0.9340 0.9679 1.9770 1.7703 5.3292 0.5348 0.2772 0.6919 0.6456 0.7279 0.8249 1.0433 0.9648 1.4194 1.1548 0.5742 eicosenedioate (C20:1-DC)* 0.8742 0.7674 0.6129 0.9524 0.6944 0.8746 0.8675 0.7786 0.9277 0.9966 0.9702 0.9671 0.8431 0.9356 0.9939 0.9860 0.9347 0.7759 0.8404 0.9822 0.8775 0.9086 0.9694 1.0000 0.9631 1.0713 1.0098 1.1987 1.1377 1.1804 1.1678 1.3121 0.7888 1.0753 0.9515 0.9909 0.8504 0.9640 0.9112 0.8736 0.7716 1.1955 1.3531 1.0080 1.4445 1.0948 1.1542 0.7447 0.7554 1.0000 0.9278 0.7062 0.2024 0.8880 0.8296 0.8683 1.0238 0.7009 1.3102 1.3060 1.4797 1.3898 1.4155 1.2909 0.2905 0.2024 0.2024 0.2024 0.2024 1.3579 1.1820 1.2101 1.4056 1.3286 1.2420 2.2517 2.3524 2.1687 1.9359 1.8344 0.6254 0.2024 0.4184 0.5184 0.4660 0.7929 1.0995 0.9958 0.9756 0.8689 1.0940 1.1436 0.9988 1.1048 1.1143 0.9232 1.0572 0.7082 0.6951 0.7355 0.6679 0.9462 0.8549 1.4758 1.5534 1.6063 1.4263 1.2241 1.6606 1.1326 0.9503 1.1921 1.1006 0.9270 1.0676 1.1852 1.4139 1.3592 1.0760 0.5647 0.6467 0.6305 0.8853 0.5397 1.0989 1.4094 1.3010 1.4064 1.4098 1.7410 2.0939 1.6848 1.8376 1.9591 1.8680 0.9494 0.8826 0.9163 1.0218 0.7663 1.1004 0.2969 0.5372 0.4387 0.2721 0.3844 0.5329 2.3830 1.8613 2.5170 2.2626 2.1847 2.3417 0.8209 0.9327 0.8991 1.0120 0.7107 0.4729 1.2723 1.1478 1.3013 1.3041 1.1857 1.4092 0.4976 0.2962 0.6986 0.2024 0.5911 0.3478 0.3450 0.2742 0.2024 0.3817 0.3112 1.3389 1.5531 1.3063 1.4349 1.2946 1.7700 1.7741 1.4824 1.7662 1.5418 1.6000 eicosenoate (20:1n9 or 1n11) 1.8358 1.4646 0.1380 1.1434 1.4702 0.4109 1.2793 1.2686 0.2231 0.9182 0.6110 1.4240 1.1778 0.5689 0.5749 0.6222 0.7206 1.0183 0.2203 3.0050 0.5299 3.5502 1.1813 1.0108 0.6507 0.8086 0.5220 3.0453 1.3241 0.4723 0.4803 0.6398 1.2452 1.4334 0.4654 4.5243 2.4146 1.4836 1.2847 1.6326 0.9139 0.7911 0.6605 0.4718 0.6591 0.6800 1.4160 0.6980 0.2970 2.5517 3.5675 2.4898 2.0731 0.8072 1.0622 1.1866 0.8695 0.2042 0.1926 0.4711 0.6337 0.8764 0.4594 0.6595 0.6677 0.7316 1.0425 2.3782 1.1055 1.3501 2.2402 0.6868 4.3788 1.8239 1.5135 0.6590 0.6021 2.0429 1.1505 0.8034 1.1016 0.1799 0.6961 1.2679 1.9608 0.9121 0.5266 0.6586 0.5730 1.4775 0.6203 1.0070 0.8594 0.8807 0.8065 1.0001 0.7230 2.7094 1.0421 0.6844 1.4751 0.6990 2.1549 0.8690 0.5338 0.6617 1.5986 0.2049 0.6183 1.5987 0.5669 0.4042 2.1232 1.1716 1.9045 4.3162 2.2133 1.1792 1.1706 1.1327 0.8474 1.5820 2.4517 1.1817 1.0641 1.0204 0.3097 1.2136 1.2403 0.9569 1.4342 1.5004 0.5815 1.2115 1.4025 0.6344 0.2258 0.5986 1.3411 0.9226 0.7449 2.0620 3.0564 0.8029 0.3916 1.3224 1.0000 0.4280 0.7468 0.5067 3.3572 0.6688 0.7882 1.1068 0.9874 1.0496 0.7758 1.7279 2.7005 0.8314 1.6412 0.4506 1.6528 0.7085 2.0317 0.9999 1.0286 0.7419 1.7855 0.4723 0.5234 0.2034 0.4493 1.1873 0.8278 2.0533 1.0405 0.2098 1.4920 1.3601 1.2986 0.7387 1.8344 0.8184 1.4964 1.5798 0.5860 epiandrosterone sulfate 0.8500 0.7777 0.7286 0.3219 0.3764 0.5536 0.4730 0.4486 0.5428 0.2993 0.4054 2.1177 1.7904 1.4672 1.6458 1.8051 1.8813 0.4553 0.8466 0.7640 0.7968 0.6365 0.8906 0.5137 0.5697 0.5543 0.6242 0.7136 0.5862 1.1163 1.2373 1.1684 0.6032 1.0926 0.7832 1.9475 1.9916 1.7196 1.6542 1.5887 1.5748 3.1510 2.7222 2.9367 2.9572 3.1062 3.0650 0.7383 0.8513 0.6334 0.5459 0.7930 0.4583 1.6431 0.8491 1.1279 1.7770 1.7675 2.9540 2.0226 3.1073 1.8390 3.1640 1.6221 1.9362 1.6471 1.5718 1.6971 1.3035 0.5847 0.5604 0.4718 0.6523 0.6402 0.5812 0.5403 0.5361 0.5793 0.5647 0.6132 1.5016 2.1016 1.8232 1.3473 2.6395 2.3982 0.6777 0.6371 0.7563 0.7159 0.7071 0.7904 2.4489 1.3648 1.6876 2.3018 2.3279 1.1376 0.9933 1.0067 1.0457 1.1253 1.1546 0.5273 0.7342 1.0114 0.5453 0.9326 1.1654 1.6359 1.8854 1.8520 1.2022 0.7153 0.8864 0.3100 0.2724 0.2868 0.2486 0.5855 0.6943 0.6840 0.7066 0.6893 0.6230 1.3897 1.4948 1.6636 1.0427 0.3500 0.6795 0.4559 0.6140 0.6177 0.4265 1.3904 1.9061 1.9517 1.2552 0.8940 2.0012 0.5137 0.5262 0.6442 0.5167 0.7268 0.5171 1.5331 1.0638 2.1478 2.2869 1.0253 1.8277 1.7560 2.0163 1.9367 1.9042 2.0307 2.4544 0.7140 0.7139 0.6366 0.7167 0.6441 0.7577 0.7875 0.6706 1.4684 1.4193 1.0641 0.6220 0.9106 0.7896 0.8184 0.8514 1.0000 2.4150 2.2253 2.3064 1.8932 2.0978 2.4917 1.4354 2.4742 2.7919 1.0668 0.9335 erucate (22:1n9) 1.4326 1.1400 0.4412 1.0618 0.9777 0.6716 1.1734 1.0650 0.6774 0.9177 0.8325 1.5424 1.4409 0.7184 0.7317 1.0114 0.8250 0.9379 0.6031 2.3795 0.8503 2.8194 1.8977 1.1455 0.7449 1.1305 1.1338 2.8435 1.0272 0.7824 1.1526 0.9445 1.3732 1.9448 0.8117 2.6496 2.0713 1.0664 1.0275 1.0800 0.9335 1.1813 1.3405 0.8588 0.9525 1.0928 1.5081 0.5831 0.6433 1.5988 2.4722 1.9154 1.5230 0.8641 0.9606 0.9299 0.9027 0.6737 0.3642 0.5784 0.6554 0.8502 0.5490 0.6678 0.9639 0.8785 1.1145 1.8670 1.0116 1.0674 1.4239 0.6112 2.4113 1.1792 1.1256 0.8361 0.8079 1.5587 0.9039 1.1113 0.9895 0.4413 0.9331 1.1324 1.7857 0.9778 0.8047 0.8327 1.1237 1.5626 1.0017 1.1242 1.0946 0.8750 0.8245 0.9135 0.9133 2.5538 1.1157 0.8464 1.2780 0.9983 1.8171 1.0286 0.7230 0.8534 1.5320 0.5429 0.9816 1.3636 0.7853 0.9356 2.1756 1.0109 1.7166 2.1864 1.2893 0.8345 0.8160 1.1298 0.8407 1.3954 1.9965 0.9845 1.0574 0.9469 0.7888 1.1930 1.1645 0.8060 1.1365 1.1782 0.7261 1.0644 1.0436 0.5818 0.4291 0.7238 1.0568 0.6991 0.6703 1.8589 2.3059 0.8501 0.6046 0.9875 0.8774 0.5788 0.7535 0.6891 2.1206 0.6559 0.7244 1.0725 0.9849 0.9715 0.8734 1.1938 2.2073 1.1322 1.4701 0.7517 1.4472 0.9974 2.4795 0.9323 0.7996 1.8037 2.1646 0.7084 0.6819 0.5964 0.6477 1.1449 1.1002 1.9550 0.8927 0.4497 1.3207 1.1819 1.0000 0.9487 1.5781 1.0588 1.5154 1.5744 0.6876 etiocholanolone glucuronide 1.1058 1.0537 0.7092 0.6199 0.6682 0.7339 0.3454 0.3449 0.5515 0.2836 0.3044 1.4339 1.4135 1.0128 1.3728 1.3808 1.1413 1.0956 1.1934 1.5874 1.9030 1.1111 2.3777 0.2673 0.2513 0.2095 0.1772 0.3186 0.1439 0.6773 0.8871 0.6978 0.6202 0.6700 0.6438 0.9499 1.1494 1.1810 1.0868 1.0000 0.9319 2.3147 2.8355 2.1955 2.9920 1.9427 1.7194 0.8211 0.8270 0.6440 0.3651 0.7170 0.4333 1.8036 1.1117 0.9610 2.0581 1.8825 1.4341 1.9105 2.3803 1.8972 2.3679 2.2187 1.5200 1.3106 1.2186 0.8547 1.2686 0.4778 0.4547 0.3563 0.6564 0.5922 0.7371 1.1540 0.9506 0.6648 0.9168 0.9387 0.7850 0.6373 0.8604 0.5122 1.1909 1.2025 1.0914 1.0064 1.4128 1.0922 1.4014 1.6473 1.0181 0.8654 0.7432 0.8077 0.7098 1.6506 1.7291 1.6867 1.2016 1.6047 1.4633 0.8046 1.1224 1.1288 0.9617 0.9145 1.2653 1.5134 1.6794 1.3420 1.4283 0.9384 1.0650 0.1439 0.1439 0.1439 0.1439 1.2349 1.2076 1.1451 0.7755 1.0113 0.8851 1.0924 0.8288 1.5535 0.9547 0.7408 1.2078 0.8001 0.5867 1.3170 0.8296 0.7202 0.6558 0.8294 0.7671 0.5453 1.0675 0.4881 0.5520 0.9240 0.4717 1.0460 0.6751 0.7196 0.6775 0.9058 1.4191 0.7629 1.2889 0.6228 0.8910 0.7899 0.8167 0.6948 0.9778 0.5549 0.4981 0.4360 0.6484 0.5434 0.6265 0.6151 0.6788 1.0661 0.9936 0.8706 1.1408 1.0403 1.2781 1.3628 1.0562 1.6868 1.4057 1.4346 1.1754 2.4143 1.4890 4.3380 4.2183 2.7667 4.4606 2.6612 1.4797 ADSGEGDFXAEGGGVR* 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 1.2590 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.9066 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 5.6187 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 1.3923 0.2382 0.2382 0.8370 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.4182 0.2382 0.6951 23.5420 0.8019 0.2676 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 1.0934 0.2382 0.2382 0.2382 0.2382 0.4550 0.2382 0.8138 0.2382 6.9938 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 1.1077 3.3109 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.7645 0.2382 0.2382 23.9727 1.5917 8.2600 0.2382 0.2382 0.2382 0.2382 0.2382 0.6839 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 1.2307 0.2382 0.8722 0.2382 0.2382 0.2382 0.2382 0.2382 0.8923 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 0.2382 4.5870 0.2382 0.2382 0.2382 0.2382 0.2382 DSGEGDFXAEGGGVR* 0.2406 0.6611 0.2406 0.2406 0.2406 0.2406 0.3459 0.2895 0.2406 1.4813 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 1.3588 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 9.5288 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 1.6325 0.2406 0.2406 0.3816 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.3757 0.2406 0.6357 0.2406 1.3144 30.9977 2.3284 0.6856 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 1.0359 0.2406 0.2406 0.2406 0.2406 0.5114 0.2406 1.0000 0.2406 7.7419 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2972 0.2406 0.2406 0.2406 0.2406 1.8926 6.0724 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.4294 0.2406 0.2406 10.9172 0.9070 13.5844 0.2406 0.2406 0.2406 0.2406 0.2406 0.5906 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.4265 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 0.2406 1.7783 0.2406 0.9267 0.2406 0.2406 0.2406 0.2406 0.2406 2.2851 0.2406 0.2406 0.2406 0.2406 0.2590 0.2406 0.2406 0.2406 4.8812 0.2406 0.2406 0.2406 0.2406 0.2406 ADpSGEGDFXAEGGGVR* 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.3776 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 2.4347 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 1.0000 0.2588 0.2588 0.8529 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 7.2098 0.3768 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.6676 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.8675 0.2588 6.3656 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.4981 1.6720 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 11.9879 0.9147 14.1872 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 1.7100 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 1.0270 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 0.2588 1.0000 0.2588 0.2588 0.2588 0.2588 0.2588 Fibrinopeptide B (1-13) 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.4912 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 1.0359 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 7.0702 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.5971 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 23.4067 0.6488 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.4683 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.5118 0.3982 2.4916 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 1.1302 0.9706 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 6.0905 0.3982 3.3445 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 1.0000 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.6781 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 0.3982 1.0294 0.3982 0.3982 0.3982 0.3982 0.3982 gamma-CEHC 0.6809 0.3970 0.4246 0.8119 0.7777 1.4707 1.1474 0.9673 1.0860 2.2299 3.1669 1.3946 2.0054 1.6942 2.0563 2.2993 1.7923 0.5629 0.3729 1.0597 0.4434 0.6199 0.4119 0.9339 1.2531 1.9145 0.9537 1.7529 1.0283 1.2302 1.2930 1.4035 1.1859 2.6536 2.1154 0.9282 0.7890 0.8615 1.0179 1.2436 0.9756 1.2733 0.9769 1.6002 1.0694 2.1767 0.8750 1.0000 1.0103 1.5722 0.9758 0.8955 0.5119 0.7234 0.8000 2.1426 1.0018 0.7282 1.0334 3.0782 1.3106 1.9034 1.1524 1.6090 1.3568 1.2056 1.0779 0.6814 0.5942 0.4018 0.8207 0.7798 0.5884 0.6351 0.4986 0.7252 1.0405 0.4042 0.5749 0.3008 0.7391 0.7282 1.4530 0.6277 0.9358 0.7306 0.4899 0.5739 0.7264 0.2172 0.3922 0.4262 0.8266 1.6221 1.9114 1.0785 0.9613 0.9982 1.2397 1.3744 0.7829 1.5934 1.0683 1.0704 2.3025 1.0914 1.0194 0.6891 0.9120 0.7578 0.7166 0.8282 1.7112 1.0249 1.1726 0.3322 0.5026 0.7035 0.4918 0.7184 1.4608 1.0600 0.6036 0.8352 0.5969 0.7373 0.7352 0.8176 1.5442 0.9544 0.5611 2.0154 0.6795 0.8718 0.8523 1.5467 0.9050 0.7625 1.4072 1.4303 0.9369 0.9671 1.9186 0.8198 0.5299 0.9257 1.7334 2.0966 1.8414 1.1419 1.1903 1.3233 1.0000 1.5882 1.2970 2.5394 2.2312 1.2807 1.8907 0.8436 0.6023 0.8031 0.6305 0.8902 0.5293 1.4368 0.8259 1.4474 1.4532 0.9930 1.2860 1.1714 0.9212 1.5147 2.0202 1.3225 0.8024 0.6709 1.1153 0.5178 1.4374 1.2538 1.6152 1.0958 1.7078 1.5780 2.3388 gamma-glutamylleucine 1.3064 1.1698 0.5870 0.5539 0.5200 0.5345 1.4781 1.2062 0.6260 0.6419 0.8305 1.7604 2.1611 2.6073 1.8473 2.2619 2.2852 0.4688 0.4927 0.8622 0.9458 0.5380 1.1704 0.7279 0.8016 0.4842 0.3985 0.9010 0.8192 1.7827 0.9384 1.8164 0.6172 0.9552 0.6723 1.4608 1.3921 1.5321 1.3468 1.3764 1.3055 1.6975 1.8998 1.8204 1.7773 1.9142 1.7397 1.0939 0.3764 0.6099 0.5306 1.1607 0.3865 1.2203 0.4088 0.8332 1.1323 0.3915 0.6535 1.1360 1.7048 1.0289 1.5333 0.9198 1.0419 0.9236 0.9027 0.8908 0.8706 0.9605 0.7891 0.7202 1.2315 0.8334 1.4217 1.1766 1.1767 0.9669 1.0646 1.0577 0.5335 0.6322 0.5532 0.4656 1.5363 1.4789 1.8802 1.9676 1.9689 2.0206 2.0400 2.3764 0.9469 0.6811 0.6920 1.1160 0.8136 1.3900 1.3466 1.3092 1.4371 1.5218 1.3962 0.8375 1.0000 1.7759 0.8390 1.0064 1.7725 1.3012 1.2623 0.7924 0.6478 0.5973 0.7563 1.3976 0.5825 0.6358 0.5786 0.7055 0.6270 0.6721 0.5990 0.7377 0.6993 1.3253 0.6873 1.3128 0.9711 0.8783 1.3368 0.7507 0.8118 1.3338 1.0331 0.8670 0.7386 1.4912 1.2291 0.9242 1.4151 0.8274 0.8432 1.4887 0.7329 1.6565 0.8730 0.9103 0.9298 0.9132 1.5987 0.9637 1.5847 1.4306 1.5837 1.5276 1.4481 1.4865 1.6222 1.3666 1.3277 1.2750 1.2039 1.2174 1.4117 0.4827 0.3990 0.4562 1.1751 1.1938 0.4793 0.5583 1.2556 0.8164 0.6068 1.3485 0.3276 0.4875 0.3803 1.0113 0.5399 1.0937 1.1764 0.5915 1.0227 0.6707 0.5054 gamma-glutamylphenylalanine 1.1902 1.0430 0.7118 0.5278 0.4795 0.4439 1.3323 1.1372 0.7700 0.5400 0.9171 1.9551 2.2161 2.8031 1.9186 2.5137 2.4845 0.3533 0.4613 0.6919 0.8499 0.5838 1.1266 0.7293 0.8557 0.6753 0.5009 0.7920 0.9106 1.5090 1.0000 1.7045 0.6855 0.8532 0.7807 1.4126 1.5685 1.2941 1.3326 1.4072 1.1715 1.5146 1.6086 1.4646 1.3466 1.4430 1.5283 1.0971 0.5187 0.3533 0.6016 1.0387 0.4764 1.4357 0.6517 0.8378 1.5678 0.5521 0.7164 0.9288 1.3486 0.9602 1.4673 1.0087 0.9488 0.9410 0.9460 0.7786 0.9238 0.7956 0.5909 0.5894 1.0000 0.7831 1.2002 0.9776 1.1796 0.9807 1.0914 0.9851 0.6964 0.6779 0.5991 0.5149 1.6031 1.5389 1.7011 1.4115 1.6883 1.9556 1.5631 1.8315 1.0730 0.8992 0.9232 1.3667 0.8032 1.4378 1.0733 1.3158 1.2973 1.6645 1.2872 0.7344 0.9093 1.5229 0.8832 0.8088 1.2221 1.6974 1.3994 0.9100 0.7808 0.8898 0.8859 1.1806 0.5012 0.3977 0.4177 0.6329 0.8999 0.6801 0.5975 1.0252 0.7803 1.3548 0.6902 1.4363 0.7860 0.9772 1.4085 0.7043 0.7364 1.2929 0.9919 0.9867 0.8719 1.6767 1.0331 0.7884 1.4221 0.9152 0.8199 1.0687 0.6281 1.3512 0.9152 1.3124 1.0714 1.1616 2.0544 1.0500 1.9013 1.2557 1.5941 1.4923 1.4540 1.3459 1.5747 1.4203 1.3026 1.3450 1.3414 1.2001 1.4098 0.5870 0.5861 0.5817 1.3756 1.0774 0.5687 0.6054 1.3488 0.7941 0.7231 1.3605 0.6080 0.8023 0.7390 1.6326 0.5641 1.7988 1.1485 0.8489 1.8170 0.7976 0.7046 genistein sulfate* 6.4684 3.8610 1.0000 9.7868 9.3507 14.4139 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.3983 0.2212 0.2677 1.7025 0.2212 1.4540 0.2212 1.1988 0.8715 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.3100 0.2807 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 1.0000 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.6148 1.1167 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.7917 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.6880 0.2212 0.2212 0.2212 0.2212 0.2212 1.1519 0.2212 0.2212 0.2212 0.8378 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 0.2212 glucuronide of piperine metabolite C17H21NO3 (4)* 1.4272 1.8756 1.7874 1.4292 2.2108 2.9399 0.3177 0.5601 0.2628 0.5028 0.7583 0.2628 0.2628 0.3928 1.2491 0.2628 0.4105 0.2628 0.2628 0.2628 0.2628 0.2628 0.2628 0.5762 0.5184 0.6874 0.4836 0.3705 0.5922 1.6077 0.8779 1.3898 1.4095 1.6317 1.0641 1.2889 2.0127 0.8986 1.0448 1.9060 0.8646 0.8340 0.7693 0.2628 0.2628 0.2628 0.2628 0.4946 0.2628 0.2628 0.2628 0.2628 0.3485 0.7251 1.0250 0.2628 0.4033 0.6579 0.2628 0.9311 0.2628 0.4898 1.1581 1.5006 0.3984 0.5606 0.6373 0.7124 1.0394 4.5402 3.0722 3.9746 4.2462 1.3420 5.5321 0.3861 0.3373 0.4253 0.5416 0.5189 1.6922 2.0427 2.5084 1.3486 1.0740 1.8824 1.0601 1.1778 1.7607 1.4607 2.3953 1.0822 2.7540 0.5935 1.2978 1.0447 0.8737 2.7001 1.7694 1.6023 1.4542 1.9560 1.6710 0.2628 0.3883 0.6599 0.5908 0.5735 0.8299 0.2628 0.2628 0.2628 0.4004 0.4758 0.2628 0.9632 0.8145 1.1781 0.6446 0.7409 0.7731 0.9885 0.6772 0.9203 0.5882 0.9928 0.7888 1.0072 0.7057 0.2628 0.5073 0.6250 0.2628 0.2628 0.6211 0.6435 0.9774 1.8758 0.9192 1.2534 1.2293 1.1283 0.8045 0.2628 0.2628 0.4170 0.4888 1.9473 0.9878 0.7176 1.2700 1.6859 2.3829 1.4601 1.5123 0.4819 0.9687 0.8644 1.3010 9.4043 9.2128 9.6453 12.9946 10.1431 19.1658 0.2628 0.2628 0.2628 0.2628 0.5150 0.8630 1.3011 1.0000 0.2628 1.6017 1.5060 1.7159 3.2410 1.9468 3.6213 1.7322 0.7642 0.2628 0.3788 0.3707 0.2628 0.2628 glutamine conjugate of C6H10O2 (2)* 1.0443 1.0138 0.1959 1.2207 1.1567 0.4056 0.3920 0.4252 0.1959 0.3823 0.4440 1.8785 0.5331 0.4340 0.8263 0.6195 0.6401 0.4831 0.1959 1.8879 0.1959 0.9742 0.3719 0.5660 0.5061 0.5154 0.1959 2.0786 0.6946 0.5628 0.4401 1.0000 1.0326 1.1979 0.7153 4.8400 1.1602 2.1780 2.5567 1.0281 0.9981 0.3797 0.3179 0.3270 0.5518 0.4916 1.0039 0.8545 0.2836 7.9815 4.6105 1.1439 2.3595 0.8226 3.0688 4.3537 0.7761 0.1959 0.1959 0.3184 0.1959 0.2975 0.1959 0.3110 0.6550 1.3967 1.0203 2.4435 1.4561 1.8881 4.3178 2.1100 2.0415 3.6393 1.4310 0.3087 0.1959 0.7781 0.3829 0.1959 2.8761 0.2192 0.7669 1.3941 1.3172 1.5928 1.0220 0.8991 0.5059 2.5702 0.7492 1.3725 0.1959 0.4053 0.4779 0.1959 0.2877 0.9137 1.3714 1.2797 3.2864 1.2943 1.3166 2.3893 2.8344 0.7106 4.1001 0.2893 0.5564 0.2084 0.1959 0.1959 0.4450 0.6193 0.5300 1.0019 1.5860 1.5772 1.7159 3.4898 1.5719 1.3004 3.7961 2.6853 3.6950 1.3987 0.1959 1.2197 4.3546 0.7007 1.1935 1.4218 0.1959 0.7767 1.2120 0.5579 0.1959 0.4579 1.0893 0.3397 0.4624 0.3417 0.4715 0.1959 0.1959 0.3200 0.3437 0.9554 1.2046 0.8171 2.1908 1.7105 2.1343 0.5940 0.3140 0.4646 0.3337 1.5465 0.6364 0.5670 1.3110 0.1959 0.3932 0.3395 0.3190 1.4520 1.9860 0.1959 0.1959 0.1959 0.5823 0.1959 0.1959 1.1505 0.4198 0.3025 1.3953 0.1959 1.0243 1.2814 3.1435 0.5804 9.3085 0.3877 1.2662 3.3772 2.1957 glycerol 1.8829 2.1169 0.6771 1.1953 1.6160 0.7652 1.3571 1.9575 0.6702 1.2057 1.0381 1.0053 0.6457 0.8708 0.6445 0.6511 1.1561 0.8942 0.2924 0.8315 0.4694 0.8693 0.9739 1.3816 1.2915 1.0694 0.7484 1.3026 2.5335 0.9957 0.6549 0.9113 0.7474 0.6896 0.5732 3.0043 2.0765 2.9655 1.7294 2.6122 1.8734 0.4262 0.3525 0.3038 0.4609 0.4361 0.8249 1.4083 0.8335 0.6059 1.0065 1.3916 1.2620 1.4228 1.0319 1.3533 2.3105 0.7191 0.2807 0.4633 0.7289 0.6190 0.7705 0.5240 0.8945 1.3715 1.3798 1.8837 1.4737 1.3623 1.9771 0.8217 3.2006 1.6467 1.7982 0.7629 0.6970 1.0000 1.5858 0.6710 1.3836 0.4877 0.9547 1.2552 1.7772 0.9410 0.6811 0.8148 0.5536 1.1589 0.9395 1.1310 1.0043 0.8376 0.9313 1.3218 0.7164 1.9181 1.0727 0.8812 1.4124 0.6969 1.4570 0.9891 0.6265 0.8761 0.8734 0.4718 0.5899 1.0079 0.7828 0.5342 0.5534 0.6003 0.9303 3.8228 1.9569 1.2405 1.4147 1.7654 1.0493 1.7580 1.5396 2.0237 1.1083 1.6101 0.7777 1.4608 0.8869 0.8248 1.4518 0.9050 0.7653 0.9564 1.2165 1.5362 1.0098 1.4675 1.6735 2.5203 2.1533 0.5696 0.9110 0.6754 0.4323 1.0758 0.8721 0.9442 1.3480 0.8956 3.3062 0.9173 0.8281 0.9764 1.1172 1.3196 1.0225 1.6203 1.6470 0.8124 1.9011 0.6906 1.7014 0.6832 0.8163 1.5467 1.0745 0.6858 1.5150 1.1403 1.1086 0.6947 1.3009 1.8846 1.1368 3.3297 0.9734 0.8974 0.7658 0.9567 0.9327 1.2749 1.0700 0.8703 1.0375 0.4806 0.4157 glycine conjugate of C10H14O2 (1)* 0.9850 0.7835 0.7680 0.9713 0.8124 1.4264 0.4022 0.5245 0.5989 0.6381 1.3628 0.9673 0.9164 0.7265 0.7923 1.7094 0.8005 0.9547 0.6248 1.0826 0.4220 0.9954 0.7551 0.8711 0.7463 1.5868 0.7968 1.3087 1.1476 1.2557 1.2005 1.5061 0.8856 1.4080 0.5017 0.6839 0.8349 0.8155 0.8977 1.3068 0.6848 1.2417 1.1474 1.1828 1.2452 2.5416 1.0860 1.1993 1.1135 0.5625 1.4162 1.5682 1.7700 0.5270 0.4814 0.6061 0.6638 0.4352 0.5587 0.9304 0.6636 0.7505 0.4521 0.6636 0.3697 0.4250 0.3581 0.3183 0.3183 0.6730 1.0150 1.2073 0.9599 1.3393 0.8789 1.4183 1.1692 1.2330 1.5410 1.2131 0.5603 0.4329 0.7680 0.8516 1.0953 0.7371 1.3566 1.0554 2.8274 1.2525 1.1642 1.6116 0.4274 0.6480 1.1526 0.5786 0.7318 1.2986 1.4997 1.4557 1.2432 2.5341 1.3856 0.3183 0.5409 0.7603 0.3484 0.6011 0.5995 0.8329 0.9031 1.0428 2.0880 1.2092 1.2065 1.0672 0.7830 1.1127 0.6896 1.6830 2.3601 2.0191 1.3777 1.2039 0.6511 0.8805 0.6017 0.8205 1.1155 1.0542 0.8890 1.7490 1.0346 1.1339 1.0183 1.0394 0.7783 0.8566 0.9404 0.6434 0.9845 0.8077 1.6864 0.3849 0.3601 0.7681 0.7461 1.6035 1.2044 0.9674 1.2947 1.4216 1.0553 1.2350 1.0966 1.3208 2.3690 1.1111 1.5438 1.4595 0.8195 2.5010 0.8367 0.8461 1.0000 1.0339 0.6196 0.4902 0.6709 0.5212 1.8747 1.1225 1.9886 2.5748 1.9077 2.6054 0.8752 0.9196 1.2029 1.1630 0.6804 1.0580 2.7719 1.2653 1.6975 1.4050 1.0546 glyco-beta-muricholate 0.8837 0.6995 0.3748 0.6040 1.0000 1.1070 0.4228 0.3247 0.3247 0.3247 1.0462 0.3247 1.7232 1.4561 1.7050 1.5000 1.2570 0.3247 0.3247 2.4328 2.2758 3.5896 0.6238 0.7670 1.1288 0.8853 0.3247 1.2426 1.9868 0.3247 0.3247 0.5992 0.3247 0.3247 0.7267 0.3247 0.3247 0.4025 0.9566 0.3247 0.5892 0.3247 0.3247 0.3247 0.3247 1.2544 0.3247 0.3247 0.3247 0.3247 0.3247 0.4094 0.3247 0.9870 0.3247 0.6506 0.3247 0.3247 0.3247 1.8433 1.8068 1.2092 2.1520 1.1774 0.3247 0.3247 0.5733 0.3247 0.6796 0.3247 0.8212 0.3247 0.3247 0.9464 1.0272 7.6415 4.8041 3.3285 3.0818 1.3577 0.3247 0.3247 0.3247 0.3247 0.3247 0.3247 1.1243 0.5464 2.4959 0.3247 0.5676 0.7212 0.3247 0.4672 0.9309 0.3247 0.3247 0.9627 0.8415 0.5646 0.3247 1.1648 0.3247 0.3247 2.4052 3.0392 1.2363 0.3247 1.7718 0.3247 0.3247 0.3247 0.3247 0.3247 0.6560 0.3247 0.3247 0.6550 0.3247 1.5196 1.5229 0.9377 0.6913 0.8657 0.3247 1.0796 0.3247 0.6518 1.0159 0.3247 0.3247 1.2499 0.3247 0.6016 0.9248 2.7309 0.5190 1.0394 1.7327 1.1531 1.6047 0.6175 1.2057 1.1213 0.3247 0.8005 0.7448 0.4060 0.6521 0.3247 0.3247 0.7312 0.5600 1.1139 1.0130 0.7552 2.0303 1.0586 0.3247 1.1452 1.6275 3.6685 0.5406 1.4888 1.3462 0.7542 0.3247 0.3247 0.8855 0.8613 0.8547 0.3247 0.7849 1.1794 0.9736 0.9983 0.3247 0.3247 0.3247 0.3247 0.6214 0.6200 4.7065 0.3247 1.2177 0.9129 7.1657 glycochenodeoxycholate 1.1584 0.7959 0.1132 1.0020 0.8240 0.8870 0.7186 0.4077 0.0484 0.3654 3.0738 0.4988 1.0000 1.7429 0.4642 1.4825 0.9268 0.6338 0.1887 1.0556 1.1405 2.6366 0.7978 0.8575 3.0006 2.7287 1.0819 1.2598 4.0703 1.7606 2.3259 2.2320 0.8615 1.3501 2.9131 2.8047 4.4721 3.3922 1.7859 3.0085 5.2660 0.4638 0.6535 0.2918 0.6674 3.6899 0.6416 0.4183 0.0546 1.4432 2.0546 1.1186 0.8561 1.0367 0.6374 1.3314 1.0388 0.9318 0.2195 1.0322 0.8956 1.4003 0.8276 0.5534 0.1828 0.9678 0.1757 0.1399 0.1105 0.0975 0.9064 0.5392 0.9845 1.1751 2.7654 3.4553 3.3288 2.1122 1.8756 1.1126 0.6569 0.9254 2.3042 0.4185 0.4162 1.3172 1.4605 0.8348 2.7769 0.2596 0.6600 1.0881 0.4130 0.8324 0.7111 0.7988 0.6398 3.6007 1.2273 1.1311 2.9934 4.4653 3.5170 0.4475 1.0644 1.0118 4.0113 0.1810 3.5112 0.6531 0.9518 0.0798 0.3186 0.3345 0.1990 0.8056 0.4611 0.5027 0.3818 0.8173 0.6408 0.7115 1.5286 1.1204 0.6685 0.8461 0.2106 0.8462 1.6932 0.2637 0.5972 5.8174 0.1398 0.5405 0.5835 1.6549 1.0829 1.9657 2.9178 1.3558 1.9879 1.4977 2.1351 6.1327 0.4018 1.2091 1.1600 0.7717 0.8588 0.4666 1.9427 0.7321 2.8814 0.7871 0.5973 0.3558 1.2019 1.2694 0.4867 1.2179 1.9120 1.4957 0.5251 0.9549 1.8396 1.2152 1.1913 1.4904 4.5021 1.1148 4.3354 1.0453 3.0229 2.5112 1.3402 3.5030 0.1041 0.0588 0.5935 0.2151 0.4151 1.6044 2.6220 0.2759 2.3841 0.8299 2.1976 glycochenodeoxycholate 3-sulfate 0.5910 0.5771 0.4359 0.4478 0.9903 1.5413 0.4755 0.1521 0.1521 0.1521 0.7447 0.1521 0.1521 0.6989 0.1521 0.3534 0.4551 0.4230 1.4233 2.4760 1.0754 2.7435 0.4322 0.8404 0.7993 1.0743 0.4587 0.5166 1.3588 2.9340 2.5467 3.8869 0.8292 2.5659 2.9179 5.0561 2.5464 2.4368 5.0437 2.4441 1.9980 0.1521 0.5389 0.1521 0.4836 0.3224 0.1521 0.9092 0.1521 0.7586 1.0821 0.8334 0.4225 2.6707 2.0691 3.2267 1.5188 0.5072 0.9658 2.5973 1.6151 0.4148 1.0067 0.7295 0.1521 0.4882 0.4009 0.1521 0.1521 0.9474 1.3560 1.2945 0.6553 1.5237 1.0541 2.0866 1.8628 1.7216 2.0902 1.3280 0.7429 1.0894 1.0097 1.2612 1.0866 1.9056 1.1147 0.5273 1.8495 0.1521 0.5893 0.7172 0.1521 0.1521 0.9239 0.5009 1.0569 0.9565 0.7016 0.5801 0.1521 1.3933 0.5147 0.4877 1.9854 1.0421 0.8722 0.3678 0.7260 0.2573 0.1521 0.1521 0.1521 0.1521 0.1521 0.9602 0.6163 2.7162 1.3512 2.0460 1.9190 0.8093 0.9680 0.8283 2.8887 2.8951 0.5458 2.5864 4.4618 1.1445 0.6275 1.7219 0.5734 1.0175 1.4809 0.8759 0.5556 0.5700 0.4366 0.5297 0.7417 4.2819 5.9433 4.7619 1.3786 4.5561 3.2031 2.2745 1.6485 1.1949 1.8052 1.5069 2.0198 0.6304 0.6083 0.3457 1.1725 0.6422 0.1521 1.2025 1.6524 1.9141 0.8670 1.0000 1.5645 0.2504 0.3034 1.1452 0.6891 0.5157 0.5154 0.6601 0.5370 0.5034 0.7326 0.7701 0.6694 0.2350 0.8738 0.6547 1.1101 1.3480 2.1268 1.3139 2.4388 0.5256 1.8680 glycochenodeoxycholate glucuronide (1) 1.6280 1.0009 0.6261 0.2092 0.8832 2.2727 0.5552 0.2092 0.2092 0.4829 1.3568 0.2092 1.3340 1.3492 1.0148 1.3794 1.1148 0.2092 0.2092 0.7724 0.5465 0.4808 0.2092 0.9355 0.9551 0.8598 0.7619 0.5657 0.9877 1.5687 1.8985 1.7695 0.5642 1.0712 1.2077 1.2324 0.8528 1.1203 1.2189 1.1513 0.7186 0.9418 0.9991 1.3479 0.8599 2.7530 0.8539 0.2092 0.2092 0.6514 0.2092 0.2092 0.2092 0.5651 0.2092 0.8514 0.6040 0.4304 0.8378 1.7583 0.9549 0.5893 0.8693 0.3437 0.2092 0.2092 0.2092 0.2092 0.2092 0.2092 0.6150 0.7321 0.5710 0.6174 0.7808 2.5640 3.0735 1.6185 1.8955 1.7001 0.2092 0.7647 1.3684 0.2092 0.7469 0.8184 1.0176 0.7736 2.0431 0.2092 1.0000 0.6629 0.9542 0.9393 1.5525 0.8468 1.0007 1.4258 1.2920 0.7152 0.9643 1.4977 0.9065 0.3606 1.4482 0.6573 0.5079 0.2092 0.7531 0.9150 0.5774 0.5211 1.2054 0.2092 0.5053 0.2092 0.2092 0.6587 0.2092 0.7525 1.1237 1.1001 0.5120 0.7851 1.1295 3.6943 1.7804 2.4841 3.1715 0.9325 0.8107 2.4476 0.6730 1.4548 0.9960 3.7418 3.8703 4.2846 3.1105 3.0577 4.6994 0.8324 1.2109 1.3218 0.6172 1.1144 0.9878 13.1194 10.7852 15.0572 15.5154 10.5251 15.8596 1.0084 1.3272 1.2789 2.2430 0.8282 1.0422 2.0168 2.0277 3.1961 1.9203 2.4829 2.2605 0.4102 0.2092 1.9717 1.5664 1.3671 0.5414 0.6060 0.8382 0.5739 0.8775 0.6858 0.2092 0.4968 0.4467 0.9358 1.4932 1.1486 1.4038 0.7653 1.4376 0.7836 2.2223 glycocholate 0.9977 0.7391 0.2664 1.0274 1.0431 0.9122 1.8772 1.2237 0.1496 0.7038 7.9987 0.2178 0.8459 1.9031 0.2314 0.7345 0.9096 1.2467 0.3628 4.6535 3.3575 8.8792 0.9684 0.7180 4.0098 1.9661 0.4196 1.2902 3.4041 1.1817 2.3023 1.4334 0.4747 0.8177 4.1986 1.9618 2.9757 1.8777 1.8291 0.8695 3.0017 0.4508 0.3730 0.3258 0.7377 5.0865 0.6580 0.6211 0.1198 1.2138 2.2973 1.1986 0.7731 3.8127 0.3048 1.2060 0.8657 3.5969 0.8355 1.8814 1.3832 1.6402 1.1231 0.3999 0.1047 0.3325 0.2406 0.1221 0.1288 0.1167 0.5695 0.4335 0.5100 0.7442 2.5277 3.4736 3.2471 2.7624 2.1352 1.0047 1.4041 1.9885 1.6014 1.3017 0.4610 1.0023 1.4103 1.0009 4.6941 0.8936 1.3588 2.0669 0.4451 0.3054 0.6285 0.4843 0.4221 3.3899 0.8967 0.8752 1.8798 2.2619 2.2225 0.2048 0.7668 1.3762 2.2227 0.0669 3.1670 0.7810 0.6855 0.0669 0.4836 0.9266 0.8098 0.4292 0.1714 0.9739 0.2658 0.8296 0.3028 0.2616 0.6851 0.9991 0.3003 0.9683 0.1185 0.3163 1.2304 0.3612 0.6310 7.9256 0.0973 0.7236 1.0472 1.8660 1.0144 2.8810 2.3441 1.1576 2.2762 2.1144 4.1677 6.1429 0.7299 2.7534 1.5555 0.9002 0.8171 0.3507 1.1429 1.1328 2.0747 0.9164 1.0752 0.4189 1.8962 1.2748 0.7040 0.5849 2.1642 2.1376 0.3381 0.7351 2.1463 1.4282 1.8214 1.8239 5.3263 1.1689 3.3739 1.2198 4.0975 2.0726 0.5934 3.4841 0.4196 0.2373 0.8685 0.6447 0.7699 0.9326 3.3478 0.3429 1.8667 0.8499 4.2464 glycocholenate sulfate* 0.9126 0.9048 1.3380 0.6943 0.7743 1.0543 0.7069 0.5553 1.1310 0.6173 0.6571 1.2197 0.8774 0.8484 0.9286 0.9274 0.9409 0.4036 1.2829 0.8024 0.6001 0.6390 0.5742 1.4546 1.0411 1.3287 2.0409 1.1276 1.6086 1.1528 2.0031 1.1809 0.7211 0.8118 0.8350 1.0963 1.0281 0.8972 0.8985 0.7845 0.8109 1.0006 0.7093 0.8779 0.6360 0.8940 0.7513 0.6860 1.6989 1.0000 0.6015 0.8071 0.4360 0.8946 0.6250 0.9670 1.0608 1.6290 1.8044 1.3679 1.3844 1.0952 1.2502 0.8245 0.8574 0.7197 0.7452 0.9512 0.7000 1.3180 1.1178 1.2691 1.3453 1.0413 1.4784 1.4859 1.5383 1.2881 1.3674 1.0957 1.0425 2.9677 1.3723 0.7927 1.7206 1.4898 1.0574 0.7912 1.0242 0.9088 0.9585 1.0039 1.0148 0.9773 1.0435 1.2099 1.5907 0.9160 0.8320 0.7992 0.9440 0.7818 0.9612 0.3401 0.7424 0.5725 0.2638 1.0733 0.6158 0.5242 0.6965 1.2259 0.2867 0.2305 0.2590 0.8260 0.7387 0.9119 0.6982 1.0712 0.9825 1.1226 0.9737 0.9729 1.0951 1.7637 2.0472 1.9104 1.6547 0.7483 1.0130 0.9767 1.6280 1.0407 0.7093 1.7330 2.1791 1.0182 1.7920 1.4363 1.4876 0.5538 0.7850 0.7525 0.6490 0.8610 0.6790 3.6111 2.8932 4.3894 3.8479 2.8508 3.4172 0.8880 0.8978 0.8991 0.7749 0.9724 0.9961 1.2752 1.4581 1.0563 1.3551 1.2685 0.9875 0.6661 0.4162 2.7264 1.6247 1.5289 0.9684 1.8387 1.1716 1.0949 1.4735 1.4218 0.1103 2.2739 0.1887 0.9995 1.1803 1.4946 1.2997 2.2718 1.7714 1.3249 1.5048 glycodeoxycholate 1.9194 1.3814 0.1354 1.4752 1.5919 1.6540 1.5147 0.9705 0.0423 0.7667 5.5538 0.7038 3.0369 3.0399 1.2313 2.3491 1.7296 0.4260 0.1743 1.0924 1.0046 2.2317 0.6321 0.7904 5.2907 2.3337 0.6562 1.7551 4.3335 0.9954 1.5260 1.4968 0.5461 0.6422 2.1514 1.5825 2.9313 2.0284 1.3174 1.5759 3.7073 0.9242 0.6955 0.7330 0.9130 9.5090 0.8559 0.2310 0.0216 0.7637 1.1589 0.4823 0.4550 1.1372 0.2513 0.8122 0.7381 0.7253 0.1950 1.2654 1.2696 1.9780 1.1067 0.5272 0.2814 1.0923 0.2744 0.1794 0.1923 0.0660 0.4711 0.3301 0.5936 0.5989 2.2484 7.8448 8.0534 4.6372 3.5152 2.0269 0.4192 0.6290 1.4476 0.2907 0.4144 0.9025 1.6764 0.8856 3.9663 0.2917 0.9768 1.5349 0.1731 0.6442 0.4891 0.4729 0.3071 6.1232 1.9943 1.5653 4.0633 5.9673 5.1118 0.4749 1.2296 1.3557 4.4935 0.1494 5.1320 1.3847 1.7038 0.0971 0.7089 0.5721 0.5494 0.5400 0.3283 0.4224 0.2207 0.4828 0.2902 0.2844 0.5460 0.5166 0.2660 0.5603 0.1017 0.4628 0.9494 0.2943 0.5606 6.3651 0.1079 0.6534 0.7891 2.1227 1.1256 2.2851 4.0183 2.4904 2.4479 0.8162 1.1707 3.2371 0.0216 0.6724 0.7042 0.3172 0.4834 0.1182 0.6142 0.5733 1.3984 1.5476 1.3752 0.9439 2.6002 2.1515 1.0141 2.7692 4.4904 5.2729 1.2515 2.9334 3.5418 1.2992 1.0343 2.6653 7.0936 2.1121 3.7926 1.0295 3.2927 2.9654 1.2183 4.2241 0.0790 0.0479 0.3892 0.2089 0.3345 0.5395 1.8013 0.1721 1.0553 0.5227 1.6825 glycodeoxycholate 3-sulfate 1.6163 1.3113 0.9637 1.1389 1.7995 3.3871 0.6560 0.3202 0.2133 0.2716 0.8602 0.2881 0.8215 0.9051 0.5619 0.8749 0.7206 0.4072 0.8163 1.3286 0.5161 1.5877 0.2376 0.7883 1.4316 1.1804 0.4758 1.0181 1.3307 1.0894 1.6510 1.6099 0.4922 0.9613 0.8728 3.7676 1.3745 1.2155 2.8479 1.1990 1.4062 0.5332 0.6659 0.6217 0.5213 1.0381 0.3995 0.6372 0.2133 0.6824 0.9152 0.4825 0.4766 1.7991 1.0000 1.6410 0.6701 0.3255 1.0421 2.9490 2.0461 0.3916 1.4565 0.5485 0.2133 0.4617 0.2793 0.2892 0.2321 0.5287 0.9690 0.9517 0.6376 1.1910 1.0526 6.8369 6.8010 4.6685 5.6384 3.4386 0.5860 1.6642 1.0732 0.5741 1.2285 1.3121 1.2637 0.7116 2.1300 0.2351 0.8096 1.3912 0.2133 0.4145 0.8444 0.5523 1.0510 1.2154 0.8221 0.7267 0.4049 1.2752 0.7239 0.4075 1.7079 0.7573 1.0818 0.4203 0.8150 1.6508 0.6747 1.2007 1.2440 0.6750 0.8148 0.9181 1.0310 2.2084 1.4077 0.8083 0.8079 0.3592 0.3779 0.3849 1.4655 1.8934 0.2954 1.6807 2.6741 0.9821 0.9553 2.5985 0.8137 1.2450 2.2546 1.4814 0.9268 1.0356 1.2152 1.2418 1.0427 2.0713 1.9115 1.7266 0.6030 1.7500 1.3925 4.1760 4.2277 3.1422 4.4076 6.2074 4.6821 1.1367 1.0267 0.9874 2.4057 1.6078 0.6170 5.2403 5.4135 6.1887 3.4014 5.1525 3.5007 0.3350 0.5022 2.7235 1.6969 1.2856 0.5478 0.7660 0.5913 0.7856 0.8096 0.7412 0.3672 0.2133 0.4660 0.5550 0.6876 0.7325 2.0714 0.9656 1.5453 0.5012 1.6852 glycohyocholate 0.7898 0.4350 0.4350 0.7551 1.0819 0.6719 0.4350 0.4350 0.4350 0.4350 1.2755 0.4350 0.4350 0.8309 0.4350 0.4350 0.4350 1.3825 1.3094 5.6097 6.2943 10.3870 1.3723 0.7032 1.9791 1.6712 0.4350 1.5011 2.0569 0.9414 0.4350 1.0912 0.4350 0.5664 2.0263 1.9807 1.6160 1.5103 2.3613 0.9774 1.6189 0.4350 0.4350 0.4350 0.4350 0.7725 0.4350 0.4350 0.4350 0.4799 0.6881 0.4350 0.4350 1.7402 0.4575 1.0553 0.5465 0.4526 0.4350 0.7897 0.6928 0.6401 0.4350 0.4350 0.4350 0.4350 0.4350 0.4350 0.4751 0.4350 0.8842 0.6793 0.4350 1.1445 1.4264 4.4644 2.0869 2.8600 1.9559 0.9736 0.4350 0.4350 0.5251 0.9209 0.4350 0.7954 0.8316 0.4350 1.3010 0.4350 0.4350 0.5941 0.4350 0.4350 0.8299 0.4350 0.4350 0.7809 0.5003 0.4515 0.4350 1.0941 0.4350 0.8691 2.7024 5.6536 3.3129 0.4350 3.0361 0.4350 0.4350 0.4350 0.4350 0.4350 0.4350 0.6032 0.4350 1.8988 0.4913 1.8986 1.1967 0.6457 1.1244 1.5371 0.6729 0.8283 0.4350 0.5089 0.5177 0.9447 0.4350 2.4471 0.4350 1.5288 2.6917 0.7302 0.5392 0.4999 0.6120 0.4350 0.4350 2.5007 3.0140 4.2198 0.4350 2.5440 1.3288 0.4350 0.4350 0.4350 0.6129 0.4350 0.6878 0.5033 0.5134 0.4350 1.1096 0.7986 0.4350 0.5375 1.5731 2.1015 0.4350 0.8226 1.1055 0.4350 0.4350 0.4350 0.4350 0.4350 1.1509 0.4350 1.1230 1.2219 0.8161 1.0226 0.7690 0.4350 0.7251 0.4350 0.9558 0.5291 2.5186 0.4350 1.3926 0.5170 2.8898 glycolithocholate 0.7223 0.3213 0.3213 0.3213 0.3213 0.3213 0.3767 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 1.2215 0.9812 1.7660 0.3213 0.3213 2.0790 0.3213 0.3213 1.5907 1.6445 0.3213 0.3213 1.5468 0.8943 1.5869 0.3213 0.3213 0.7575 0.3213 0.7940 0.6450 0.3213 1.2201 1.2105 0.9826 0.3213 0.3213 0.3213 1.2100 0.4720 0.3213 0.3213 0.3213 0.3213 0.7360 0.3213 0.3213 0.3213 0.9105 0.8044 0.3213 0.3213 0.5683 0.3213 0.3213 0.5975 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.7928 3.6452 1.4262 1.4972 0.8811 0.3213 1.2620 0.3213 0.3213 0.3213 1.2573 0.3213 0.3213 0.9669 0.3213 0.3213 0.6989 0.3213 1.0188 0.3213 1.5647 0.6954 6.3269 1.2642 0.5724 1.9977 1.2482 1.6045 0.3213 0.3213 0.3213 0.7284 0.3213 1.0174 3.0748 0.9310 0.7279 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.5217 0.3213 0.3213 0.3213 0.3213 0.3213 0.4380 0.3213 0.3213 0.3213 0.3213 0.5132 0.3213 0.3213 0.3213 0.3213 2.2264 1.2459 0.7693 3.4929 1.6962 1.2619 0.3213 0.4104 0.9085 0.3213 0.4079 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.7923 0.6537 3.3499 0.8565 0.3213 0.8765 0.3213 0.3213 0.3213 1.1007 0.3213 0.9085 4.4314 8.7317 3.4746 0.3775 0.6099 2.8667 3.0717 1.6409 3.0177 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 0.3213 glycolithocholate sulfate* 1.6111 1.0846 0.8613 0.5977 1.4527 1.5627 0.8767 0.5120 0.6110 0.4758 0.8186 0.3319 0.6275 0.5892 0.7108 0.7919 0.6470 0.1176 0.7804 0.8568 0.4221 0.7324 0.3334 0.9118 1.1172 0.4235 0.4109 1.3277 0.6903 1.1468 2.0236 1.6570 0.5391 0.3680 1.0802 2.1812 1.1136 1.1741 1.2767 0.8054 0.6861 1.0605 0.9505 1.3471 1.1816 2.2109 1.1988 1.3153 0.7531 1.4631 0.6519 1.1311 0.1663 1.0318 0.4169 1.5846 0.8675 0.6375 1.5785 2.5363 2.0740 0.5866 2.3468 0.8323 0.2456 0.6241 0.4608 0.5717 0.4291 0.3510 0.8032 1.0732 0.3497 0.6364 0.8335 1.6421 3.4481 2.2465 2.3152 1.5733 0.5898 3.9253 1.5313 0.3086 2.4507 2.5788 0.8463 0.4888 2.4788 0.4690 1.1559 1.5762 0.4416 0.7933 1.0334 1.1359 2.0786 1.3802 0.9806 0.5252 0.4547 0.5193 0.6266 0.3308 2.2482 1.1763 0.3396 0.6772 0.6592 1.3689 0.4640 1.0825 0.8707 0.3091 0.4965 0.7780 0.3451 2.3487 0.8268 2.1212 1.2056 0.7958 1.2610 1.1685 1.6647 2.0110 1.0100 1.7914 2.9830 0.7145 0.7987 1.4397 1.1787 1.1439 0.9900 1.7272 1.8300 1.4272 1.7988 1.6875 1.7834 1.7660 2.4559 1.5941 0.6855 1.8863 1.4683 0.8322 1.1420 0.4961 0.6857 0.8494 0.9931 0.3842 1.1091 0.8140 1.4085 2.1701 0.7640 0.9084 2.5280 2.5626 1.2144 1.9098 1.2955 0.3146 0.3087 4.4150 2.0101 1.8015 0.2918 1.1594 1.0000 1.3425 0.6546 1.3412 0.0542 0.6730 0.1627 0.6396 0.7738 1.0676 1.7626 1.1195 1.6936 0.6625 2.7242 glycoursodeoxycholate 1.6020 1.2688 0.1957 1.3623 1.7948 1.3858 1.2480 1.0624 0.0528 0.8621 4.3333 0.8408 2.7259 2.4958 0.9769 2.2852 1.8948 0.4710 0.1814 1.2154 0.9871 2.0455 0.4460 4.8444 17.6857 15.6313 4.7606 8.6359 19.7621 4.4820 4.3408 7.3886 2.6266 3.4753 12.5359 2.4727 3.1455 2.7205 2.0597 2.3775 5.0369 0.3230 0.4542 0.3032 0.5064 2.1093 0.4381 0.1233 0.0528 0.3506 0.5829 0.2245 0.3529 1.9014 0.8942 2.0985 1.5602 1.0974 0.0528 0.4949 0.4355 0.7640 0.4100 0.2394 0.3413 1.0842 0.4072 0.2620 0.3214 0.0954 0.6057 0.4418 0.6074 0.8859 1.7030 3.5208 2.9906 3.1249 2.1216 1.1811 0.7361 0.4153 1.6822 0.6452 0.4982 1.2827 1.4149 0.6214 1.4016 0.1259 0.6414 0.7374 0.3774 1.2384 1.0129 1.0538 0.7899 4.4308 3.5990 2.6468 4.0656 7.3173 3.7051 2.3711 4.7863 4.7635 13.5048 0.6199 10.7065 0.3515 0.4579 0.0528 0.1889 0.1752 0.1960 0.6192 0.4055 0.8934 0.3354 0.4649 0.2613 0.3562 0.4761 0.5536 0.6145 1.4549 0.1706 0.9534 1.3249 0.0778 0.0990 0.6612 0.0528 0.1220 0.1783 0.4936 0.2642 0.5845 1.0851 0.7271 0.5040 0.4384 0.4331 1.0798 0.0528 0.3659 0.3604 1.8873 2.4983 0.8200 3.9005 3.0572 5.9884 1.2781 1.1509 0.6719 1.2884 1.4843 0.6098 1.6742 2.5757 2.1226 0.6918 1.6860 1.4550 0.4509 0.4549 0.3927 0.8441 0.4804 6.5273 1.9944 5.7115 5.1550 3.3163 5.4393 0.0528 0.0528 0.1298 0.0944 0.1476 1.0231 2.7397 0.2125 1.6019 0.6691 2.4687 guaiacol sulfate 1.0258 0.4379 0.4529 0.3573 0.5909 0.5261 0.9788 1.1099 0.4147 1.5123 1.1531 1.4394 1.1996 1.1173 1.6346 1.0563 1.6415 0.4518 0.4468 0.5420 0.9036 0.7827 1.1517 1.1678 0.6508 0.6748 0.6028 1.2463 1.1671 2.1514 1.1098 1.7898 0.4102 1.6349 1.5722 0.9819 1.9963 1.8018 1.3516 1.5147 1.7931 1.2385 1.1358 1.5218 1.3587 1.2253 1.0260 1.2668 0.6212 0.6746 0.9861 1.1806 0.4725 0.6545 0.1528 0.3034 0.9194 0.3443 0.8436 1.3707 1.9897 1.4629 1.8108 0.9863 0.8798 1.0252 0.9995 0.6381 0.6622 0.3061 0.6221 0.7310 0.5862 0.7519 1.1276 0.9959 1.6662 0.5448 1.2706 0.9640 0.8388 0.9218 2.1046 0.4866 2.6284 1.6686 1.3210 1.7274 1.2681 0.8206 1.9261 1.6551 1.0024 0.6394 0.6778 0.9926 0.4289 1.6752 1.3273 1.5980 0.8440 1.5287 1.0662 0.5166 0.5905 1.0000 0.4544 0.6219 0.9500 0.9510 0.8094 0.4645 0.7372 0.6217 0.6495 1.0872 0.7417 0.4933 0.7980 1.8145 1.4179 1.6849 1.1703 2.1968 0.3246 1.1462 0.4451 0.9659 0.3536 0.2476 0.1409 0.1862 0.0805 0.2034 0.2108 0.7174 0.5528 1.5750 0.9932 0.6592 1.1297 0.8183 0.7462 1.1777 0.6212 1.4806 1.2171 0.8623 0.8117 0.9743 1.0347 1.0092 2.0755 1.1016 1.3233 1.1888 1.0707 0.6411 1.1830 1.1692 0.6066 0.7500 1.0005 1.1087 1.2447 0.6842 0.5452 0.9541 1.7944 1.9331 0.7568 0.9945 2.3705 1.6250 1.5416 2.0169 3.1234 1.7916 2.5846 2.8996 4.5852 1.7713 0.6116 0.9227 2.3281 1.0215 1.4108 heptanoate (7:0) 1.2383 0.8221 0.9870 0.3804 0.8895 1.1728 2.1815 1.5442 2.2472 1.9151 1.7577 0.8003 0.8317 1.0714 0.6878 0.8828 0.7700 1.1467 1.1239 1.6703 0.6842 0.9267 1.1176 0.3979 1.7305 0.8751 1.0557 0.5868 0.9363 0.7351 4.0377 1.2324 4.2726 1.0169 1.2811 0.8168 1.2425 0.9969 1.7053 3.0684 4.4463 0.7546 0.8067 1.6269 0.9706 1.2759 0.8754 0.9768 1.6766 1.0515 0.9163 1.9780 0.8525 1.0032 0.9055 0.9609 0.7101 0.7069 1.0422 1.1136 0.6716 1.5821 1.2855 0.7083 1.0538 0.7374 1.0558 1.0390 0.7829 0.4496 0.6007 0.6921 1.0394 1.1576 0.9263 3.5873 1.4071 1.1122 1.2899 0.6888 3.3953 0.8461 0.8590 1.8040 1.9100 0.7395 0.8823 0.8619 0.8596 1.1535 0.8319 3.2685 0.9968 0.8665 0.7323 1.3883 4.9793 1.2373 3.1834 0.7139 3.9284 0.7838 1.2271 1.1403 1.3249 1.8545 0.9335 1.1495 2.5570 0.8832 1.8845 1.1891 0.6996 0.6917 1.0923 1.3548 2.6176 0.8307 0.7002 1.3976 1.3150 1.0730 0.9837 0.6446 0.9926 0.7497 0.9447 0.8039 1.1855 1.1033 2.6592 0.8888 1.3717 1.2990 0.8885 1.2040 0.7522 1.0295 1.6171 1.0031 0.7473 1.1601 1.4977 0.9791 0.9115 1.0055 1.2078 0.6050 1.6171 0.5291 0.9004 0.4258 0.6709 0.9877 1.5345 0.8925 0.8147 4.3186 0.8372 0.8161 1.0048 0.9443 1.0565 4.1964 1.2519 0.9475 1.5700 0.9338 0.8244 0.7405 0.3804 1.1381 0.9057 0.9084 0.8721 0.9247 0.9810 1.0899 0.9273 0.9929 1.3080 4.9408 1.2414 0.8020 1.0061 0.8477 0.8938 hexadecadienoate (16:2n6) 2.1634 1.4521 0.1217 0.8454 1.3877 0.3070 1.5104 1.5462 0.1544 0.9326 0.5761 1.2547 1.1058 1.1436 1.4057 0.8174 1.4824 1.0256 0.1380 1.1514 0.3378 1.1330 0.8985 1.5728 1.1424 0.8824 0.3420 2.4079 2.6546 0.8850 0.8785 1.0641 1.4056 0.7897 0.5433 3.0120 1.6082 2.6913 2.1149 2.4218 1.7364 0.4085 0.3773 0.3208 0.4331 0.4753 0.7369 0.7206 0.2917 0.9640 1.9800 2.4322 1.6158 1.0832 0.7923 0.9478 1.0292 0.1701 0.2513 0.5480 0.9568 1.4106 0.8290 1.0397 0.7972 0.7980 0.6964 2.0359 1.0856 1.5265 2.1217 0.8211 3.5908 1.8385 1.7898 0.9080 0.5023 1.7821 1.8236 0.5692 1.0729 0.0693 0.3250 0.8495 1.0319 0.4983 0.6099 0.5028 0.4686 1.0154 0.6626 1.0132 0.9745 0.6785 0.7008 1.3189 0.8653 1.7062 1.2326 0.8553 1.7594 0.4625 1.3440 1.0900 0.5929 1.0241 1.5638 0.1710 0.5010 1.6153 0.4214 0.2509 0.7678 0.5595 1.6382 1.7301 1.0000 0.6336 0.7809 1.4181 0.9929 2.0457 2.0596 1.8352 1.2690 1.3672 0.1896 1.5177 0.8181 1.0593 1.4683 1.6026 0.4702 0.9794 1.3859 1.4234 0.3628 1.3872 2.2987 2.3990 1.9759 1.0005 1.9908 0.8879 0.2463 1.7571 1.0606 0.5356 1.3441 0.7655 5.0019 1.1950 1.4155 1.4014 0.9313 1.0071 1.0751 2.3332 1.7864 0.9557 1.2475 0.4014 1.1677 0.4222 0.9275 1.1556 0.7274 0.2973 1.2189 0.6206 0.9961 0.1611 1.0981 2.1586 0.7416 1.8500 0.6309 0.1755 0.9442 0.6345 0.7314 0.8288 1.2057 0.2837 0.7734 0.6064 0.4448 hexadecanedioate (C16) 0.9740 0.9343 0.3957 0.8117 0.9713 0.8507 1.0869 1.0000 0.6457 0.8503 1.0167 1.6068 0.7590 0.9405 0.6229 0.8332 0.8368 0.4655 0.4779 1.4381 0.4982 0.8694 0.5894 1.8231 1.3342 1.2584 0.9027 2.1219 1.6640 1.2269 0.7829 1.0017 0.7738 0.9585 0.9636 2.1842 0.8256 1.0711 0.9664 0.8337 0.7595 0.8962 0.9935 0.9388 1.0791 1.5871 1.7153 0.6068 0.4424 2.4894 1.5098 0.9311 0.7331 1.1094 1.4904 2.3449 1.3161 0.7822 0.8153 1.5532 1.0229 1.4695 1.0594 0.8995 0.7998 0.9262 0.8527 1.3323 0.8692 0.7082 1.0901 0.8278 0.9246 0.9343 0.7659 1.4456 1.2062 1.7899 1.6751 0.9455 1.4685 0.6124 0.8438 0.7285 1.2166 1.1703 0.5705 0.6353 0.6934 0.8650 0.7231 0.6795 0.7539 1.0228 0.9237 0.8524 0.8868 1.1913 1.0478 1.0288 1.8725 1.2594 1.2892 1.2920 1.2667 0.7402 1.3310 0.5941 0.7115 1.2571 0.7666 0.8698 1.3041 0.9170 1.1297 0.6777 0.9055 1.1808 1.2392 1.3977 0.9513 1.5821 1.2737 1.3328 1.1835 1.0941 0.5060 0.9570 1.5428 0.9291 1.2697 1.3062 0.6239 1.0630 1.0695 0.8903 0.7416 1.0432 1.2546 1.0226 0.9448 0.8929 1.0637 0.7763 0.6318 1.3412 1.1584 2.7507 2.9011 2.7077 4.1491 2.8965 4.1923 0.9983 0.8917 0.9170 0.9571 1.5669 1.1606 0.9164 1.5976 0.8217 0.9517 0.8467 0.9068 1.6008 1.6151 0.8114 1.1838 1.0889 1.4440 1.1017 1.1897 2.2729 1.7096 1.7766 0.6147 0.4013 0.6087 0.6902 1.0203 1.4702 3.7977 1.0143 1.8575 2.4241 1.9144 hexadecenedioate (C16:1-DC)* 0.8884 0.5833 0.4289 0.8148 0.9999 1.0108 0.7697 0.6651 0.5884 0.8826 0.9102 0.9782 0.5660 0.7299 0.6423 0.1737 0.5613 0.5876 0.4395 1.1583 0.5751 0.7679 0.5949 1.2386 1.1953 1.3447 0.7312 2.5059 1.6443 0.6902 0.6142 0.8992 0.6548 0.8371 0.9142 1.5306 0.5706 0.6752 0.5288 0.6319 0.5615 0.8595 1.0869 1.0994 1.2881 1.6868 1.6414 0.4346 0.3272 2.1210 1.3342 0.7343 0.7370 1.0112 1.2501 1.9849 1.0810 0.5507 0.9074 1.6784 1.1202 1.4562 0.8466 0.9232 0.4180 0.4825 0.4280 0.7905 0.4335 0.8190 1.1768 0.8454 1.0001 1.1441 0.7717 1.4988 1.9115 2.2547 1.9173 1.1575 1.2674 0.6136 1.0726 0.8198 1.2372 1.1483 0.5920 0.1737 0.6365 0.6345 0.6001 0.6988 0.7073 1.2363 1.2204 1.1797 1.1006 0.8013 0.8613 0.8041 1.5346 1.1177 0.8875 1.4316 1.5122 0.8561 1.3604 0.7849 0.6810 1.2085 0.8723 0.8741 1.2298 1.0568 1.4353 0.6808 0.8870 1.1960 1.4098 1.5879 1.2794 1.7413 1.5384 1.5010 1.2717 0.9978 0.4000 0.8185 1.4153 0.9642 0.8949 1.3096 0.8573 0.9638 1.0666 0.6228 0.4204 0.6073 0.8754 0.7109 0.7470 0.6631 1.0827 0.6942 0.5602 1.0446 1.1421 3.2249 3.2323 2.7649 3.8001 3.1865 3.7873 0.7821 0.8365 1.0539 0.8857 1.4629 1.1044 1.1942 1.8628 1.0088 1.0987 1.0546 1.0022 1.5486 1.5912 1.0809 1.4263 1.1694 1.5891 1.1825 1.2550 2.4647 2.1135 1.8035 0.6232 0.3843 0.5548 0.3568 0.9099 1.2287 3.8605 1.3909 2.0805 2.6004 2.2860 hippurate 0.8314 0.3383 0.1696 0.1308 0.7341 0.3250 0.6362 1.0298 0.3410 1.6245 1.0085 1.0022 0.8409 0.6151 0.9929 0.6172 1.3482 0.3228 0.2549 0.3308 0.4965 0.8638 0.7535 0.5768 1.2682 0.7051 0.7232 1.3670 1.0870 1.0171 0.3826 1.0366 0.2520 0.5020 1.6440 1.4169 1.6091 2.2643 1.1061 1.8294 2.0127 1.8609 1.3597 2.0376 0.9988 1.3918 0.5995 1.3610 0.3244 1.0447 1.7701 1.3828 0.9873 0.8948 0.4760 0.7155 1.6738 0.6173 0.8206 1.8667 1.7051 1.4782 2.0329 1.7631 0.4076 0.5631 0.5507 0.2656 0.4555 0.2919 0.6685 0.8039 0.4076 0.8336 0.8484 1.1172 1.1958 0.8394 1.5032 1.3719 0.7035 0.5287 0.9043 0.8112 1.7593 0.9658 1.6896 2.4198 1.0664 0.4927 1.4378 1.0317 0.7413 0.6881 0.5387 0.7299 0.3748 0.5886 0.7037 1.2157 1.0779 0.5738 1.4588 0.6032 0.7140 1.4374 0.8931 0.5811 1.8585 1.3268 1.0308 0.4561 1.5851 1.1414 1.2193 1.2820 1.3121 0.7227 1.3028 2.4683 1.7578 1.4232 0.9133 2.2894 1.4834 2.2658 0.8189 2.2628 1.2163 1.1705 0.9644 1.0352 0.6085 1.1199 1.3853 1.1450 0.5203 1.4414 1.1448 1.0000 1.3116 1.6891 1.2947 1.5819 1.7070 3.6764 2.1119 0.5014 0.9885 0.5636 0.6428 0.7243 1.0256 1.0039 1.7711 0.9197 1.5822 0.5812 1.1145 1.2317 0.7915 0.6722 1.2470 0.9797 1.2011 0.9961 1.4482 0.6260 2.3430 1.7644 0.7256 0.3720 1.4210 0.9083 0.7784 1.5142 1.3980 0.5714 1.1706 1.6590 1.5418 0.9565 0.4236 0.1306 0.4868 0.2624 0.2528 histidine 1.0980 1.1279 0.7011 0.8274 0.7495 0.7363 1.2144 1.0914 0.7605 0.8542 0.9594 1.0377 0.9429 1.0571 0.9274 1.0000 1.0002 0.7261 0.5627 0.7833 1.0339 0.6930 1.1043 0.8694 0.9061 0.7507 0.5920 1.0168 1.0283 1.0909 0.6902 1.0766 0.7701 0.7480 0.8137 0.8934 0.9768 1.0322 0.8921 0.9062 0.8989 1.0795 1.1424 1.2132 1.1140 1.1193 0.9906 1.2728 0.6752 0.6871 0.7171 1.0208 0.5830 1.0857 0.6567 0.7291 1.0449 0.6468 0.6606 0.7722 1.1166 0.9588 1.0561 0.8466 0.9697 0.9133 0.8663 0.8611 0.9073 0.9585 0.8324 0.6138 1.0932 0.9074 1.2466 1.2265 1.1724 1.0455 1.1187 1.2058 0.9227 0.8589 0.8959 0.8852 1.5032 1.4839 1.0146 1.0062 1.1024 1.0597 1.0132 1.1547 1.1270 1.0899 1.0221 1.1624 0.9748 1.0258 0.9893 1.0007 1.0258 1.0741 1.0523 1.0024 1.0274 1.3484 1.1267 1.0022 1.3526 1.3496 1.2627 0.7709 0.7642 0.8088 1.0794 1.2132 0.9803 0.8869 0.9145 0.8861 0.8385 0.8785 0.7451 0.8253 0.7748 1.0249 0.6843 1.0429 0.6996 0.8459 1.0711 0.6856 0.7816 0.9993 0.9546 0.9612 0.8186 1.2328 1.0316 0.8944 1.1869 0.9533 1.0441 1.1939 0.8699 1.2492 0.9909 0.7669 0.8632 0.7644 1.0542 0.9008 1.0648 1.0145 1.0710 1.0886 1.0332 1.0957 1.0600 1.0703 1.0243 1.1196 1.1165 1.0928 1.2027 0.7036 0.5644 0.6402 1.0792 1.1425 0.9190 0.6270 1.1850 1.1142 0.8204 1.2754 0.6122 0.6294 0.5618 0.9202 0.6262 1.6146 1.3009 1.0322 1.5840 1.0762 1.0258 hydrochlorothiazide 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 1.0853 0.8610 0.9084 1.1256 0.9147 1.4815 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 0.8610 hydroquinone sulfate 0.3252 0.3252 0.3252 0.3252 0.3252 2.2524 0.3252 0.7375 0.3252 0.3252 1.1234 0.3252 0.8862 1.9021 0.8574 0.3252 1.1127 0.6849 0.3252 0.8727 0.9902 0.3252 0.3252 1.0241 0.7526 1.7388 0.7999 0.3252 0.6507 1.4627 0.7089 0.7582 0.9370 1.3253 0.5600 0.7245 1.5557 0.4561 0.5981 1.5610 0.5778 1.5113 0.9945 1.3550 0.8549 2.3871 0.6260 1.5325 0.8173 0.7299 0.3252 1.6398 0.5478 0.3288 0.3252 0.3252 0.3252 0.3252 0.3252 0.3252 0.3252 0.3252 0.8666 0.3252 0.3252 0.3252 0.3252 0.3252 0.7463 0.3252 0.8945 2.8156 0.6199 1.5743 2.4762 1.1456 0.3252 0.3252 0.3252 0.8345 0.3252 0.3252 0.6757 0.3252 0.3252 0.6536 0.9094 0.6047 6.8944 2.2728 1.6489 1.2980 0.7965 0.3252 0.4975 0.3252 0.3252 2.2879 1.5578 1.4018 3.7986 4.0707 2.7256 0.8157 1.2312 0.3252 0.4712 0.3252 0.7616 0.3252 1.0462 0.3252 0.9851 0.3252 0.3252 0.3252 0.3252 0.6125 0.3252 2.3410 1.1681 1.0963 0.3252 0.3252 0.3252 0.8108 0.3252 0.3252 0.4127 0.3252 0.3252 0.3631 0.3252 0.3252 0.3252 0.3252 0.3252 0.5764 0.3252 0.3252 0.3252 1.0055 0.3252 1.4610 0.3252 1.0706 0.3252 1.0210 0.8710 0.5571 1.2187 1.3349 2.1381 0.4888 1.3864 0.3252 0.5884 0.3252 0.3252 1.3789 0.8764 1.6457 1.0098 1.1070 1.8669 0.3252 0.3252 1.1361 0.7432 1.7401 0.3252 0.8719 1.9662 0.3252 1.3218 1.5725 0.9555 0.3252 0.3252 1.9660 0.9346 2.2674 0.3252 0.3252 0.3252 0.3252 0.3252 hyocholate 0.6804 0.6741 0.4222 0.4222 0.5286 1.0504 0.6231 0.7258 0.7494 0.8104 0.5533 1.0903 1.5236 0.9278 1.6600 1.7633 1.9152 0.4222 0.4222 1.3379 1.0056 0.4222 0.6357 1.3780 1.2597 0.9457 1.1028 1.0316 1.1155 1.2205 0.7994 0.6535 0.9411 0.9473 0.4222 1.2044 1.0258 0.7933 0.9942 0.9351 0.8238 0.4222 0.4222 0.6902 0.4222 0.6258 0.4222 0.8547 0.4222 0.9317 0.9550 0.4222 0.4222 0.9433 0.7555 0.7935 0.9215 0.8075 0.8767 1.8383 0.4222 1.4232 1.2142 1.3589 0.4222 0.4222 0.4222 0.4222 0.4222 0.4222 0.6216 0.8761 1.2074 1.1296 0.8388 2.8722 2.2812 2.2337 3.2901 2.2207 0.8710 0.4222 0.4222 0.4222 0.4222 0.4222 0.4222 0.8506 1.2165 0.4222 1.0822 0.8590 0.4222 0.9903 0.4222 0.4222 0.7411 0.6318 0.8170 0.9024 1.1087 1.0218 1.1380 1.7249 2.0695 2.0222 1.8320 1.5021 2.2166 0.4222 0.4222 0.4222 0.4222 0.4222 0.4222 0.7424 0.8628 0.4222 0.7940 0.4222 0.7027 1.7064 0.4222 0.4222 1.1205 1.0340 1.0029 1.0803 2.6742 1.0108 1.0818 1.0682 0.8865 0.7760 1.1073 1.4672 0.8031 0.4222 1.0058 0.8849 1.1800 0.7463 4.3621 0.4222 0.4222 0.4222 1.2732 2.7670 0.4222 3.1597 1.9214 0.4222 0.6973 0.7153 0.6924 0.7554 1.1045 0.9253 0.4222 0.4222 0.9971 0.8223 1.0697 1.2950 0.4222 0.6911 0.4222 0.4222 0.4222 0.5873 0.4222 0.4222 0.4222 0.4222 0.6713 0.5474 0.4222 0.9148 0.4222 0.9266 1.1339 1.7814 1.9365 1.4324 1.4396 0.8507 1.4599 hypoxanthine 0.8002 1.2038 0.7358 0.6400 1.1030 0.4527 1.4506 1.2916 0.8821 1.4646 0.5066 0.6397 0.5095 1.0419 0.7295 0.5600 0.8547 0.9475 0.6059 1.0198 1.0699 1.1384 1.3191 1.0624 0.7324 1.6645 1.2763 1.0044 1.4903 0.9970 1.5128 1.2636 1.2653 1.0923 1.2873 1.3145 0.9017 1.2812 1.1443 1.2619 0.9838 0.6772 0.6125 0.8281 1.1200 0.7672 1.3168 1.4827 1.1966 1.4313 1.1732 1.7560 1.2374 1.0921 0.6973 0.8760 1.4723 0.7884 1.2686 0.8476 1.1120 0.7328 1.1494 1.0693 0.8382 1.0226 1.4526 0.9426 0.9507 1.0029 0.9422 0.6299 1.1546 1.2127 1.0000 0.6737 0.9617 0.8508 1.3689 0.8251 0.8457 1.1358 1.6555 0.6376 1.0200 0.7980 0.6928 0.7674 0.3245 1.5940 0.6944 1.3151 0.9053 1.0083 0.9890 1.2868 0.7941 1.1984 0.6200 0.6729 0.7286 0.5668 0.9889 0.6747 0.8170 1.3926 0.4928 0.6804 0.7588 1.4417 1.4084 1.0647 1.0212 1.5543 0.7185 1.6862 0.7153 0.4966 0.6861 0.8095 0.8755 1.2394 0.8047 0.9362 1.4155 0.9080 0.7317 0.8939 0.8501 1.4386 1.9285 0.9567 1.0030 1.6380 1.1340 0.6072 0.9310 1.0445 0.9124 1.6729 1.2332 0.9345 1.4195 1.4770 1.0264 1.6123 1.4154 0.8113 1.0736 1.1505 2.0466 0.8546 1.3624 1.1837 1.2488 1.0154 0.6682 1.0529 1.4825 0.6114 0.6528 0.4597 1.2126 0.6357 1.4200 0.7604 1.0709 0.6937 0.6753 0.5736 0.7174 0.9383 1.0939 0.7641 0.9449 0.8582 1.1723 1.7383 0.8073 2.0076 0.8856 1.3528 0.4560 2.2801 1.0132 0.3974 0.6710 indoleacetate 1.1575 0.7752 0.5773 0.8941 0.9715 1.2936 0.9431 1.0000 0.9244 0.6699 1.3473 1.0297 1.2675 1.3307 1.2211 1.5220 1.3557 0.6108 0.3665 0.5811 0.7534 0.7096 0.7748 1.2022 0.9859 2.3135 0.8319 1.6430 1.2326 1.2981 1.0114 1.3341 0.9378 1.1395 0.6064 0.4546 0.8134 0.7410 0.7762 1.2039 0.7074 5.6592 4.1808 2.6252 2.1833 4.4100 1.4183 1.4897 0.8438 1.2729 1.1979 1.3271 0.9225 1.2549 0.9523 0.9500 1.2619 0.6965 1.1502 2.2820 1.9299 2.1243 1.9748 2.2732 0.4842 0.5190 0.4132 0.3721 0.3855 0.3512 0.6363 0.5621 0.5958 0.8262 0.7353 0.7036 0.6805 0.3720 0.6717 0.6897 1.1032 0.4226 1.0590 0.9661 0.9728 0.8027 0.5652 0.5224 0.9112 0.4888 0.8120 0.7570 1.0477 0.8361 1.1446 1.0635 0.6693 0.7068 1.0201 0.8903 0.6358 1.1926 0.8726 0.8485 2.0212 2.3402 1.7661 1.1481 2.3421 1.0821 0.9070 0.7705 1.3941 1.3682 0.7583 0.6488 0.7341 0.7193 0.5790 0.7722 0.9624 0.8617 0.3803 0.4885 0.9431 3.0903 0.7050 1.5078 1.1323 1.1854 1.1601 2.0693 0.6657 1.4463 1.3399 0.7023 0.7778 0.9405 1.1256 0.8431 1.0142 2.9918 4.0593 3.1691 2.8064 5.2085 2.3954 1.2618 1.3205 0.8396 1.4587 1.7278 1.2335 1.1169 1.8156 1.0658 1.5948 0.9965 1.6288 1.2729 1.0082 1.4908 1.2416 1.0035 1.2761 0.9722 0.5989 0.6921 1.1215 1.2839 1.8015 1.3990 2.1148 2.2236 1.7004 2.5796 1.0379 0.6193 0.7565 1.1132 0.9634 0.6310 0.9592 0.5223 0.8819 0.7088 0.5147 indolelactate 0.7497 0.6590 0.6648 1.0212 1.2631 1.5101 0.7792 0.7647 0.7180 1.1607 1.5377 0.8974 0.8746 0.8821 0.8963 0.8393 1.0002 1.5640 0.9453 1.6866 1.1807 1.6609 1.0834 0.6552 0.4405 1.0322 0.5292 0.7831 0.6213 1.0907 0.9747 1.1023 1.5475 1.4867 1.5782 0.5454 1.0251 0.8156 0.7600 0.8554 0.7571 0.9542 0.8979 0.9836 0.8941 0.8919 0.7838 0.5940 0.6228 1.3721 1.0362 0.5351 0.8442 0.7603 1.1537 1.1342 0.7295 0.7953 1.5483 2.2654 1.5733 1.8512 1.5805 2.1313 0.5227 0.4111 0.3514 0.3076 0.4077 0.6749 1.3439 1.5110 0.7398 1.2057 0.8497 0.8761 1.0016 0.6362 0.7726 0.8046 1.2170 0.6350 1.4480 1.0087 0.6756 0.6548 1.4169 1.3284 1.4035 1.0968 1.4750 1.4864 1.0465 1.1462 1.2831 1.0480 0.9341 1.0057 0.8499 0.8834 0.7401 1.0166 0.9943 1.0931 1.2041 0.8143 1.1345 0.7241 0.8335 0.9006 1.1488 1.0000 1.3637 1.1453 1.1218 0.4374 0.8752 1.0138 0.8039 0.5060 0.8347 0.6665 0.5576 0.6320 0.7968 0.6700 0.6248 0.7213 0.9685 2.6860 1.9366 2.7395 1.7790 1.9537 2.4091 1.3587 1.0062 1.0443 1.3364 1.2116 1.1139 1.5652 1.8461 1.0688 1.0629 1.2084 1.7306 1.5695 1.2959 0.9759 0.9040 1.3335 0.9918 0.7887 0.8520 0.8530 0.7883 0.7593 0.9085 0.7587 0.5650 0.8001 0.7915 0.7621 0.9419 1.5105 1.2468 1.0416 1.0752 1.0679 1.2371 0.8960 0.9839 1.1809 1.4583 0.9478 1.2085 0.6845 1.1590 0.6334 1.2597 1.1495 1.2794 1.0443 1.2305 1.4454 1.8636 indolepropionate 1.0345 1.7418 0.9113 0.9424 1.0523 2.3358 0.4603 1.4500 0.5221 0.4218 1.3916 0.6363 0.6918 0.5112 0.8049 1.9879 0.5570 0.9158 1.8548 1.3263 3.0403 1.1407 2.3130 0.4605 0.8486 2.0291 0.2886 0.6323 0.3331 0.8548 0.3589 0.4784 0.2988 2.0108 0.7949 0.5235 2.3748 0.6879 1.0823 2.0166 0.6573 1.5686 1.2638 1.4457 0.8824 2.9870 0.6679 2.0174 0.8680 2.1088 0.7562 0.9314 0.3433 0.9945 0.2713 1.0590 0.5871 0.5377 0.6636 2.9020 0.7770 0.8996 1.4072 0.6683 0.5187 0.3031 0.1931 0.2684 0.3156 0.4646 0.7480 3.0648 0.7293 0.7236 1.9953 1.1710 1.4929 1.0087 1.4029 2.8914 1.6600 0.6693 1.4020 0.4068 0.7689 1.5851 1.3597 0.4837 0.9689 0.3788 1.2252 0.4950 3.8432 1.0340 2.4928 1.4728 2.0783 0.7880 0.9431 1.0055 0.5584 2.1966 0.7358 1.0000 3.1870 1.0710 0.9872 1.0138 1.4269 1.0141 2.7152 0.9877 1.9445 0.9078 0.7852 0.5947 0.3926 1.7505 0.4595 2.3318 3.4426 1.8522 1.3291 1.5547 0.7902 2.2560 1.6098 1.4502 2.3420 0.5694 1.4338 1.1041 0.4782 0.4831 0.8416 1.5559 0.5210 0.5611 0.5934 0.4700 0.4737 0.8623 2.2730 3.5816 1.1292 1.6249 1.1650 3.6597 0.8220 1.0734 1.3950 1.8350 4.0031 1.5900 1.9900 0.9266 1.8809 1.2726 1.4671 1.2055 0.9658 1.8100 1.1168 0.8548 1.3054 0.6996 0.6277 1.1902 1.5273 2.2170 0.6321 0.8450 1.9671 0.7681 1.4958 1.1194 0.4596 0.4580 0.5796 0.8747 0.9509 3.5225 0.4183 0.6224 0.7056 1.2116 1.3210 isobutyrylglycine (C4) 0.4142 0.4142 0.4142 0.4142 1.3072 0.5823 0.4142 0.8228 0.4142 0.9274 0.9422 0.8670 1.0593 1.0094 0.4142 0.7819 0.6370 1.1577 0.6209 0.7208 0.5861 0.9816 1.2449 0.9948 0.4142 0.9582 0.8653 0.6807 1.0474 0.4142 0.4142 0.4142 1.4101 0.8932 0.7430 0.4142 0.4142 0.4142 0.8227 1.3921 0.4142 0.4142 0.4142 1.4511 1.4494 0.8610 0.8622 1.2557 1.3723 1.0345 1.1406 1.3465 1.0000 1.0733 0.4142 0.4142 1.1952 0.4142 0.6650 1.0701 1.1920 1.2058 1.0516 1.1074 0.4142 0.4142 0.6024 0.8012 0.4142 0.4142 1.2059 0.5619 0.8713 0.6430 0.5116 0.4142 1.8172 0.6154 0.9332 1.6038 0.4142 0.4142 0.4142 0.7520 0.6039 0.4142 1.2607 1.2446 1.7027 1.0623 1.3776 0.4142 0.4142 0.9241 0.6979 0.8436 0.8198 0.6045 1.3877 0.9152 0.8404 0.8939 1.0176 0.4142 0.4142 0.4142 0.8105 0.4593 0.5857 1.7783 1.3054 1.9956 0.9742 1.8159 1.3604 0.9460 1.2869 0.4142 0.4142 1.4229 2.1754 1.6724 1.6675 1.0681 0.9549 0.4142 0.8478 0.5677 0.8621 1.1675 1.4712 0.7303 1.3881 0.9995 0.7832 0.4142 0.8709 0.9973 0.4142 1.0319 0.6827 0.8287 1.1245 1.3230 0.9196 1.3960 0.9005 0.9799 0.8172 0.4142 1.2399 0.7679 1.1594 1.2218 1.2923 0.9970 0.9736 0.8838 1.2975 0.7879 1.0000 0.9701 0.7559 1.0354 1.4125 0.8510 1.1157 1.2738 1.5871 1.4487 2.0094 1.6957 2.0361 1.6894 1.6413 1.9314 0.7732 1.4028 1.5644 1.1962 1.0488 0.9845 0.6654 1.0849 0.7605 1.0726 0.7815 isoursodeoxycholate 1.5712 1.9640 0.6486 0.3911 1.1077 0.7479 1.9251 2.4449 1.0579 1.8060 1.3272 4.4105 2.9002 3.0200 3.1624 3.8606 3.1901 0.2816 0.4418 0.3281 0.5540 0.4490 1.2171 5.9997 4.8709 9.1950 10.5408 7.4722 9.4302 13.0242 8.4982 10.2764 6.8286 8.5533 11.3216 1.6296 1.9952 1.4610 0.9757 1.2285 1.7482 0.7510 1.2783 0.9103 0.7204 1.0000 0.3844 0.3307 0.2527 0.6477 0.9733 0.3456 0.7509 1.3680 0.3577 0.4922 2.7514 1.1452 0.1818 1.1947 0.2579 0.7193 0.1928 0.5589 1.7742 1.3387 1.1820 1.1300 1.1244 0.2078 0.2544 0.6316 0.2565 0.3162 0.3900 1.3143 1.2274 1.1802 1.4317 0.9782 0.1619 0.2563 0.2939 0.3124 0.7738 0.5463 1.8024 1.8057 0.7701 0.5803 1.9381 1.0267 2.6255 2.5111 1.9233 2.9712 1.5299 2.9734 4.6853 3.7976 3.3558 4.6415 2.7063 4.2062 6.3125 5.6359 4.1210 2.8452 7.1664 0.2933 0.6205 0.1529 0.4196 0.2808 0.3678 0.8383 0.6011 0.4398 0.4731 0.2861 0.3219 0.5649 0.1344 0.1332 0.1368 0.6402 0.1822 0.3342 0.2399 0.4520 0.1918 0.2197 0.1011 0.2131 0.2859 0.3341 0.4010 0.4788 0.4375 0.4318 0.3470 0.9230 0.6552 1.1255 0.5604 1.0346 4.3712 2.9332 4.0708 3.1980 3.1398 4.0199 3.6863 1.5696 0.9925 2.0918 1.0075 0.6409 0.9616 0.9594 1.0742 0.5213 0.9175 2.0788 0.8707 0.3096 0.4137 0.6746 0.5432 0.3294 2.6545 3.0516 3.5138 2.8010 5.6226 3.5271 0.0659 0.0659 0.0659 0.0659 0.0659 0.5246 2.4293 1.4884 2.0690 1.1547 0.8421 isovalerate (C5) 1.0000 0.7311 0.7321 1.0357 1.0363 1.1640 1.4987 1.1819 0.8638 1.3673 1.5630 0.8381 0.8789 1.1590 0.8162 0.8185 0.9497 1.8284 1.3567 3.0850 1.7913 2.7923 2.1747 0.9461 1.2222 0.7205 0.9942 1.2457 0.5038 0.6760 0.9053 1.0872 2.0137 2.2763 0.8952 1.0737 0.8792 0.6037 0.9549 0.4946 1.2045 0.7572 0.8302 1.0778 0.9438 0.9981 1.4349 0.9392 0.2799 1.5503 1.1714 0.7402 0.8927 0.6836 0.6116 1.0256 1.4975 0.4012 0.6831 1.4719 0.9600 0.8360 1.2753 1.3780 0.3843 0.7858 0.4147 0.6793 0.8347 0.5328 1.9004 2.2817 0.8492 2.0482 0.8407 1.1460 1.1726 1.9776 0.9812 0.7304 1.1668 0.7029 1.1776 1.0563 0.9725 0.8132 0.7940 1.0173 0.9294 1.3999 1.2708 1.3425 1.0036 0.8242 1.5457 1.0011 1.3472 1.5834 0.5983 0.9068 0.8327 0.9354 0.7830 1.4527 1.4463 1.3676 0.9048 0.8440 1.3715 0.6466 0.7881 0.9052 1.2850 1.3717 1.2709 0.6763 0.9114 0.7294 0.8977 0.6024 1.0071 0.6273 0.6245 0.6344 1.6600 0.9279 1.0933 0.9989 1.2430 1.3720 1.1423 1.4294 1.4069 0.9148 1.5246 1.2297 0.6923 1.1350 1.2175 0.9339 1.1007 0.9581 1.7847 1.6254 0.6200 1.7802 1.6243 1.1528 1.1479 0.6535 0.8485 0.9353 0.7885 1.0473 0.9938 1.4412 0.8956 1.0288 1.1755 0.6964 0.7182 0.5344 0.8343 0.5983 0.6461 1.0248 1.2748 0.9594 1.0675 1.1115 1.0183 0.6266 1.8828 1.7258 1.3524 1.2469 1.7514 0.7076 2.0883 1.7344 4.0535 0.6866 1.2302 0.8062 0.8894 1.1245 0.8803 isovalerylglycine 0.3076 0.5808 0.3076 1.0659 1.1109 1.1172 1.0000 0.6869 0.6099 0.7192 1.0074 1.0037 1.3853 2.1132 1.4260 1.7589 1.1302 0.3076 1.9286 1.0913 1.5636 1.7315 0.3076 0.9175 0.9528 1.1769 0.3076 0.7410 0.3076 0.6955 0.3076 0.6399 0.8731 0.7449 0.3076 0.3076 0.8184 0.9472 0.3076 0.8636 0.3076 1.1199 1.1179 1.1290 0.7513 1.5051 0.6155 1.2941 1.2937 0.8176 1.1457 1.3443 1.3837 0.3076 0.3076 0.3076 0.3076 0.3076 0.3076 0.3076 1.1956 1.2503 1.4960 1.6027 0.3076 0.3076 0.3076 0.3076 0.3076 0.3076 0.8079 0.5755 0.3076 0.8857 0.3076 1.3026 1.8289 0.8744 1.7468 1.6790 0.3076 0.3076 0.3076 0.9711 0.3076 0.3076 0.3076 1.0867 1.0000 1.0780 0.6268 0.3076 0.4916 0.3076 1.0242 0.7322 0.6226 1.2870 0.3076 0.3076 0.3076 0.3076 0.3076 0.3076 1.0426 1.1959 0.6136 1.8194 1.5377 1.4745 1.3146 1.1153 0.5849 0.6089 1.2898 0.6129 0.3076 0.7647 0.3076 0.8377 1.4813 2.3560 1.1719 1.0034 0.7898 0.3076 0.3076 0.3076 0.3076 0.3076 0.3076 0.3076 1.7581 0.3076 1.0247 0.3076 0.7480 0.4036 0.3076 0.7557 0.4681 0.7127 0.3076 0.5157 0.3949 0.7528 0.6778 0.3076 0.6282 0.3076 0.4636 0.3076 0.5260 0.3076 0.3076 0.3076 0.3076 0.3076 1.1109 0.3076 0.3076 0.4683 0.3076 0.8986 0.3076 0.7044 0.5538 0.7453 0.7773 0.9132 1.7602 1.3998 2.0731 1.6873 0.8265 1.6211 0.5048 1.4387 1.3131 0.3076 0.9140 0.8909 0.6199 0.3076 0.3076 0.3076 0.3076 kynurenate 0.9639 0.6682 0.4406 1.1294 1.2273 0.9971 0.6408 0.5463 0.3056 0.7444 0.8590 1.0751 1.3810 1.5854 1.2882 1.2202 1.4807 1.1572 0.3022 1.4293 0.7417 1.1382 0.6738 0.5793 0.3585 0.6350 0.2389 0.8301 0.6156 1.2418 0.5867 1.3496 1.2661 1.2332 1.4665 0.8423 1.1161 1.0144 1.0499 1.1560 0.8739 0.7703 0.5965 0.7432 0.7216 0.6786 0.5707 0.4158 0.2777 0.9284 0.8055 0.5838 0.6624 1.0403 1.2479 1.5522 1.0001 0.4214 0.4677 1.0657 0.8833 1.0704 0.7260 1.1081 0.6946 0.7829 1.0169 0.5808 0.7272 0.5052 0.9593 0.6676 0.7838 1.4399 0.5930 1.2812 1.6493 1.1423 1.4494 1.2700 1.7217 0.4898 1.3501 1.3513 1.0302 1.0000 1.2302 1.1743 1.1854 1.0545 1.2651 1.4119 0.7670 1.3035 1.1039 1.0136 0.5425 0.7130 0.6961 0.7332 0.6356 0.7836 0.7467 1.2134 1.0008 0.8376 1.3708 0.4250 0.7483 0.7611 1.0027 0.4420 0.8940 1.1033 1.3956 0.5510 1.1808 1.0639 1.2832 0.4998 0.5451 0.5694 0.4728 0.5774 0.9641 0.9189 0.4385 0.9458 0.9842 1.3607 0.9807 1.2523 0.6196 1.0512 1.3860 0.8169 0.4475 0.6848 1.2540 1.0012 0.9305 0.9951 1.1443 0.6994 0.3714 0.7804 1.2354 1.3698 1.4865 0.6532 1.5286 1.7715 1.3895 1.1338 1.2838 1.1409 1.0265 0.8941 1.3048 1.1928 0.7288 1.0768 1.1803 1.0623 1.2786 1.2778 0.9999 0.4793 1.2071 1.0272 1.2766 0.4825 1.0374 1.5862 1.0350 1.0662 1.4110 0.4506 1.1864 0.7542 1.5545 0.8120 1.5593 0.4806 0.9593 1.2087 1.1110 laurate (12:0) 1.6288 1.2696 0.2596 1.0375 1.2567 0.6005 1.2570 1.3273 0.3362 0.8869 0.6630 1.3281 0.8562 1.1062 0.7903 0.4898 1.3714 1.8037 0.4216 2.1204 0.8698 2.3165 2.0204 1.1937 0.8230 0.7675 0.4947 1.1169 1.5436 0.8409 0.5691 0.9924 0.8795 0.7682 0.7761 1.6869 1.1990 1.4358 1.0590 1.2209 1.0143 0.4898 0.5242 0.5009 0.5843 0.5745 0.9770 1.0165 0.4173 1.0000 1.2540 1.3493 1.3337 0.8742 0.8722 1.0858 1.3517 0.3590 0.3740 0.5742 0.7835 0.8910 0.7802 0.6647 0.7097 0.7884 0.8629 1.2929 0.9012 0.7829 1.2391 0.6833 1.4859 1.0281 0.9002 0.6949 0.7338 1.3478 1.5176 0.7442 0.9319 0.2710 0.4630 0.8229 1.0929 0.6401 0.4840 0.6208 0.5691 0.9126 0.7711 0.9517 1.3779 1.5573 1.4526 1.7973 1.4388 2.1279 1.1997 1.0076 1.5714 0.8645 1.8300 1.3202 0.7195 1.0113 1.1480 0.3952 0.7262 1.1189 0.7378 0.3963 0.7707 0.6533 1.0016 2.2439 1.5900 1.4334 1.3014 1.2048 0.7620 1.3774 1.2010 1.4856 0.9665 1.1434 0.4158 1.1068 0.8681 1.1855 1.4706 1.0919 0.7916 1.0407 1.2684 0.9001 0.4682 1.0113 0.9522 1.3090 1.2122 0.8917 1.7313 1.2061 0.5259 2.0341 1.4764 0.5706 0.8231 0.4841 1.8670 0.6285 0.7725 0.9350 1.1648 1.1431 0.7740 1.4560 1.5965 0.8489 1.8342 0.6491 1.6140 0.6902 1.0523 1.7791 1.6826 0.4881 1.7226 1.1233 1.2205 0.4222 1.5822 2.0740 1.3009 3.8398 0.8279 0.3381 0.6092 0.7351 0.8872 1.1451 1.4471 0.7077 1.2940 1.1765 0.7356 linoleate (18:2n6) 1.6989 1.2854 0.0968 1.0872 1.1951 0.3906 1.1234 1.1111 0.1305 0.7405 0.5192 1.5227 1.2639 0.7083 0.7382 1.0264 0.9660 0.9554 0.1675 2.0583 0.3583 2.2392 1.0801 1.0404 0.7440 0.8590 0.4673 2.3184 1.6199 0.5689 0.4550 0.6791 1.0899 1.5992 0.4906 2.8586 1.9315 1.5320 1.3301 1.6259 1.0731 0.6137 0.5073 0.3285 0.5097 0.6475 1.0093 0.6543 0.2545 1.5438 2.0385 2.0729 1.5468 0.8852 1.1867 1.4017 1.2070 0.1974 0.1592 0.5903 0.8753 1.1344 0.6124 0.8145 0.7204 0.6807 1.0990 2.0315 1.0217 1.0158 1.5906 0.5809 2.6938 1.5161 1.2366 0.5632 0.4978 1.2732 1.0113 0.6048 0.8319 0.0934 0.5756 1.1018 1.4682 0.6177 0.5983 0.6968 0.7382 1.3904 0.7756 1.1543 0.8277 0.8505 0.8616 0.9715 0.6604 2.6385 1.1841 0.8235 1.5295 0.9147 2.1063 0.7405 0.5321 0.5344 1.3430 0.1298 0.5133 1.2460 0.3959 0.2528 1.4460 0.6026 1.3686 2.3210 1.6019 1.0065 1.0224 1.2170 0.9294 1.5467 1.9622 1.2873 1.1061 1.0154 0.3089 1.2234 1.4278 1.1555 1.5619 1.5940 0.6715 1.2580 1.5284 0.9492 0.2238 0.7912 1.5960 1.3446 1.0909 1.1007 2.1550 0.5701 0.2092 0.9720 0.6838 0.6333 0.9619 0.5159 3.0098 0.8245 0.8615 1.0743 0.9846 1.0746 0.9337 1.6295 2.2603 0.9339 1.7260 0.6231 1.7242 0.7949 1.8432 0.8804 0.7880 0.5978 1.5748 0.4405 0.4096 0.1098 0.3897 1.0405 0.7566 1.7201 1.0996 0.2001 1.2537 1.1953 1.2234 0.5226 1.1036 0.5091 1.0020 1.0000 0.3849 linolenate (18:3n3 or 3n6) 1.9697 1.2394 0.0810 1.0126 1.1979 0.5000 1.1615 1.1526 0.1187 0.6578 0.5158 1.6326 1.3239 0.7806 0.7918 1.0923 1.2486 1.0717 0.1207 2.6223 0.3596 2.5466 1.2234 0.9899 0.6940 0.7798 0.3018 2.1318 1.6692 0.5677 0.4087 0.6820 0.9751 1.6401 0.4971 4.4719 2.2283 1.8689 1.4927 1.9784 1.2125 0.4625 0.3963 0.3056 0.4269 0.7101 0.8725 0.7240 0.2299 1.6028 2.3438 2.5814 1.7591 0.7602 0.8762 1.2313 1.1444 0.1171 0.1289 0.6666 0.8260 1.1060 0.5875 0.7506 0.5731 0.5780 0.8657 1.5928 0.7487 0.8728 1.6046 0.5655 3.0329 1.2925 1.0797 0.5555 0.5357 1.3690 1.3006 0.5753 0.8279 0.0616 0.5714 1.0018 1.5280 0.5362 0.5335 0.6682 0.8590 1.3102 0.7514 1.1414 0.8455 0.9395 1.1164 1.0747 0.6411 3.4588 1.1436 0.7930 1.5921 0.9930 2.4134 0.8285 0.5907 0.5818 1.3444 0.1069 0.4983 1.3708 0.4344 0.2247 1.7776 0.5898 1.4444 3.4626 1.8227 1.1753 1.0859 1.1932 0.8185 1.6406 1.8329 1.3794 1.1154 1.2199 0.2394 1.4090 1.5179 1.3409 1.7808 1.8958 0.5980 1.3443 1.8216 1.1150 0.2424 0.9259 1.7078 1.6927 1.1928 0.8012 2.7708 0.5498 0.1729 1.0456 0.6815 0.6540 0.8918 0.4580 5.0561 0.7383 0.8497 1.0070 1.0677 1.2226 1.0485 1.7715 2.7941 0.8083 1.7193 0.7005 1.5940 0.6216 1.7669 0.9370 0.8332 0.4156 1.7128 0.4770 0.4732 0.1056 0.5084 1.1620 0.8681 2.6984 1.0112 0.1687 1.0110 1.0303 1.2197 0.5843 1.1986 0.4350 1.0606 1.0000 0.4370 linoleoyl ethanolamide 1.7494 1.3757 0.3606 1.4869 1.2431 0.3606 0.8745 1.2917 0.3606 0.5477 0.3606 1.0208 0.8913 0.6551 0.6147 0.8177 0.5820 0.9029 0.5220 2.8206 0.9726 3.3541 1.0943 1.3213 0.7691 1.4194 1.2133 3.3459 1.2342 0.8310 1.2137 0.6379 0.9979 2.2087 0.6853 3.4632 2.4024 1.1593 0.8432 1.2528 1.1502 0.4979 0.3606 0.3606 0.3606 0.3606 0.3606 0.4891 0.5809 1.0397 2.0067 2.0808 0.8790 1.0331 1.0084 1.1533 1.0069 0.5081 0.6020 1.0115 0.9738 1.8665 0.9911 1.6451 0.7924 0.6970 1.0625 1.6488 1.0134 1.1489 0.3606 0.3606 2.0679 1.0580 0.3606 0.6695 0.3606 0.9840 0.3606 0.3606 0.8305 0.3606 0.9986 0.8058 2.0558 1.0014 0.7909 0.8858 1.7366 1.9116 1.0214 1.3171 1.1646 0.6753 0.8958 0.8527 0.6206 3.0335 0.7184 0.6220 0.9988 0.8915 1.6744 0.3606 0.7525 0.3606 0.9713 0.3606 0.3606 1.4396 0.3606 0.9030 2.0717 0.6736 1.1200 3.4961 1.5390 0.8517 1.0752 0.8264 0.9430 1.6811 1.7747 1.0155 0.7909 0.8812 0.6106 1.2238 1.4844 1.0517 1.4967 1.1592 0.6192 1.1232 1.2516 0.5308 0.3606 0.3606 1.3626 0.9609 0.3606 1.6982 2.5462 0.3606 0.3606 0.6839 0.3606 0.7234 0.8026 0.7984 3.8530 0.7996 1.2557 0.7908 0.6674 0.5450 1.0012 0.8921 1.9772 0.8384 0.6524 0.4866 0.9941 0.5487 1.7099 0.6213 0.5359 1.1319 2.0530 0.4218 0.6069 0.3606 0.3606 1.4642 1.8687 2.8811 0.8670 0.4135 1.4039 1.4331 1.2858 0.4863 0.9429 0.5469 0.8914 1.0738 0.3606 lithocholate sulfate (1) 0.9177 0.9217 0.8150 0.2264 0.5721 0.2264 1.0590 0.5898 1.4516 0.6931 0.3419 0.5604 0.3720 0.2264 1.0204 0.5410 0.2264 0.2264 0.2264 0.2264 0.2264 0.2264 0.2264 0.7972 0.7375 0.2264 0.4154 0.8072 0.2264 0.8435 1.6527 0.7831 0.5752 0.2264 1.2149 1.6637 1.6972 0.9007 0.5140 0.6537 0.5514 2.3870 0.7035 1.4342 1.7965 2.0768 1.4559 2.4187 2.8731 1.7774 1.0557 2.3265 0.2264 0.2697 0.2264 0.2723 0.8249 0.8342 5.3997 4.7241 3.8259 2.6628 4.5251 2.8690 0.4490 0.3332 0.3381 0.5860 0.5345 0.2264 0.2264 0.6344 0.2264 0.2264 0.2264 0.6296 1.9312 0.9796 0.7587 0.7265 0.4471 5.2494 1.1418 0.2264 5.1546 2.7756 0.4175 0.2264 0.4869 2.2165 1.6828 2.6665 0.4948 1.1885 1.3011 1.4073 1.4341 0.2264 0.2851 0.2264 0.2264 0.2264 0.2264 0.2264 0.2264 0.2264 0.2264 0.2264 0.2264 1.0350 0.8468 1.6582 1.3667 0.5880 0.8590 0.2264 0.2264 0.2264 0.2264 1.4318 1.4390 1.8630 1.2718 1.5627 0.8889 1.3145 1.9345 0.8403 1.1607 0.7316 1.5361 1.0104 1.7819 1.6147 0.9896 0.4611 1.0452 0.4051 0.8025 1.0229 0.5698 1.2937 1.1819 0.7672 1.4260 1.9213 4.2276 0.5548 0.5542 0.4389 0.2264 0.7256 0.4931 0.2264 0.4836 1.3993 0.9502 1.1086 1.1375 0.2264 0.5846 0.2756 0.3430 0.6943 0.3496 0.2725 0.2264 5.5437 2.9309 2.7018 0.2264 0.2264 0.2264 0.6531 0.2264 0.2264 0.4399 2.2400 0.6531 1.1530 1.7426 1.3097 0.6652 1.8637 1.4161 1.6393 2.2526 malate 1.2068 1.1448 0.8885 1.3107 0.8584 0.8609 1.1101 1.0727 1.2402 0.8609 0.8953 1.6711 1.3351 1.3384 1.4492 1.2701 1.6754 0.9412 0.7151 1.0419 0.6350 1.0079 0.9890 0.6101 0.7113 0.6852 0.6703 0.9033 0.8079 1.1330 1.3254 1.1799 0.8017 0.8676 0.9386 0.9428 0.8988 1.0593 0.7199 0.4538 0.9645 1.0220 0.8899 0.9891 1.0937 1.0242 0.8520 0.7154 1.0882 0.6488 0.8612 1.0378 0.7714 0.8347 0.9091 0.8731 1.0837 0.9154 0.7545 0.8684 1.0287 0.9630 0.9631 0.9133 1.2384 1.5227 1.4963 1.3177 1.4612 0.8883 1.0942 0.8003 1.0635 1.1770 1.1685 1.0742 0.9325 0.6842 0.8196 0.9058 1.2249 1.1276 1.0477 1.1101 1.2128 1.2796 1.3334 1.1681 1.1475 1.5672 1.2396 1.3249 1.1858 1.0823 1.1386 1.2466 1.2473 1.0317 0.9636 1.0599 1.1753 1.1851 1.1546 1.5830 1.3587 1.2720 1.7864 1.0586 1.3412 0.9325 0.9341 0.8227 0.7908 0.5978 0.9563 1.2089 0.9752 0.8005 0.9913 1.2843 1.3915 1.3084 1.1611 1.4411 0.6598 0.6597 0.6282 0.6908 0.6335 1.0356 1.1987 0.8506 0.7719 0.9420 1.2529 0.7958 1.0107 1.0000 1.0156 0.9260 1.0350 0.9698 0.9624 0.9444 0.7754 1.1751 1.0190 0.8196 0.8318 0.8333 1.3247 0.9010 1.0506 0.7645 0.7276 0.7381 0.7142 0.7373 0.7773 1.0794 1.1973 1.0942 1.0648 1.0626 1.0996 0.9921 0.9643 0.8829 0.9153 0.9913 0.8313 1.0080 1.0561 1.0248 0.7658 1.2439 0.9960 1.1347 0.9300 1.1558 1.1716 0.8377 1.1487 0.9714 0.9712 0.9385 0.8386 margarate (17:0) 1.6034 0.9975 0.2260 0.9452 1.0880 0.4362 1.2997 1.0770 0.3735 0.8096 0.6762 1.7816 1.8888 0.9393 0.9786 0.9769 1.2895 1.1790 0.4035 3.1200 0.6694 3.5670 1.2662 1.0039 0.6649 0.8587 0.6708 2.8530 1.2219 0.6056 0.6637 0.8315 1.4148 1.5902 0.7306 4.3804 2.5747 1.6743 1.2935 1.7006 1.1256 1.0223 0.8181 0.6659 0.7755 0.7378 1.0551 0.7276 0.4979 2.4809 3.3256 3.0319 1.9289 0.7634 1.0458 1.1206 0.9961 0.3780 0.3024 0.5729 0.9332 1.3670 0.6947 0.9461 0.9632 0.8070 1.2694 2.3696 1.1670 0.7548 1.3979 0.5481 2.5940 1.1522 0.9354 0.5778 0.5610 1.2884 0.7352 0.7182 0.7759 0.2676 0.6041 1.1253 1.4167 0.7047 0.7293 0.8449 0.9408 1.4464 0.8753 1.3137 0.6847 0.7604 0.6803 0.6980 0.5974 3.0012 1.1805 0.8652 1.4631 0.8818 2.5403 0.8354 0.6349 0.7374 2.1287 0.2969 0.6885 2.0889 0.6526 0.5856 2.3282 1.1334 1.9888 2.8652 1.8490 1.0591 1.0060 1.0563 0.8875 1.4482 1.9450 1.0319 0.9846 0.9066 0.4474 1.1471 1.2741 1.2387 1.7753 1.8016 0.8426 1.6167 1.7870 0.8765 0.3619 0.9282 1.7190 1.2457 1.0565 1.9303 3.0295 1.0000 0.4614 1.4075 0.9670 0.6046 0.9632 0.6421 3.5978 0.9270 0.9333 1.2781 1.1717 1.2203 0.8922 1.5842 2.7371 0.9151 1.5595 0.5973 1.5076 0.8537 2.1143 0.9794 0.9456 1.0982 2.2108 0.6674 0.7223 0.4141 0.6907 1.6987 1.3378 2.7887 1.2331 0.3834 1.6875 1.6405 1.5173 0.6205 1.3496 0.7083 1.2040 1.2973 0.4792 metabolonic lactone sulfate 1.2440 1.0080 0.9679 0.7947 0.8972 0.9544 0.8947 0.8714 0.9810 0.7088 0.9021 0.7398 0.7259 0.6350 0.7281 0.6880 0.7418 0.1145 0.1703 0.1566 0.1785 0.1611 0.1955 0.5997 0.5280 0.6777 0.7012 0.6692 0.6234 2.3254 2.3386 2.5036 1.6173 2.2011 1.8525 2.7555 2.7125 2.6307 2.3304 2.4068 2.0882 1.2333 1.2863 1.2814 1.2527 1.3247 1.2340 0.3416 0.3537 0.4064 0.3562 0.3666 0.2971 1.6072 1.1534 1.4482 1.7431 1.5620 1.8439 1.7087 1.7614 1.6116 1.7122 1.5367 1.1475 1.0854 0.9223 1.0189 0.7765 1.1120 0.8205 0.8755 1.1933 0.8757 1.0906 0.2127 0.2476 0.2295 0.2459 0.2381 1.4839 1.8005 1.6759 1.3054 2.0613 1.7490 0.4843 0.4681 0.5135 0.6118 0.5250 0.5610 0.9337 0.6076 0.8327 0.8458 0.9362 1.1167 0.9129 0.9899 1.0101 1.0801 1.1415 0.1145 0.1145 0.1145 0.1145 0.1145 0.1145 1.2815 1.3317 1.6801 1.1828 1.0095 1.1554 0.4574 0.3913 0.3922 0.2594 0.1145 0.1703 0.1500 0.1259 0.1145 0.3376 0.5454 0.5800 0.6107 0.4805 0.2866 0.3612 0.3219 0.3799 0.3332 0.2406 0.3730 0.4936 0.5187 0.4187 0.3376 0.4811 0.7432 1.0000 1.1056 0.9639 1.2266 0.7933 4.4170 3.9992 5.0770 5.2711 4.1588 4.6247 1.6345 1.6819 1.5821 1.5631 1.6501 1.8941 1.8552 1.8496 1.7375 1.8152 1.5813 2.1049 1.3571 1.2482 2.0863 2.0938 1.7378 0.9987 1.2914 1.2198 1.1870 1.2787 1.4309 0.8496 0.9599 0.8412 0.9762 0.8789 2.0106 1.5846 2.0168 2.2880 1.5079 1.5602 methyl glucopyranoside (alpha + beta) 0.4129 0.6499 0.4132 0.1957 0.1957 0.4436 0.9049 1.3939 0.5192 0.1957 0.4004 0.5386 0.8401 0.7763 0.8773 0.7912 0.8670 0.1957 0.4795 0.1957 1.1226 0.1957 1.0000 0.9849 0.5016 0.1957 0.5243 0.1957 0.5986 0.9572 0.4586 0.6332 0.1957 0.3757 0.2558 1.3215 1.7200 1.0687 1.2385 0.5943 1.0112 1.1400 0.9996 0.7335 1.0004 0.9470 0.7868 1.6191 1.0274 0.1957 0.1957 1.1938 0.1957 2.0647 0.1957 0.1957 1.3278 0.8592 0.2459 0.1957 0.8024 0.1957 0.4224 0.1957 0.9069 1.1136 1.0400 1.1614 1.0177 0.6122 0.6144 0.7476 1.1539 0.3798 1.2285 1.1568 1.4425 1.4425 1.5258 1.4627 0.1957 0.8300 0.5561 0.1957 1.4987 1.2919 0.7047 1.2403 1.2830 1.4345 1.7084 1.9918 2.3562 0.4085 1.0621 2.3085 1.5833 1.1053 1.7171 0.9383 0.4830 0.7257 1.2213 0.9537 1.5001 2.6554 1.2740 2.5336 3.4794 2.4426 3.0245 2.0383 0.8529 0.8955 0.9359 1.7151 1.2374 0.6011 0.7483 1.6985 1.4368 1.9974 1.3815 1.8992 0.3089 0.7548 0.6241 0.7189 0.2645 0.7261 2.9186 0.9790 1.8235 1.7860 1.2245 1.1330 1.4491 3.6453 0.6744 0.6058 3.2543 0.5793 0.3793 1.4800 0.5865 1.0942 0.1957 0.6642 0.4360 0.9945 1.2368 0.7633 1.7193 1.1834 0.9639 0.6934 0.5221 0.7589 0.7730 3.1135 3.3277 2.4420 3.6749 2.2735 4.0619 0.1957 0.2748 0.6923 0.8981 1.1497 0.8873 2.0819 3.2971 0.9774 0.8554 2.8190 0.1957 0.7193 0.1957 1.1094 0.1957 1.7577 0.1957 1.1206 1.1050 0.3835 0.6331 methyl-4-hydroxybenzoate sulfate 10.9002 4.9961 7.4331 10.9603 10.7017 16.1903 0.0971 0.0971 0.0971 0.4579 1.5360 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.3248 0.2288 0.0971 0.2679 2.0923 0.7314 0.2435 0.2978 0.4951 0.4449 0.7687 0.0971 0.0971 0.3013 4.9613 1.0000 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.0984 0.6443 0.1236 0.2065 0.1937 0.1722 13.3330 6.9496 8.7413 11.8671 4.0429 2.5789 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.3478 0.2373 1.3453 0.2816 0.0971 0.2016 0.4151 0.7212 0.9264 4.2062 0.3772 0.4778 0.7844 2.0008 0.0971 0.0971 0.0971 0.0971 0.0971 0.0971 0.3519 0.4959 0.7055 0.3839 0.6892 0.4737 1.7091 10.4560 3.2371 9.7636 8.5367 0.7733 0.2068 0.3683 1.2273 1.2662 1.7563 6.3625 9.3816 6.3382 3.0756 4.5077 7.3814 0.1186 0.1538 0.1362 0.4779 0.0971 0.2115 20.1501 7.8641 16.4304 10.1266 2.4361 1.4294 2.1453 0.6751 0.9531 0.0971 0.0971 0.0971 0.0971 0.0971 0.1845 0.2796 0.4093 0.0971 0.0971 0.0971 0.2037 0.1298 0.4165 0.1024 0.0971 0.1924 1.0736 0.1178 0.0971 0.0971 0.0971 0.0971 0.1616 0.0971 0.0971 0.0971 0.0971 0.1416 0.7362 0.0971 2.5134 1.1293 0.0971 0.0971 4.2883 5.8416 6.0706 8.5747 8.0275 17.8820 11.3738 2.3929 4.1375 5.9728 21.7935 0.0971 0.0971 0.0971 0.0971 0.1271 0.0971 10.9128 21.3462 27.6457 38.4578 21.5560 0.2468 0.0971 0.0971 0.0971 0.0971 0.0971 myristate (14:0) 1.5449 1.1656 0.1693 0.7218 1.0307 0.3844 1.3506 1.3993 0.2738 0.8683 0.5740 1.7132 1.5720 1.0864 0.7604 0.7821 1.3833 1.1372 0.2457 2.1155 0.5796 2.6306 1.4387 1.2195 0.7868 0.8297 0.4949 2.3090 1.9645 0.7639 0.6116 0.8271 1.0657 1.0504 0.6185 4.2515 2.4978 1.9083 1.3835 1.8432 1.2086 0.5283 0.5337 0.3976 0.4870 0.4402 0.8310 0.8029 0.3108 1.2155 1.9137 2.4020 1.3975 0.7486 0.7220 0.9952 1.0086 0.2500 0.2225 0.4318 0.7245 0.8269 0.6363 0.5418 0.7541 0.7656 1.1863 2.1044 1.1340 0.7904 1.3235 0.4705 2.6542 1.1151 1.0105 0.5078 0.5074 1.2234 1.0435 0.6542 0.9010 0.1857 0.5701 1.1182 1.6140 0.6614 0.4798 0.6129 0.5770 1.1476 0.7903 0.9921 0.9440 0.9095 0.9018 1.2138 0.6812 3.1593 1.1001 0.7787 1.4575 0.7049 2.2729 0.7128 0.4727 0.5803 1.1156 0.2254 0.5624 1.7591 0.6468 0.3836 1.4051 0.6933 1.6784 4.1208 1.9559 1.0931 1.1899 1.1157 0.7040 1.5092 1.8717 1.3331 1.0111 1.1900 0.3780 1.2852 1.0690 0.9622 1.3348 1.0772 0.6331 1.0048 1.2502 0.9185 0.3279 0.9386 1.5922 1.4019 1.2497 1.0806 2.4808 0.9434 0.3467 1.4469 0.9982 0.4772 0.8703 0.4405 3.4230 0.6241 0.7926 1.0145 1.2348 1.2763 0.8287 1.7125 2.8364 0.6474 1.4410 0.4623 1.5774 0.6375 1.7058 1.3772 1.2402 0.7639 2.6888 0.8996 0.7849 0.3040 0.9908 2.1096 1.3656 5.0967 1.0000 0.2948 1.1247 1.2304 1.1111 0.8010 1.3117 0.6480 1.2868 1.1761 0.4730 myristoleate (14:1n5) 1.4401 0.9042 0.1136 0.8011 0.9431 0.3099 1.6949 2.0051 0.1749 1.0299 0.6848 1.6793 0.9834 1.1251 1.0000 0.5401 1.7063 1.0096 0.1441 1.2668 0.4729 1.4152 1.1332 1.6991 1.3599 0.7889 0.2985 1.8264 2.9684 0.7260 0.3508 0.9169 0.8838 0.4749 0.6342 3.2097 1.6953 2.4540 1.7933 1.8875 1.8075 0.2878 0.3012 0.2649 0.3551 0.2609 0.8110 0.9135 0.1686 0.8242 1.2547 1.4847 1.1847 1.0474 1.0528 1.3234 1.4490 0.1595 0.1561 0.3221 0.7194 0.8675 0.5561 0.6063 0.5290 0.6540 0.8059 1.4899 0.9421 1.4486 1.9796 0.7138 2.9442 1.7817 1.6622 0.7605 0.7208 1.7011 2.0467 0.6491 1.5289 0.1016 0.4892 1.4317 2.0147 1.1167 0.4498 0.5537 0.2783 1.1733 0.6950 1.0369 1.2164 1.1740 1.0101 1.7834 0.9904 2.3658 1.0504 0.7698 1.6465 0.5864 1.8915 0.6980 0.4786 0.6525 0.9388 0.1334 0.4340 1.6933 0.8494 0.2809 0.7619 0.8219 1.4956 2.5766 1.6715 0.9116 1.5272 1.5342 0.8141 1.8671 1.5808 1.9601 1.3164 1.6200 0.2187 1.5117 1.1451 0.6727 0.8636 0.5258 0.3826 0.6275 0.9150 0.9647 0.4033 1.1372 1.5943 2.0553 1.6356 0.6550 1.2953 0.9750 0.3258 1.9379 1.1291 0.4599 1.0702 0.5024 2.9297 0.7922 1.0063 1.3122 1.5051 1.5600 0.9512 2.4380 2.3672 0.6433 1.7353 0.3586 1.4435 0.5777 0.8218 1.7952 1.6962 0.3101 2.1541 1.2176 1.8807 0.2633 2.5041 3.5739 1.8816 6.0589 0.6041 0.1646 0.5270 0.5195 0.6038 1.4141 1.7913 0.7162 1.6680 1.2245 0.6456 N1-Methyl-2-pyridone-5-carboxamide 1.2627 0.9595 1.1459 0.5863 0.8797 1.5121 1.0658 0.9613 0.9291 0.5645 1.3442 0.8953 0.7832 0.6019 0.9023 0.9092 0.7961 0.5783 0.6789 0.9192 0.7892 0.5010 0.8952 0.8345 0.3975 1.1723 0.7209 0.6721 0.9780 1.0349 1.3742 1.4705 0.9155 1.4741 0.8248 0.9985 1.2133 1.0583 1.1188 1.5232 1.2384 1.6318 1.2411 1.6375 1.3662 1.3798 1.3993 0.8126 0.7097 1.0993 0.4958 0.7936 0.3117 1.7249 0.7702 1.8430 1.6446 1.5277 0.7186 1.0298 0.9184 0.5152 0.8329 0.7703 0.7556 0.6164 0.5972 0.5975 0.7054 0.6936 0.5213 1.3127 0.7810 0.5839 0.9410 1.2465 1.0094 0.9672 0.9978 1.1051 0.6433 1.0000 1.5126 0.7358 1.3892 1.0367 1.3510 1.4751 1.8587 1.5334 1.5272 1.6445 1.3091 0.8348 1.2301 1.1194 0.9289 0.9488 0.9889 1.0111 1.0570 1.0520 1.1198 0.5931 0.9268 1.0640 0.6375 1.0315 1.0779 1.2421 1.4310 1.1318 1.1074 0.3516 0.6949 0.8520 0.6019 1.0020 0.6062 0.4312 0.6123 0.6250 0.5243 0.4488 0.6014 1.0444 1.1179 1.2868 1.0829 0.8065 0.8573 1.0832 0.7696 0.9046 0.7978 0.6435 0.7259 0.7518 0.6786 0.5147 0.7723 0.6159 1.1182 1.0203 0.7677 1.0297 0.8143 1.2793 0.9919 1.2942 1.4712 1.1003 1.3221 1.1698 1.0620 1.2412 1.2436 1.2119 1.2051 1.4777 1.3747 1.4537 1.4218 1.2819 1.4665 0.5285 0.3788 1.0583 1.1015 0.9035 0.7769 1.4429 1.8676 0.8677 1.3413 1.7732 0.5494 0.9986 0.5053 1.1099 1.2444 1.0533 1.0440 1.0776 1.2960 0.7137 1.0803 N6-carbamoylthreonyladenosine 1.0534 0.7407 0.7407 0.8843 0.8397 0.7407 0.8657 0.8705 0.8728 0.9287 0.9874 0.9188 0.8786 0.7407 0.9409 1.0298 1.1611 0.8430 0.7407 0.8848 0.7407 0.9703 0.7407 0.9784 0.7407 0.7407 0.7407 0.9959 0.7407 1.1027 1.1413 1.2289 1.0503 0.7407 0.7407 0.7407 0.7407 1.2387 1.1883 0.7407 0.7407 1.3180 1.0408 0.7407 0.7407 0.7407 0.7407 0.8793 0.9321 0.7407 0.9458 0.7407 0.7407 0.7407 0.7739 0.7407 0.7407 1.0340 1.1931 0.7407 1.1956 0.7407 0.9631 0.9093 0.9595 0.9975 0.7407 0.8758 0.8192 0.9974 0.7407 1.0363 0.9027 0.7407 1.2465 0.8166 1.0171 0.7407 0.7942 0.7492 1.0168 1.3093 0.9727 0.9779 1.1462 0.9333 0.7407 0.7407 0.7407 0.7407 1.3326 1.2218 1.0335 0.7407 0.7407 0.7407 0.9987 0.7407 0.7407 0.7407 0.7407 0.7407 0.7407 0.7407 0.7407 0.8911 1.0209 0.9919 0.8615 0.9758 1.0281 1.3616 1.0026 0.9433 1.0354 0.7692 0.7407 0.7407 0.7407 1.3135 1.4426 1.2441 1.0013 0.7407 0.8804 0.9211 1.0699 0.7792 0.7407 0.7407 0.7407 0.8597 0.7407 0.7407 0.9929 0.7407 0.8305 1.0718 1.2066 0.7407 0.8330 0.9344 0.7948 0.7407 0.9894 0.7407 0.7407 1.1376 0.8915 1.2023 1.1694 1.0372 1.3427 0.7407 0.7407 1.1170 0.7407 1.3368 1.2837 0.7407 0.7407 0.7407 0.7407 0.7407 0.7407 1.0821 0.9729 0.7407 0.7407 0.7407 0.9635 1.1338 1.1843 1.0082 0.7407 1.3337 1.1292 1.3048 1.0845 0.7407 1.1796 0.9005 1.2672 0.7407 1.1018 1.0033 0.7407 N-acetyl-2-aminooctanoate* 1.7790 2.0021 1.6097 1.1850 0.9792 2.1074 0.6251 0.7596 0.7708 0.3848 0.6874 1.0708 1.6254 1.6346 1.3826 2.0283 1.4864 0.7298 1.5976 0.8399 2.9480 0.6262 2.0989 0.6878 0.6478 0.5148 0.6961 0.4400 0.7856 1.4229 0.9848 0.9663 0.2568 0.4509 0.2568 0.7893 1.4898 0.8889 0.9817 1.2646 0.8506 2.6258 3.4621 3.0010 2.5684 3.2321 2.2264 1.1036 0.7185 0.5597 0.6311 0.6552 0.5622 0.7483 0.3098 0.5176 0.7145 0.6645 1.1305 0.7233 1.1542 0.4200 1.2295 0.4456 1.3410 1.6356 0.9070 0.7516 1.6964 0.6570 0.4711 0.6937 0.8703 1.0000 1.5283 2.5124 2.1280 1.8241 2.0605 4.2382 0.6237 1.4137 1.1254 0.7570 1.7744 1.4587 1.6833 1.7412 2.0544 1.4409 1.9139 1.8493 0.6910 0.2568 0.2809 0.4831 0.4851 0.7365 0.8450 0.5684 0.4855 0.8200 0.5467 0.7652 1.7932 3.0306 0.9827 4.2196 3.8809 0.6131 0.9963 0.7308 0.3064 0.2568 0.2568 2.8953 1.1601 1.0600 0.5852 1.4586 1.6431 1.1610 1.1895 1.3138 0.2568 0.4763 0.3361 0.3463 0.2568 0.7156 1.2070 1.2121 1.4408 1.4763 1.2710 0.3829 0.5064 0.7777 0.3716 0.3588 0.6342 1.1255 1.1550 1.7992 1.7425 1.5395 0.6613 1.0618 0.7777 1.3734 1.3448 0.9041 1.5301 1.4665 2.0141 1.7121 1.6612 1.0800 1.7896 1.8656 1.6745 2.8308 2.0768 1.9675 3.0363 0.2568 0.2568 0.6400 0.8472 1.0000 0.4428 0.9231 1.1424 0.6566 0.5710 1.2514 0.2568 0.9246 0.2568 1.0619 0.3105 0.6754 0.5821 0.7810 0.6288 0.3659 0.2568 N-acetylaspartate (NAA) 1.2691 0.9708 1.0172 0.8291 0.9563 1.1755 1.0264 0.8281 0.9402 0.9824 0.9587 0.9656 0.8801 0.8648 0.8327 0.4710 0.8698 0.9998 0.9941 0.9629 1.2820 0.8329 1.0742 0.9644 0.8811 0.9734 0.8138 0.8825 0.5811 1.1199 0.8763 0.9630 0.9823 0.9421 1.0279 0.9065 1.0128 1.0194 1.1595 0.8595 1.0185 1.1242 1.2459 0.9941 1.0058 0.9330 0.9535 0.9544 1.0566 1.0188 0.5472 1.0317 0.9304 0.9924 0.9225 0.5175 1.0839 0.7815 0.4597 1.0900 0.9597 0.5837 0.4881 0.9917 1.1463 1.0621 1.1777 1.1285 0.5546 1.0376 1.0540 1.0610 1.2107 1.1447 1.0965 1.2607 1.4320 0.5413 1.1871 1.0794 1.0496 0.6172 0.9867 0.8995 1.3189 1.0203 1.1020 1.1602 1.2471 1.0474 1.1704 1.0241 0.9088 1.1431 1.0110 1.1126 1.1284 0.8468 0.9409 1.0498 0.9002 0.8890 1.0002 1.2121 1.2299 1.2208 1.2752 1.0844 1.0556 1.0415 1.0342 1.1379 0.9814 1.2367 1.2165 1.0468 1.0724 0.8666 0.8948 1.2128 1.2859 1.1197 1.3807 1.1743 0.8239 0.6876 0.7451 0.8167 0.7328 1.0928 1.0646 0.9044 1.0275 1.1113 1.0434 0.6534 0.9277 0.9328 1.0157 0.8942 1.0505 0.9238 0.8113 1.0370 0.8586 0.9561 0.8879 0.9493 0.8090 0.8759 0.9234 0.9028 1.0021 1.0820 0.9738 1.1919 0.9809 1.1332 1.0668 1.1491 1.0875 0.9437 1.1062 1.0399 1.0337 0.9247 0.5333 0.9731 1.1244 0.9213 0.9887 0.8571 1.1031 1.1226 0.9666 1.0355 0.9717 1.1341 1.1275 1.0823 1.1519 0.9899 1.0000 0.8219 0.9877 0.9326 0.8284 N-acetylleucine 1.1411 1.2039 0.9522 0.6815 1.1795 0.9503 1.3032 1.4968 0.6305 0.8094 1.2024 1.1172 1.0695 1.7568 1.4548 1.4226 1.2227 0.5124 1.1056 1.3886 1.6539 1.0328 1.5396 0.5124 0.9031 0.5124 0.5124 0.5124 1.1675 1.2524 0.8022 1.2044 0.5124 0.9422 0.8786 0.9140 0.8467 1.1040 0.8173 0.5124 0.9732 1.2152 1.3955 1.6836 1.1911 1.0000 1.2118 1.0656 0.5997 0.9245 0.9815 1.1846 0.5854 1.2865 0.5926 1.1014 1.2564 1.1725 0.9609 0.9837 1.2059 0.8424 1.1256 1.0000 1.0755 0.5124 1.2796 1.0027 0.7308 1.2459 1.1143 1.3640 1.0449 1.3128 0.5124 0.9502 1.4487 1.0458 1.3346 1.2183 0.8745 1.0015 0.7089 0.5124 1.3078 1.1045 1.1896 1.2231 0.7942 1.2922 1.4039 1.1231 0.9010 0.7908 0.9069 0.5124 0.8827 0.8592 0.5124 1.2591 0.5124 1.0924 0.5124 0.5435 0.6235 0.8881 0.9628 0.5124 1.4076 1.0130 1.1207 0.6517 0.5124 0.7994 0.5124 1.4664 0.8058 1.3289 0.9932 0.5124 0.5124 0.8074 0.5124 0.6404 0.9348 0.9102 0.5124 0.7191 0.9681 0.9458 0.8034 0.9124 1.3297 1.1435 1.1226 0.5124 0.7328 1.3919 0.9388 0.9311 1.1286 0.5124 0.9052 0.9826 0.5124 0.9297 0.8270 0.9123 0.7320 0.6948 0.9446 0.9069 1.1057 0.8906 0.9124 0.8005 0.6396 0.7070 0.5124 0.5124 0.8401 1.2058 0.7827 1.0958 1.1978 0.5124 0.5124 1.0377 1.1336 0.7144 0.5124 0.5124 1.3887 0.7604 0.5124 0.5124 0.5124 0.7173 0.5124 0.9116 1.0303 0.8929 1.0334 0.7342 0.5124 0.9034 0.5124 N-acetylmethionine 1.0187 0.8830 0.8442 0.8037 0.7981 0.7848 1.1468 1.1542 1.0198 0.8806 0.9739 1.0248 1.0438 1.2030 0.8926 1.0910 1.1265 0.7933 0.8990 0.9988 1.0748 0.9971 0.9598 0.8792 0.9455 0.7447 0.8952 0.9956 1.1236 1.3327 1.1559 1.1921 0.9198 1.0179 0.9874 0.8977 1.0506 1.1124 1.0623 1.0497 1.0469 1.1359 1.1216 1.2123 1.0386 1.2918 1.1360 0.9085 0.6763 0.6730 0.7466 0.8516 0.6534 1.3878 1.1494 1.1341 1.4201 1.2304 0.7808 0.7417 0.8718 0.7806 1.0198 0.7062 0.9583 1.0031 0.9609 0.9177 0.9949 1.0375 1.0130 0.9149 1.0392 1.0511 1.0630 0.8277 0.9291 1.0281 0.8044 0.7256 0.8976 1.0296 0.9473 0.8062 1.2677 1.1239 0.9849 1.0573 1.0984 1.4615 1.1219 1.0285 0.7577 0.7035 0.6907 0.9126 0.8306 1.2544 0.9912 1.0086 1.0753 1.1665 1.0557 0.5387 0.7558 0.7197 0.6631 0.5951 0.7502 0.7430 1.2926 0.8907 0.5879 0.6624 0.6303 1.0618 0.7403 0.6773 0.6512 1.3172 1.5164 1.4707 1.3626 1.3336 1.0012 1.0985 1.0057 1.2205 0.9949 0.9412 1.1863 0.8683 0.9873 1.0327 1.0457 0.7808 0.8174 0.9436 1.0000 0.8648 1.0408 0.8103 0.8593 0.9688 0.6470 1.0849 0.8314 1.0724 1.0111 1.1779 1.4084 1.0065 1.3752 0.9105 0.9627 0.9932 0.8822 0.9555 0.8700 1.0594 0.9642 1.0720 1.0831 0.9477 1.2719 0.9130 0.9954 1.0586 1.3584 1.3602 0.8834 0.9595 1.3840 1.0622 0.9003 1.3799 1.0364 1.1137 1.0569 1.2754 1.2452 1.0442 1.1136 1.0525 1.0286 0.8352 0.7377 N-acetylphenylalanine 1.0236 0.7830 0.6163 0.9226 0.9574 1.0103 1.1647 1.0542 0.7947 0.8727 1.0051 1.5148 1.4561 1.6183 1.3872 1.5864 1.4711 1.6187 1.2931 1.6892 1.7251 2.0922 1.7927 0.6447 0.6607 0.7670 0.6542 0.7814 1.0261 1.3359 0.7957 1.1288 0.9517 1.0504 1.2135 0.9357 0.8932 1.0926 0.9992 1.3196 0.9743 0.9652 0.9984 1.0540 1.0872 1.1043 1.0582 1.0986 1.0000 0.9387 1.2904 1.1346 0.9168 1.1759 0.7802 0.9108 1.0043 0.8594 0.9843 1.1509 1.2474 1.2052 1.2105 0.9587 1.0045 1.0489 1.1289 0.8860 1.0642 0.9951 1.2181 1.0065 1.1757 1.2910 1.2604 0.6761 0.7522 0.9540 0.7006 0.6835 1.4178 1.2957 1.5108 1.3530 1.7113 1.5695 3.0437 2.8375 3.2365 3.4086 3.0671 3.2388 0.8021 0.7142 0.8350 0.8120 0.7740 0.8448 0.9180 1.0235 0.8878 0.9957 0.9654 0.6320 0.5362 0.7247 0.7258 0.6497 0.8643 0.8436 0.8259 0.6948 0.7378 0.6458 0.6220 1.4071 1.1459 1.0053 0.9395 0.9727 0.9662 0.8454 1.0436 0.8782 1.0102 0.9234 0.7041 1.1748 0.8354 1.5599 1.4979 1.2935 1.2647 1.4298 1.4811 1.1259 1.0339 1.3679 1.2318 1.1227 1.4153 0.7964 0.9427 1.0246 0.8222 1.0165 0.8829 1.5323 1.5533 1.4123 1.9559 1.3701 1.8885 0.8674 0.8589 1.0712 0.8592 0.8490 1.0580 0.9278 0.8556 0.9014 1.0205 0.8355 1.3471 0.8499 0.6855 0.6741 0.9013 1.2146 0.6628 0.6261 0.9509 0.6885 0.5844 0.7741 1.0418 0.9318 1.1935 1.1376 0.9012 0.8007 0.7313 0.8071 0.7780 0.6526 0.5138 N-acetylthreonine 1.3231 0.9096 0.9952 0.6300 0.6765 0.8802 1.2238 1.2725 1.0357 0.8854 0.9121 1.4544 1.5459 1.1832 1.1749 1.3639 1.4195 0.5331 0.8454 0.6496 1.0060 0.6282 0.9294 0.7488 0.6882 0.5829 0.7739 0.7397 0.8898 1.3490 1.2826 1.4382 0.8337 1.0197 0.9395 1.0828 1.3535 1.1755 1.1872 1.2441 1.3279 1.4888 1.5629 1.2558 1.2169 1.2232 1.2350 0.9204 0.8038 0.5423 0.6221 0.9656 0.5396 1.1556 0.7549 0.8175 1.3263 1.0117 0.8637 0.7778 0.9996 0.8769 1.0579 0.7562 1.0616 0.9261 0.9228 0.9379 1.1605 1.0460 0.7388 0.6911 1.0871 0.8286 1.0084 0.8691 0.9395 0.8784 0.8802 0.9485 0.7405 0.9605 0.9808 0.6473 1.4195 1.4244 1.3771 1.3374 1.4066 1.3528 1.4053 1.4622 0.9936 0.6713 0.7250 1.1492 1.0586 1.0775 1.0538 1.0224 1.0752 1.2107 1.1069 0.8582 0.9969 1.3166 0.8933 1.1786 1.1578 1.4116 1.4690 1.1747 1.1363 0.8273 0.8480 1.0000 0.5753 0.5966 0.5428 0.9894 0.9463 1.0004 0.9580 0.9753 0.6511 1.0537 0.9117 1.0286 0.6913 0.7049 0.9715 0.7105 0.9935 1.0587 0.6991 0.7548 1.0041 1.2270 0.8474 0.8529 1.3194 0.8125 0.8958 1.1543 1.0534 1.3381 0.9990 0.8985 0.8993 1.1725 1.5135 0.9496 1.4063 1.0717 1.0606 0.9767 1.0298 0.9377 1.1200 1.2254 1.0733 1.2012 1.1724 1.0788 1.2592 0.6782 0.6667 1.0505 1.2478 1.2628 0.8164 1.0208 1.8690 0.8874 0.8224 1.8696 0.6428 1.1169 0.7398 1.2894 0.8261 1.1961 0.8932 1.1279 1.2215 0.7163 0.6501 N-acetylvaline 1.0577 0.8052 0.7532 0.6868 0.9511 0.6737 1.3365 1.0532 0.9992 0.8158 1.1088 1.1829 1.2801 1.0141 1.1144 1.4519 1.2937 0.7897 0.8892 0.7431 1.3390 0.9267 1.2096 0.9786 0.9381 0.7672 0.7398 0.8689 0.9985 1.3708 0.7577 1.2870 0.6587 1.1793 0.6875 1.1170 1.1714 1.0175 1.1305 1.0211 0.9762 1.2874 1.0763 1.1552 1.2082 1.3745 1.4200 1.0466 0.9284 0.7126 1.0241 0.8799 0.7406 1.0704 0.9501 0.7606 1.2410 0.8284 1.1172 1.0610 1.1420 0.8791 1.0118 0.6406 1.0589 1.1567 1.2347 1.0792 0.9127 0.9576 0.8767 0.8893 0.9226 0.9612 1.0074 0.7428 0.9058 1.2204 0.7443 0.9120 1.2751 0.9367 1.0096 0.8651 1.1498 1.1512 1.3352 1.2769 1.1894 1.7151 1.0863 1.1410 0.7226 0.7947 0.7053 0.9287 1.0331 1.2792 1.0993 0.8658 0.9505 0.9714 1.2354 0.9018 0.7679 1.2011 0.7369 1.0837 1.1453 1.0543 1.1001 1.2994 1.1879 0.8954 1.1121 1.1599 0.5789 0.5864 0.6607 0.9544 1.1165 1.3051 1.1146 0.9749 0.8625 0.7494 0.8463 1.2667 1.0015 0.9411 1.2132 0.9631 0.7801 1.3584 0.9360 1.0091 0.8385 0.9688 1.0056 0.8595 1.2051 0.6347 0.8141 0.9250 0.9404 1.0173 0.8407 1.2012 0.9424 1.0084 1.3666 1.0479 1.2672 1.1009 1.0299 0.9414 0.7492 1.0660 1.1644 0.9936 1.1378 0.9896 1.2484 1.1413 1.5651 0.8669 0.6959 0.9190 1.3315 1.2819 0.6947 1.0279 1.5660 0.9994 0.9460 1.5284 0.6200 0.9703 0.6808 1.0000 0.7961 1.3484 0.9936 0.8955 0.9785 0.7797 0.6181 naproxen 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 1.0817 0.8969 1.9676 1.0000 0.6391 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.2459 1.1424 5.5643 1.9098 2.5853 0.5356 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.0480 0.1375 0.2513 0.0733 0.1190 0.1750 0.0480 0.0480 0.0480 0.0480 0.0480 17.9280 0.8576 6.9717 8.6601 1.6263 3.6816 nervonate (24:1n9)* 1.4349 0.9210 0.4076 0.9581 0.9300 0.9403 1.3542 1.0841 0.7376 1.1585 0.9030 0.5755 1.4773 0.6440 0.8636 1.1971 0.8682 0.7599 0.7792 2.4055 1.1665 2.7698 1.3328 1.4371 0.9360 1.5479 1.8365 1.8498 0.8119 0.8807 0.9006 0.6188 0.9139 2.6792 1.0713 1.9596 2.2469 1.2599 0.3941 0.8363 0.8459 1.9225 2.1030 1.2611 1.5555 1.7921 1.8244 0.7398 0.7965 1.8493 2.5175 2.2243 1.3604 0.8519 1.3677 0.8394 1.2956 0.5774 0.5160 0.6954 0.3732 1.2275 0.4844 0.4889 0.8558 0.9738 1.1647 1.8659 0.5918 0.8844 0.5045 0.7630 1.1354 1.3292 1.0469 0.6115 0.9045 1.0558 0.7614 1.0473 1.0887 0.5502 1.4422 0.5901 1.9683 1.1814 0.6461 0.9721 0.8528 1.4312 1.2945 0.8228 1.4312 0.8789 1.2796 0.7974 0.7315 2.0331 1.1948 0.9096 1.2544 0.6237 1.7243 0.9776 0.7650 0.6778 1.6007 0.6232 1.0000 1.4599 0.7802 0.9570 1.7610 1.0823 1.6929 2.1315 1.3376 0.7704 0.7087 1.1985 0.7626 1.5290 1.8458 0.8416 1.3691 0.9877 0.6417 1.6558 1.7920 0.3294 0.9004 0.6313 0.8750 0.6674 0.6171 0.3501 0.3887 0.7779 1.1445 0.5868 0.7022 2.5034 3.1539 1.1625 0.7178 0.5119 1.0455 0.9333 0.8611 0.9591 2.1424 0.8735 0.7986 1.4032 1.0409 1.0123 1.3146 0.5606 2.4412 1.2029 1.8204 1.1295 1.1768 1.4506 3.2712 0.6455 0.6348 1.0187 1.7444 0.8968 0.6168 0.6712 0.7572 0.9049 1.3802 2.4419 1.0024 0.5530 1.5331 1.3871 1.0444 0.9137 1.2189 1.0565 1.4568 1.4510 0.6784 N-formylmethionine 1.0916 0.9051 0.8283 0.8523 0.7707 0.7791 1.0787 1.0507 1.0214 0.9003 0.9545 1.1638 1.1610 1.2531 1.0798 1.2206 1.2535 0.7490 0.7598 0.8631 0.8779 0.8238 0.8782 0.8772 0.9674 0.7017 0.8799 1.0358 1.0935 1.0831 0.9032 1.0104 0.8447 0.8542 0.8191 1.0000 1.0285 1.0600 1.0793 1.0575 1.0630 1.2196 1.1816 1.1839 1.1624 1.2744 1.0987 1.0171 0.8138 0.7445 0.8510 0.9417 0.6620 0.9799 0.7874 0.8188 0.9537 0.8456 0.8293 0.9091 1.0360 0.9266 1.0177 0.8468 0.9455 1.0120 0.9993 0.9444 1.0321 1.1042 1.0076 0.9442 1.0839 1.2314 1.2276 0.6826 0.6638 0.7485 0.5829 0.6396 0.9310 0.9371 0.8830 0.7733 1.2168 1.0655 1.2215 1.2850 1.3502 1.3881 1.3297 1.3357 1.0684 0.7928 0.8669 1.1472 1.0836 1.2606 1.1249 1.1628 1.1823 1.2628 1.1604 0.8077 0.9314 0.9232 0.9919 0.8721 1.0071 1.1795 1.2585 1.1752 0.9579 0.9999 1.0250 0.9142 0.7754 0.7488 0.7250 1.1926 1.2607 1.1427 1.1725 1.1646 0.8580 0.9332 0.9410 0.9562 0.8290 1.0650 1.0929 0.8564 0.9522 0.9253 1.0682 0.7061 0.7957 0.9680 0.8944 0.7662 0.9751 0.7925 0.8328 0.9714 0.8063 1.0416 0.8478 1.1261 1.0666 1.1490 1.2927 1.0289 1.3903 0.9273 1.0007 0.9470 0.9835 0.9564 0.9861 1.1292 0.9681 1.1112 1.0142 1.1284 1.1456 1.1022 1.0922 1.1753 1.4914 1.4251 0.9287 1.0417 1.3996 1.1153 0.9398 1.4221 0.9557 1.0133 0.9012 1.2240 1.0661 1.0836 1.1695 0.9081 1.0442 0.9375 0.7637 nonadecanoate (19:0) 1.2157 0.9860 0.4348 0.8616 1.0596 0.6106 0.9326 0.9923 0.5678 0.8513 0.7668 1.5444 1.7179 0.8903 0.9457 1.0281 1.0000 1.1455 0.8013 2.9256 0.9588 3.4645 1.4323 0.9316 0.7720 0.9429 1.0193 2.4411 1.0020 0.7435 0.9285 0.8494 1.3400 1.6734 0.7872 2.6443 2.1976 1.0340 1.0022 1.2703 0.9500 1.3219 1.1113 0.8936 0.9402 1.0193 1.1858 0.8502 0.8197 2.2138 3.3754 2.5772 1.8386 0.8511 1.0070 1.0467 0.8852 0.6974 0.4816 0.6952 0.8712 0.9683 0.6476 0.8819 0.9179 0.7774 0.9591 1.6594 0.9864 0.8166 1.2336 0.6468 1.9400 0.9897 0.9245 0.8854 0.7622 1.2873 0.8678 1.0431 0.9216 0.4317 0.8543 1.0287 1.2673 0.7410 0.8085 0.7941 1.1323 1.1729 0.9087 0.9549 0.8920 0.8209 0.8818 0.7441 0.7620 2.3728 1.0568 0.9076 1.2127 1.0027 1.7774 0.9527 0.8541 0.9128 1.8879 0.5384 1.0276 1.3559 0.8424 0.8877 2.6811 1.0894 1.8693 2.3681 1.6745 1.0125 1.0149 0.9846 1.3870 1.3006 1.9019 1.0585 0.8905 0.9325 0.8486 1.1143 1.1971 1.1199 1.4028 1.5411 0.9322 1.4164 1.6923 0.7579 0.5110 0.8531 1.3496 0.9704 0.8595 2.3302 2.8333 1.0958 0.6456 1.0982 1.0440 0.6783 0.8724 0.6651 2.3115 0.7901 0.8900 1.1544 1.2254 1.0907 1.0333 1.2981 2.1994 1.0007 1.3371 0.7668 1.3880 0.9993 2.3010 0.9975 0.8657 1.8207 2.3191 0.7616 0.7155 0.6595 0.7315 1.4768 1.3635 2.4535 1.0913 0.6124 1.6364 1.3502 1.2627 0.8484 1.2468 0.9731 1.1732 1.1981 0.6208 N-palmitoylglycine 2.1147 1.4697 0.5790 1.2566 1.1238 0.6487 1.0813 0.9108 0.4027 0.4027 0.6151 1.2397 1.8570 0.9086 1.0751 1.1532 0.9311 1.0061 0.6632 1.8177 1.3638 2.0631 1.7887 1.5702 1.3715 1.3694 1.5261 3.4027 1.5767 0.9655 0.9184 0.8149 1.1704 1.0246 0.6091 2.1491 1.6216 0.7453 0.8948 0.9286 0.7217 1.4624 1.1879 0.9149 0.9963 1.0162 1.2602 0.8255 0.6036 1.0581 1.4181 1.9970 1.0577 0.9799 0.7367 0.8187 0.8192 0.6134 0.6235 0.8075 1.2668 1.2016 1.0000 1.2702 1.4164 1.0384 1.1470 1.8789 1.1661 0.7317 0.6457 0.4027 1.4538 0.8586 0.8446 1.2770 1.1469 1.7233 0.9478 1.4507 0.4027 0.4027 0.5748 0.7957 1.6247 0.9255 0.8030 0.8403 1.0414 0.9564 0.8781 1.0861 0.8702 0.7449 0.7510 0.7266 0.6200 2.3666 1.1763 1.0521 1.1728 1.3369 1.4767 0.4027 0.5054 0.7130 1.4921 0.4243 1.1114 1.6565 0.7656 0.7022 1.3004 0.7333 1.2612 2.6533 1.3021 0.7170 0.7373 1.5594 1.5727 1.6029 2.3306 1.2476 0.8460 0.7752 0.4027 0.8812 0.7682 0.8032 1.1387 0.4027 0.4027 0.9837 0.9280 0.6513 0.4027 0.7405 1.1930 0.5648 0.8614 1.8131 1.8902 1.1032 0.6286 1.0457 0.8133 0.6964 0.7695 1.0596 2.3694 1.0542 1.0609 0.9318 0.8252 1.0835 0.9531 0.9835 1.8645 0.9569 0.8497 0.5996 1.0136 0.9783 1.6946 0.7317 0.5754 0.9575 2.5847 0.8619 0.8718 0.7329 1.1591 1.6785 1.5385 2.8739 0.6313 0.4027 0.8971 1.1630 0.6916 0.6665 1.0000 0.6618 1.0527 0.9869 0.4027 N-palmitoylserine 0.3535 0.3535 0.9252 0.3535 0.3535 0.6624 0.3535 0.8727 0.8755 0.5128 0.3535 0.3535 1.6961 0.3535 0.3535 0.3535 0.4731 0.3535 1.2876 0.3535 0.7237 0.3535 0.7351 0.3535 0.9453 0.3535 1.7433 1.7736 0.3535 0.6533 1.8353 1.1315 0.3535 0.3535 0.6384 0.3535 2.8905 0.3535 0.3535 0.3535 0.3535 1.4911 1.1071 0.7860 1.1239 0.8826 0.8304 0.8008 1.0904 0.3535 0.3535 0.3535 0.3535 0.3994 0.3535 0.3535 0.6899 1.2563 0.8586 0.8640 0.3535 0.3535 0.3535 0.4923 1.3861 1.3230 0.7608 0.3535 0.3535 0.3535 0.3535 0.3535 0.3535 0.3535 0.3535 0.9965 1.1849 0.3535 0.3535 1.6947 0.3535 1.0810 1.0000 0.3535 0.3535 0.3535 0.9592 0.7269 1.5832 0.3535 0.3535 0.3535 1.1195 0.5531 1.0000 0.3535 0.6463 0.3535 0.3535 1.0952 0.3535 1.2052 0.3535 0.5032 0.6487 0.9113 0.5125 1.3325 1.0401 0.3535 0.6383 1.1774 1.6463 0.7980 0.3535 0.3535 0.3535 0.3535 0.3535 0.6543 0.3535 0.3535 0.3535 0.3535 0.3535 0.3535 1.3633 1.0458 1.0612 0.3535 0.3535 0.3535 0.3535 0.3535 0.3535 0.3535 0.4818 0.3535 0.3535 0.3535 0.3535 1.3427 0.3535 1.1544 0.9017 0.3535 0.3535 1.1134 1.1085 1.2167 0.3535 0.3535 0.3535 0.5097 0.8994 1.6414 1.2296 0.3535 0.3535 0.8133 0.3535 0.8377 0.3535 1.3826 1.7317 0.3535 0.3535 2.7806 2.3836 0.8285 0.7233 1.4275 0.6687 1.4706 0.3535 3.3771 0.3535 1.1279 1.5495 0.9290 0.3535 1.1102 0.3535 1.1856 0.9790 0.3535 0.6323 octadecadienedioate (C18:2-DC)* 0.7950 0.7637 0.5212 0.9584 0.9134 5.8680 0.9729 0.8306 0.5302 0.7840 4.0311 0.9324 0.8851 1.1224 0.8605 2.5289 0.7690 0.7210 0.4962 2.4609 0.6400 0.9612 0.7040 1.7228 1.4531 3.0391 0.8609 1.4914 1.0958 0.8416 0.4634 0.7988 0.5527 4.2686 0.8250 0.9468 0.3804 0.5538 0.6182 0.9557 0.2630 2.4201 0.9098 1.4202 1.3325 6.7338 1.0587 0.4976 0.4163 3.0636 1.0964 0.4497 0.5958 0.7513 1.6430 3.1691 1.0018 0.4820 0.9749 7.6522 0.8124 1.4535 1.1681 1.5092 0.7879 0.6777 0.3263 0.5472 0.4213 0.5697 0.5283 1.5260 0.6804 1.4249 0.5110 8.5531 2.4589 2.4848 2.6126 1.4947 0.9073 0.4720 3.4032 0.4984 0.8318 0.8591 1.2821 0.4014 5.3213 0.4332 0.4475 0.4753 0.5459 1.1287 2.2160 0.5152 0.6324 1.2707 1.9140 0.9830 1.2675 9.7249 1.3503 1.4238 4.3187 0.8764 2.0042 0.6483 0.9326 1.0316 0.5381 0.8139 3.2081 1.4772 1.0861 0.7051 1.1053 3.0724 0.8803 1.0571 3.3770 2.2438 1.0054 1.4830 1.0306 1.6080 0.6040 0.7067 2.6315 0.8975 0.9169 4.0720 0.6775 1.0732 2.9977 2.5087 0.4779 1.1767 1.0571 0.5488 0.9451 3.3656 2.1692 0.7320 0.5776 1.0331 1.2800 14.2940 2.8302 3.2348 3.7834 6.1619 3.7450 2.2135 0.6328 0.8152 4.5168 1.0599 1.1717 1.9453 1.0983 7.5077 0.9951 0.8756 1.1246 0.9021 0.7277 0.5328 0.9982 0.9581 1.9603 1.0000 1.4258 2.4034 5.6511 1.4102 0.7094 0.4359 0.7105 0.5460 2.4759 0.9100 2.5518 0.9601 1.5504 1.6794 2.5304 octadecanedioate (C18) 1.0819 0.9174 0.4745 1.0383 1.0341 0.7483 1.1277 1.0187 0.5943 0.7624 0.7780 1.3360 0.9902 1.0372 0.7746 1.1851 1.0544 0.7157 0.4952 1.3454 0.6551 1.2251 0.8395 1.6004 1.4682 1.0342 0.9465 2.2971 1.4977 0.8728 0.6337 1.0927 0.7548 0.9283 0.8217 1.7024 0.8010 1.1285 1.0010 0.8150 0.7872 1.1567 1.0138 1.4190 1.3952 1.6528 1.3461 0.5716 0.4662 1.2698 1.3048 0.7769 0.6567 0.9512 1.2600 1.6277 1.4322 0.6142 0.9280 1.4504 1.2992 1.5578 0.9223 1.3574 0.7825 1.1250 0.8884 1.1956 1.0381 0.7906 0.9598 0.7106 0.9303 0.7609 0.6333 1.1216 0.9574 1.2696 1.0596 0.6949 1.1181 0.4679 0.5398 0.6680 1.1052 0.7126 0.7791 0.7518 0.6385 0.8928 0.6274 0.8113 0.6589 1.0185 0.9082 0.8484 0.8749 0.8535 0.9288 1.0405 1.4841 1.3810 1.1954 1.4415 1.2781 0.8935 1.5118 0.5919 0.7430 0.8327 0.6406 0.8403 1.1206 1.1247 1.2590 0.8027 0.7663 0.9012 0.8905 1.8103 1.1814 1.2871 1.6777 1.7031 1.0077 0.9586 0.4960 0.8393 1.1079 1.0478 1.2149 1.3184 0.7130 1.2138 1.3585 0.8066 0.8249 1.0000 1.1270 0.9571 1.0278 1.1600 1.1831 0.7694 0.7217 1.5887 1.2911 1.0014 1.0331 1.2569 1.7224 1.0852 1.3994 0.9308 0.8694 1.1484 0.9528 1.5320 1.3574 0.9573 1.2384 0.9445 0.8965 0.8869 0.8805 1.3294 1.1056 0.7508 1.1976 0.9923 1.2079 0.7771 0.8786 1.8284 1.0931 1.3577 0.6073 0.3773 0.6757 0.7571 0.8222 0.9966 2.7278 0.6672 1.2538 1.5957 1.1166 octadecenedioate (C18:1-DC)* 0.9040 0.8475 0.4698 0.8871 0.9384 1.3133 0.9495 0.9053 0.5924 0.6892 1.2536 1.2711 0.9655 1.5753 0.9291 1.5886 0.9590 0.5275 0.3793 1.5083 0.5362 0.8699 0.6016 1.5214 1.2067 1.2768 0.8376 1.9369 1.3212 1.0022 0.5146 0.9325 0.5063 1.2215 0.7268 1.2814 0.5480 0.7130 0.7374 0.6661 0.5301 1.2760 1.3190 1.5045 1.3909 3.4022 1.5324 0.5842 0.4226 2.0384 1.1849 0.6275 0.6076 1.1240 1.1866 1.9232 1.3360 0.7482 0.6613 1.6804 0.8383 1.1422 0.7808 0.7920 0.5881 0.8491 0.6169 0.9540 0.7540 0.7398 0.9033 0.8680 0.9001 0.8683 0.7798 2.6836 2.1316 2.0152 2.0686 1.3479 1.1840 0.6003 1.2277 0.7550 1.0720 0.7948 0.5637 0.5982 0.9978 0.5614 0.5226 0.5930 0.6039 0.7895 0.9435 0.6603 0.7539 0.9059 0.9409 0.8644 1.2554 1.7484 0.9947 1.3495 2.2273 0.9291 1.6394 0.5427 0.8450 0.8803 0.6563 0.7699 1.2710 0.9451 1.0421 0.7759 0.9005 1.7788 0.9180 1.5257 1.4016 1.5012 1.3022 1.4299 1.0225 1.2079 0.5716 0.9779 1.6051 0.7833 1.1503 1.9431 0.6331 0.9913 1.3010 1.0185 0.5734 1.1034 0.8544 0.7063 0.8459 1.4220 1.3856 0.9055 0.6100 1.2771 1.4711 3.7695 2.3236 2.7101 3.4052 3.0969 3.9706 1.1045 1.0788 0.9441 1.4195 1.1275 1.0261 1.3345 1.5556 1.8273 1.1063 1.0138 1.4981 1.1303 1.1402 0.7469 1.0257 1.2422 1.3194 0.8821 1.1839 1.8876 1.8337 1.4359 0.6158 0.4262 0.5864 0.7409 1.0899 1.2438 3.1900 1.0000 1.6226 1.7981 1.7130 oleate/vaccenate (18:1) 1.5993 1.2784 0.1191 1.1137 1.2327 0.4217 1.2287 1.2451 0.1693 0.9299 0.6270 1.3371 1.1075 0.6831 0.6633 0.6970 0.8862 0.9635 0.1519 1.8678 0.4656 1.9847 1.0725 1.1382 0.8227 0.9023 0.5181 2.1483 1.4949 0.6056 0.4707 0.7603 1.1167 1.2276 0.5464 2.5478 1.7751 1.3863 1.3008 1.5304 1.1059 0.6986 0.6374 0.4390 0.6498 0.5865 1.1560 0.6826 0.2598 1.6142 2.0193 1.9294 1.4571 0.8912 1.1296 1.2486 1.0540 0.1613 0.1461 0.4515 0.7352 0.9431 0.5293 0.6513 0.7670 0.7758 1.1434 1.7889 1.0689 1.1895 1.6468 0.6940 2.5925 1.5477 1.3495 0.6004 0.5894 1.3998 1.0609 0.7083 1.0398 0.1303 0.7015 1.2156 1.6143 0.8754 0.5331 0.6781 0.5598 1.2439 0.6974 1.0240 0.8266 0.8245 0.7922 0.9658 0.6679 2.1062 1.0668 0.7711 1.3450 0.6987 1.7989 0.7750 0.5021 0.6206 1.3026 0.1391 0.5935 1.4058 0.5387 0.3074 1.3944 0.8515 1.4893 2.2115 1.5183 0.9874 1.0561 1.1269 0.7780 1.3871 1.7477 1.1404 1.0651 0.9788 0.2614 1.1444 1.2002 0.8988 1.2244 1.2019 0.5990 1.0292 1.1723 0.8137 0.2371 0.7718 1.4005 1.1183 0.9528 1.3127 1.9022 0.8030 0.3328 1.1632 0.8743 0.5607 0.9467 0.5471 2.4936 0.7980 0.8946 1.1479 1.0845 1.0866 0.8557 1.4941 1.9536 0.8438 1.4253 0.5062 1.5193 0.7698 1.5939 1.0212 1.0583 0.5933 1.6360 0.5756 0.6754 0.1877 0.6540 1.4143 1.0066 1.9122 1.0000 0.1890 1.2263 1.1193 1.1403 0.7032 1.2994 0.6913 1.1673 1.2156 0.5229 oleoyl ethanolamide 2.3869 2.4211 0.6172 2.0029 1.4618 0.8810 1.0008 1.2455 0.5335 0.7621 0.5756 0.7732 1.0399 0.5276 0.6360 0.8029 0.7541 1.0993 0.7385 2.3151 1.0989 3.1358 1.3754 1.0094 0.9596 1.0424 1.5814 2.3369 1.4290 0.8395 0.9343 0.6637 0.8923 1.7419 0.5908 2.9369 2.2334 1.4061 0.7381 1.5176 1.0000 0.5343 0.7500 0.5688 0.5042 0.6560 0.9875 0.7165 0.5612 1.0284 1.9218 1.8836 0.8662 0.8437 1.1060 0.6844 1.0850 0.4570 0.5834 0.8234 0.5960 1.2464 0.6135 1.1839 0.9906 0.8262 1.2478 2.0469 0.8062 1.3599 0.6370 0.4507 2.7409 1.1847 1.4718 0.9403 0.7219 1.0255 0.9885 1.0477 1.2395 0.5879 0.9751 1.0535 2.7309 1.3151 0.7076 1.0745 1.0128 1.5425 1.0403 0.8938 1.1051 0.6732 0.8367 0.8322 0.5835 1.9189 0.6343 0.7456 1.0227 0.7455 1.5692 0.6941 0.6928 0.8593 1.3240 0.6885 1.0233 1.4779 0.6620 1.1714 2.1874 1.1191 1.4071 3.2423 1.6147 0.9205 0.9605 1.2118 0.8312 1.6081 1.7507 1.0715 1.0376 0.8030 0.4284 1.2959 1.2751 0.7383 1.1866 0.8049 0.8383 0.8980 1.0623 0.7675 0.4369 0.7576 1.2353 0.6059 0.6393 1.8138 2.0572 0.9599 0.4752 0.7613 0.6770 0.8038 1.1404 1.0918 3.0337 0.8845 1.1925 1.0472 0.8824 0.7531 1.0222 0.7475 2.3231 0.8164 1.3606 0.6427 1.3591 0.8752 2.1966 0.7801 0.6781 1.1190 2.2590 0.8474 1.2288 0.6788 1.1211 2.0525 1.6848 3.1521 0.8749 0.4457 1.4384 1.1195 1.0271 0.6407 1.4556 0.6101 1.3912 1.1350 0.4531 O-sulfo-L-tyrosine 1.4377 1.3434 1.0969 0.8032 0.7175 0.6589 1.2612 1.4285 0.9640 0.6682 0.7288 0.9443 0.9720 0.7768 0.9722 0.8866 0.9242 0.3899 0.7261 0.4732 1.0210 0.5663 0.9376 1.1073 0.9807 0.6923 0.8106 1.2195 1.3129 1.0338 0.9381 1.1701 0.6179 0.6009 0.5735 1.3245 1.4630 1.3392 1.2563 1.2133 1.0674 1.7290 2.0059 1.7924 1.7848 1.9121 1.8854 1.5037 1.0433 0.6530 0.9037 1.4791 0.9046 1.1380 0.5998 0.7956 1.1152 0.8821 0.7498 0.6579 1.1855 0.8028 1.1038 0.5746 0.9359 0.9985 0.9414 1.0519 0.8387 1.5709 1.0290 0.8460 1.5247 0.9566 1.6806 0.9589 1.0891 1.0438 0.9552 1.1012 1.0000 1.0658 0.7542 0.9348 1.7511 1.6786 1.4647 1.3451 1.4720 1.4217 1.6024 1.6229 1.0534 0.7791 0.6666 1.3244 1.1104 1.4988 1.4885 1.5303 1.4642 1.5830 1.6875 0.5903 0.7266 1.0869 0.6679 0.8597 1.2114 1.7895 1.8491 1.5923 1.0230 1.1534 1.1955 0.8685 0.5213 0.4472 0.4632 1.4604 1.4670 1.4724 1.1184 1.2839 0.5272 0.9987 0.6099 1.0013 0.6546 0.5268 1.0826 0.4755 0.9318 1.2253 0.7851 0.5702 0.6952 1.1119 0.8367 0.6451 1.0419 0.6457 0.6074 0.9634 0.7313 1.1809 0.6413 1.0036 0.7450 1.1831 1.6357 0.8989 1.3275 0.9917 0.9566 0.8051 0.7626 0.9818 1.0407 1.5421 1.3833 1.5588 1.3452 1.3163 1.6291 0.4458 0.4309 0.7458 1.1206 0.9935 0.7650 1.0946 1.6300 0.8974 0.8819 1.7567 0.6394 0.8064 0.5956 1.1726 0.5661 1.2696 0.9849 0.8464 1.4299 0.6184 0.5788 oxalate (ethanedioate) 1.3314 1.2528 1.0341 1.0033 0.9823 1.1553 1.0342 0.9806 0.7545 1.0834 1.2293 0.6487 0.6955 0.5168 0.8812 0.6301 0.6118 1.0011 1.3991 1.0149 1.1923 1.0679 1.2230 0.7840 0.7482 0.8050 0.5467 0.8253 0.7882 0.9749 0.8136 1.0831 0.8487 0.9399 0.7574 0.9001 0.9103 0.9286 1.2823 0.5960 1.0901 1.2409 1.1437 1.1907 1.1055 1.1320 1.0472 1.1566 0.9633 0.8754 0.9220 1.1506 1.0043 0.7306 0.6338 0.7546 0.7834 0.5293 0.9243 1.0512 1.2326 1.0594 1.0827 1.0424 1.2668 1.0882 1.1464 1.1324 1.0581 0.7600 0.7927 0.6879 0.7878 0.9092 0.8746 1.5571 1.6392 0.9744 1.4896 1.3669 0.8767 0.6203 0.7956 0.9834 0.8448 0.6452 1.0129 0.9989 0.9664 0.9109 1.0649 1.1366 1.0649 1.0517 1.1643 1.2447 1.0608 1.0206 1.1852 1.0735 1.0493 1.0956 1.0997 1.0509 0.9861 1.1152 1.0745 0.9467 1.1939 1.2629 1.2292 1.0188 1.0373 1.0000 1.1289 1.3707 1.3701 1.3422 1.1726 0.6420 0.7055 0.8356 0.5484 0.6764 0.3583 0.4327 0.3312 0.4895 0.3962 0.8650 0.9128 0.9514 0.7418 0.9960 0.9177 0.3157 0.2646 0.3121 0.3686 0.4513 0.3407 1.2372 1.3601 1.2256 1.0848 1.3915 1.1944 0.5988 0.5907 0.4827 0.6119 0.7961 0.6379 1.1125 0.9798 1.1052 1.0289 0.9905 1.0338 1.4639 1.2231 1.2561 1.1802 1.2419 1.1516 0.7414 0.7794 0.7392 1.0445 0.8926 1.2661 0.8505 1.0803 1.2149 1.0384 1.1235 1.0579 1.0357 0.9931 1.2446 1.0177 0.5664 0.8583 0.4216 0.6117 0.6867 0.5883 palmitate (16:0) 1.4645 1.0986 0.2219 0.9897 1.0602 0.4744 1.2350 1.2233 0.3580 0.8874 0.6909 1.5316 1.3629 0.8960 0.8734 0.9170 1.0899 1.0016 0.3441 1.8087 0.5150 1.9974 1.1483 1.1137 0.7835 0.8754 0.7013 2.0327 1.2863 0.7491 0.7035 0.8882 1.1844 1.3372 0.6891 2.4133 1.8617 1.3687 1.2539 1.5143 1.0927 0.8329 0.7884 0.5351 0.6945 0.6465 1.0863 0.6684 0.4713 1.4781 1.8554 1.7864 1.3584 0.8826 1.0757 1.2465 1.0536 0.3922 0.2617 0.5431 0.7898 0.9261 0.6408 0.7482 0.8493 0.8045 1.2152 1.7135 1.0697 0.8737 1.3466 0.5882 2.1044 1.2723 1.0781 0.5547 0.5468 1.1682 0.8289 0.6744 0.9859 0.2866 0.7575 1.2835 1.5238 0.8704 0.6870 0.7371 0.8315 1.2861 0.8664 1.1668 0.8487 0.8963 0.7707 0.8719 0.6979 2.1599 1.0846 0.8698 1.3832 0.8241 1.8553 0.7541 0.5757 0.6179 1.2893 0.2777 0.6580 1.4352 0.6057 0.5023 1.4667 0.8302 1.5311 2.1540 1.5421 1.0337 1.1045 1.0265 0.8836 1.2798 1.6017 1.1263 0.9785 0.8909 0.4654 1.1572 1.1919 1.0079 1.3106 1.3022 0.7638 1.2046 1.3314 0.8536 0.3434 0.7996 1.4032 1.1346 1.0000 1.3831 1.8241 0.8648 0.4036 1.0824 0.8537 0.6434 1.0001 0.6126 2.3184 0.8202 0.9202 1.0081 1.0752 1.1296 0.8507 1.3511 1.8983 0.7908 1.2794 0.5470 1.3075 0.7606 1.5544 1.0546 0.9984 0.9935 1.7226 0.7168 0.6182 0.3709 0.6561 1.2939 1.0281 1.8128 1.0325 0.3417 1.3568 1.3289 1.2160 0.7296 1.3419 0.7742 1.1366 1.1972 0.5226 palmitoleate (16:1n7) 1.9065 1.3974 0.1127 0.8229 1.2995 0.2607 2.1564 2.2549 0.2003 1.4368 0.7309 1.5157 1.0573 0.7083 0.4861 0.5217 0.9483 0.7949 0.1268 1.4546 0.3196 1.9140 0.9529 2.1062 1.4645 0.9861 0.5102 4.3647 4.0439 0.7802 0.3821 0.8437 1.1997 0.8752 0.5247 6.2890 3.1686 2.7694 2.1696 2.4150 1.6555 0.4591 0.4618 0.2761 0.4415 0.2604 1.0438 0.7821 0.1897 1.2303 2.2600 2.5303 1.6317 1.0906 1.2200 1.4478 1.4867 0.1444 0.1187 0.2324 0.5582 0.6908 0.4331 0.4218 0.6184 0.7013 1.1694 2.4465 1.1400 2.0854 3.3988 0.8935 6.9900 2.8572 2.5901 0.7186 0.6646 2.2691 1.7489 0.8299 1.6807 0.1396 0.6813 2.1717 3.3434 1.1232 0.5042 0.7460 0.3779 1.7024 0.8184 1.1442 1.2368 1.0139 0.8675 1.5677 0.7573 4.4758 1.3128 0.8945 2.0355 0.7168 2.9822 0.6145 0.3203 0.4278 0.9530 0.1275 0.3801 2.1299 0.6717 0.3199 1.2084 0.8791 2.1994 4.2978 1.8939 0.9205 0.9944 1.7601 0.8218 2.2996 3.0065 1.9522 1.3502 1.5989 0.2950 1.6048 1.3878 0.5744 0.8530 0.5867 0.3576 0.5976 0.8017 0.7903 0.2443 0.7555 1.7352 1.5510 1.1664 1.0038 2.2048 0.7151 0.2368 1.5508 0.8359 0.5468 1.1555 0.5528 6.0096 0.8729 1.0000 1.1888 1.1846 1.2347 0.8248 2.3363 3.1688 0.6886 1.6878 0.3713 1.6771 0.5720 1.6636 1.8076 1.6135 0.6084 3.1984 0.9095 1.0281 0.2288 1.1262 2.7528 1.4929 6.3522 0.6308 0.1461 0.6764 0.7216 0.6717 0.9466 1.8239 0.6316 1.5030 1.3274 0.4878 palmitoyl ethanolamide 1.3507 1.5474 0.5647 1.1052 1.2416 0.6412 0.9506 1.2984 0.8003 0.6003 0.6530 1.0752 1.4106 1.0267 0.8878 0.9392 0.9755 0.8689 0.8730 2.0850 1.2830 2.4247 0.9916 1.2158 0.9317 1.3702 1.4540 1.9656 1.1136 1.0769 1.2797 0.7528 0.8536 1.8696 0.8938 2.5554 2.1516 1.0070 0.7444 1.4254 1.1857 0.7446 0.9353 0.6458 0.6241 0.8421 0.9253 0.6921 0.8637 0.8971 1.7824 1.6839 0.8186 0.9107 1.1241 0.7109 1.1201 0.7237 0.5105 0.6865 0.6062 1.0484 0.7286 0.9252 0.9625 1.1396 1.3050 1.7254 0.7959 0.8761 0.5447 0.3332 2.2243 0.7246 1.0642 0.8880 0.6106 0.8304 0.8178 1.0409 1.1793 0.5803 1.1258 1.0000 2.2405 1.2913 0.7748 1.1549 0.9976 1.4423 1.2225 0.9237 1.1879 0.7117 1.0024 0.8631 0.7103 2.1324 1.0319 0.8271 1.1539 0.9775 1.5700 0.6807 0.7272 0.8330 1.0009 0.6626 1.0653 1.3073 1.0172 1.3256 1.6326 0.9005 1.6613 2.8503 1.4595 0.9315 1.1203 1.0238 0.7930 1.4293 1.4788 0.9534 0.9585 0.8389 0.6098 1.1326 1.2480 0.8907 1.1381 0.8411 0.9065 0.9737 0.9648 0.9743 0.6755 0.9160 1.0577 0.5789 0.7950 1.7584 1.9172 1.0725 0.7723 0.7272 0.9641 0.8527 1.0586 0.9379 2.8840 0.7424 1.2150 1.0595 0.8078 0.7286 1.1177 0.8319 1.8097 1.0228 1.0618 0.8278 1.1962 1.0544 2.1455 0.7646 0.5946 1.3531 2.2576 0.8913 1.0438 1.0244 1.1916 2.0165 1.8397 2.4069 0.7705 0.5928 1.4137 1.0840 1.1287 0.6699 1.3956 0.7662 1.2512 1.3807 0.5103 pantothenate (Vitamin B5) 1.0446 0.9099 0.6175 0.9119 0.9931 0.6954 1.1807 1.2149 0.8268 0.9953 0.9326 0.9471 0.7466 0.7306 0.9666 0.8400 0.7692 1.0064 0.5607 1.0813 1.0515 1.0748 1.0733 1.1274 1.2170 1.0408 0.8877 1.3884 1.0768 0.7602 0.6955 0.8329 0.8726 0.7469 0.7346 1.6915 1.9631 1.6934 2.0323 1.7953 1.7545 1.4308 1.2453 1.3956 1.3976 1.2740 1.3480 1.0031 0.6344 0.6712 0.8050 1.0233 0.8447 0.9952 0.9131 0.6764 0.9556 0.5995 0.6369 0.6623 0.8665 0.9756 0.8626 0.8996 1.8694 1.7036 1.7880 2.0195 1.7896 0.9674 0.5802 0.3578 0.9512 0.7482 0.9764 1.0075 0.9552 1.0894 0.9185 0.8778 1.0291 0.6312 0.8560 1.0666 1.3172 1.1871 1.0043 1.0569 0.8811 1.1889 0.8921 1.0184 1.1255 1.1029 1.0964 1.1529 0.9957 1.3157 1.5308 1.2901 1.4599 1.2126 1.4300 1.3964 1.0583 1.3031 1.6483 0.8713 1.3213 1.6188 1.7926 1.1655 1.2231 1.6151 1.5870 0.7859 0.6742 0.5139 0.5855 0.9254 0.9002 1.1185 0.9071 0.9023 0.7496 0.9114 0.4939 0.9316 0.6019 0.7243 0.9863 0.5791 0.5918 0.8349 0.8109 0.6019 0.5715 0.9635 0.9886 0.9655 0.8590 1.0419 0.7449 0.8335 0.5391 0.8968 0.9452 1.1406 1.1525 0.7747 1.6005 1.3486 1.3096 2.7535 2.7203 2.7947 2.6360 2.9392 3.0194 3.1812 3.5779 3.1903 3.3867 3.0759 4.1492 0.8368 0.9107 0.5326 0.7809 0.8362 1.2380 0.9147 1.3507 1.3877 0.9874 1.4770 1.2950 0.9257 1.0000 1.3435 1.1512 1.2270 1.4989 0.7856 1.2168 1.0200 0.9180 p-cresol sulfate 1.2070 1.1080 1.2167 0.8018 0.9165 0.8281 1.9649 1.3786 1.9574 1.2235 2.1953 2.1321 2.0629 2.1099 2.4660 2.7516 2.0526 0.2077 0.6551 0.6076 0.5997 0.6942 0.8111 1.6268 0.9394 1.0097 0.6258 1.3271 0.5220 0.8717 0.5011 0.5059 0.3506 0.1595 0.7512 0.4714 0.4778 0.5512 0.1153 0.4045 0.2762 2.0555 1.0823 1.6291 1.4962 2.2513 1.5594 2.6325 1.7352 1.6038 1.5946 1.6059 0.5150 0.9518 0.6053 0.9085 1.1219 1.1474 1.4170 1.4326 1.6125 1.0159 1.5773 1.0600 1.3248 1.2401 0.9253 1.0213 1.1586 0.0457 0.4443 0.3173 0.0529 0.4408 0.1285 0.3512 0.8536 0.6554 0.7217 0.6651 0.4075 1.0732 1.0000 0.7434 1.0873 0.6556 0.4288 0.6214 1.0216 1.6841 1.9963 2.0860 0.8673 0.5750 1.5346 2.0946 1.7083 2.0184 1.6385 1.4819 1.3221 1.9724 1.4149 0.8889 1.4611 2.1636 1.0883 2.0491 1.7813 1.9893 1.0655 2.3292 2.4279 1.5469 1.1659 0.7617 0.7242 0.9408 0.6746 1.0108 1.1384 1.3663 0.7806 1.0009 0.2511 0.1396 0.1787 0.1644 0.1934 0.7321 0.6131 0.4836 0.4885 0.5134 0.4254 0.8385 1.2640 1.1412 0.8655 0.8194 1.1560 0.8627 1.2983 0.7151 1.7439 2.0571 0.6871 0.2163 0.4747 0.3820 0.2909 0.4037 0.3921 0.2463 0.7124 0.9824 1.3194 0.9991 1.2459 0.1524 1.2303 1.5285 1.2374 1.2325 1.4409 0.7680 0.2948 1.5536 1.7244 1.1208 0.3779 1.3659 1.5178 1.0949 1.3069 1.3478 0.5174 1.2275 0.4442 0.9634 1.0338 0.4001 0.4852 0.7798 0.6515 0.3621 0.6339 pentadecanoate (15:0) 1.3294 1.0370 0.4412 0.7886 0.9353 0.6656 1.0261 1.1975 0.5292 0.9344 0.7384 1.7032 1.8102 1.0642 0.8559 1.1304 1.2868 1.0172 0.6344 1.8704 0.7278 2.2960 1.3235 1.0997 0.8334 0.9699 0.9430 2.4141 1.5482 0.8022 0.9142 0.8371 1.1351 1.3133 0.7297 3.2212 2.3886 1.2649 1.3246 1.6645 1.1759 0.9550 0.8522 0.7156 0.7471 0.7524 0.9543 0.8525 0.6979 1.4309 2.0846 2.3456 1.3906 0.8273 0.8595 1.0041 0.9002 0.5997 0.4287 0.6303 0.8968 0.9019 0.7486 0.7454 0.9256 0.8652 1.2393 1.8690 1.1118 0.8392 1.0876 0.6250 2.2670 1.1214 1.0764 0.7040 0.7220 0.9761 0.8924 0.9425 0.8849 0.4373 0.8377 1.2005 1.5458 0.7748 0.7052 0.7564 1.0141 1.1072 0.8662 0.9959 0.8376 0.7389 0.7929 0.8077 0.6670 2.5745 1.0271 0.9270 1.3030 0.9164 1.9052 0.8264 0.6706 0.7460 1.4937 0.5268 0.8502 1.7755 0.7771 0.8087 1.8295 0.8553 1.8493 2.3956 1.3580 0.8502 0.8733 0.9891 0.7834 1.1821 1.7448 1.0596 1.0239 1.0819 0.7867 1.2947 1.2686 0.9207 1.1432 1.0743 0.7729 1.0050 1.0990 1.0163 0.5414 0.8149 1.6198 1.1397 1.2162 1.5975 2.4850 1.0377 0.5904 1.0386 1.0438 0.7263 1.0007 0.7273 2.7105 0.7868 0.8918 1.0763 1.1911 1.2132 0.9615 1.4552 2.3528 0.8234 1.3161 0.6876 1.4040 0.8788 1.8386 1.1841 1.0070 1.6012 2.5970 0.9318 0.6272 0.5957 0.7112 1.4077 1.1531 2.7750 1.0654 0.5450 1.5001 1.5181 1.2417 0.6660 1.2338 0.8034 1.0000 1.2686 0.5949 perfluorooctanesulfonate (PFOS) 1.3051 1.0750 0.9876 1.0366 0.9335 1.0812 0.8300 0.6943 1.0124 0.7252 0.8104 2.0811 2.8453 1.4939 1.5449 2.3800 1.5438 0.4701 0.7560 0.8458 0.6130 1.1459 0.6179 0.8601 0.8178 1.3739 1.9186 2.3915 1.0000 1.1956 2.2807 1.2454 1.7515 2.4704 1.1455 0.9856 1.1652 0.4980 0.4869 0.5275 0.4170 0.0489 0.0524 0.0489 0.0489 0.0489 0.0489 0.5065 0.8663 0.8512 1.1350 1.0386 0.6798 0.7775 0.7881 0.7762 0.7237 1.3339 0.6274 0.6246 0.6280 0.6110 0.5531 0.5912 0.0489 0.0489 0.0489 0.0489 0.0489 0.0493 0.0790 0.0824 0.1445 0.0489 0.0785 3.8128 3.5316 3.2737 2.1731 4.1683 0.0489 0.0489 0.0489 0.0489 0.0508 0.0489 0.8721 0.7791 1.7198 0.8008 0.8692 0.7927 5.3772 4.4630 4.0702 3.8581 4.0771 1.4678 0.6200 0.6079 0.6822 0.8267 0.9595 2.4250 2.5540 2.4145 4.2643 2.9271 3.5692 1.7162 1.1902 2.2149 2.8387 1.1186 2.0305 3.1481 2.6460 1.8015 1.5128 0.0489 0.0489 0.0489 0.0489 0.0489 1.0349 1.0470 2.0294 1.4200 1.6417 1.2605 1.4660 1.6475 1.7295 1.5040 1.4092 0.5898 0.5337 0.5697 0.8451 0.5302 0.6278 1.5245 2.0032 0.7177 0.7324 0.6052 0.6749 0.8194 0.6973 1.1142 1.5812 0.7098 0.6613 1.0970 1.0141 1.1403 1.1967 1.1266 2.1720 0.8851 0.8752 0.8353 1.0673 0.8974 2.1768 0.1967 0.1971 0.9961 0.6539 0.2414 0.5505 0.8718 0.6189 0.9348 1.1785 1.4984 1.6776 1.6841 2.7949 2.0119 1.7588 0.2676 0.3118 0.4332 0.3893 0.3957 0.2757 phenol sulfate 0.7018 1.1319 0.5809 0.5805 0.4029 2.6739 1.1527 1.1944 1.4072 0.7508 1.9437 1.6736 1.4021 1.0721 0.8491 0.7864 1.8343 0.3680 1.5403 0.9776 1.0636 0.7491 1.7052 1.1221 0.9452 2.1792 2.2859 0.4654 1.4404 3.1801 2.8833 3.0503 2.6748 3.8372 1.3637 1.4484 0.7696 1.3257 0.6590 2.7188 1.8310 2.2559 1.1198 3.3588 2.9285 3.6938 2.5230 0.8221 2.3301 1.4269 0.7536 2.2690 1.0000 0.4713 0.2436 0.3601 0.5533 0.5091 1.0680 0.6756 0.8492 0.6989 0.8033 0.6909 0.4011 0.4179 0.2567 0.2984 0.3540 1.5790 1.5428 3.6252 1.6588 2.2418 3.0239 1.7710 0.9351 1.4616 1.0513 0.9612 0.3603 0.5366 0.8974 0.3546 0.7477 0.5402 2.2114 2.5065 7.8144 3.2995 2.2870 3.2228 0.6469 0.8016 1.0979 1.6340 1.1383 3.0925 2.4943 3.2837 5.5867 5.8396 4.9429 1.6898 1.7004 0.6777 0.9269 0.8530 0.6654 0.9402 0.9337 0.9713 1.6930 0.5091 0.7377 0.9159 0.9278 1.6180 0.7661 0.7346 0.7572 0.6560 0.5949 0.7165 0.5795 0.6109 0.7380 0.8825 0.7973 0.6363 0.7252 0.7308 1.2007 0.7390 0.8133 0.4968 0.6203 0.3720 0.4059 0.2940 0.4760 0.4821 1.0415 1.3989 1.1188 1.6489 0.6927 1.5349 1.2462 2.0645 2.2273 1.1405 1.5284 0.6743 0.9918 1.3143 1.2061 0.8199 1.0082 3.2081 3.3504 3.4979 3.2781 3.6938 2.7802 0.5084 0.3630 2.2086 1.3056 1.4236 0.9036 3.3110 1.8989 1.0835 3.7780 3.4510 0.5177 0.8738 0.5910 0.7465 0.5831 0.4012 0.4548 0.4163 0.4443 0.2562 0.2063 phenylacetate 0.8886 0.8538 0.6463 0.8868 0.4171 1.0576 1.6488 1.2921 1.3124 0.7339 1.5573 1.3576 1.0049 1.2048 1.1895 1.7312 0.9917 0.3176 0.3176 0.3176 0.3176 0.3176 0.7030 0.7429 0.7383 0.3176 0.3176 0.7926 0.3176 0.3176 0.3176 0.3176 0.3176 0.3917 0.3176 0.5578 0.3176 0.3176 0.3937 0.3176 0.3176 1.5424 0.5558 1.4941 1.5982 1.4907 1.4793 2.1478 1.1708 1.3951 1.5002 1.5772 0.3320 1.0317 1.0188 1.7116 1.7659 1.2543 1.5560 2.7076 2.3654 1.4945 2.2009 2.3680 1.0356 0.8858 0.3176 0.3176 0.3176 0.3176 0.5902 0.8867 0.3176 0.6350 0.3176 0.6086 1.4239 1.4274 0.8909 0.8102 0.3176 0.3176 0.5526 0.5790 0.6430 0.3176 0.3176 0.3176 2.2383 1.5583 0.9294 1.0632 0.3176 0.3176 0.5336 0.8808 0.6067 0.7604 0.6259 0.3176 1.1742 1.2327 0.6682 2.7772 2.9266 3.8162 1.8209 3.4162 3.4365 1.0002 0.3176 1.1217 0.9023 0.7368 0.3176 0.7128 0.5337 0.5712 0.5568 0.6743 1.1407 0.9272 0.3986 0.9812 0.3176 0.3176 0.3176 0.3176 0.3176 0.8616 0.3176 0.9406 1.0392 1.0342 0.6156 42.7057 50.4028 42.3280 39.0450 35.0876 37.6482 0.9998 1.3218 0.4975 3.1188 3.3055 0.6881 0.3176 0.3176 0.3176 0.5143 0.3176 0.3176 0.3176 0.3176 0.3176 1.2800 0.5294 0.8792 0.3176 0.8395 1.0910 1.3013 1.2635 1.5824 0.5647 0.3176 0.8658 1.2129 0.3176 0.3176 0.8730 0.5357 0.3709 0.6922 0.9925 0.8782 0.7407 0.6829 0.9928 1.0269 0.3176 0.3176 0.3176 0.3176 0.3469 0.3176 phenylacetylglutamine 1.0533 1.0000 0.9732 0.7981 0.8752 1.1104 1.3319 1.0037 1.1847 0.9129 1.7802 1.8210 1.8134 2.2938 1.7938 2.5032 1.5396 0.1638 0.3958 0.4264 0.5165 0.4907 0.6479 1.1427 0.7340 0.7894 0.5088 1.1053 0.3575 0.8335 0.6241 0.6772 0.6126 0.8929 0.7167 0.8002 0.5334 0.7366 0.4492 1.3499 0.7127 1.6835 1.1911 1.5265 1.7311 1.8131 1.6010 2.0703 1.3624 1.3880 1.5021 1.7277 0.8047 1.2297 0.8229 1.4132 1.6696 1.3491 1.4771 1.8446 1.8553 1.4153 2.0554 1.7638 1.3174 1.2710 1.1591 1.2338 1.3173 0.2328 0.7454 1.0137 0.3268 1.0737 0.6857 0.3925 0.8901 0.9994 0.8832 0.7660 0.4567 0.8590 1.0029 0.7922 1.0736 0.5915 0.3393 0.6423 2.0803 1.8372 1.8054 1.9714 0.6092 0.4269 0.9826 1.3592 0.9103 1.4385 1.1903 1.0591 1.4758 2.1142 1.3802 1.2958 1.2948 1.7483 1.1665 1.6239 1.4735 1.8349 0.9661 1.6171 1.9572 1.5656 1.1293 0.8750 0.7650 1.1027 0.6188 1.0249 1.3234 1.1887 0.7100 0.8568 0.6510 0.5756 0.5702 0.6933 0.9019 1.0608 0.8309 0.7975 0.8809 0.9019 0.7910 0.6793 0.8236 0.9834 0.8117 0.7500 0.9262 1.2182 1.7399 0.7987 2.3831 3.1343 1.0099 0.8441 0.7474 0.9869 1.1573 0.5914 0.8873 0.2478 0.7467 0.8537 1.2712 0.9390 1.2367 0.5307 1.4220 1.5495 1.5329 1.5311 1.4335 1.0174 0.5821 1.2597 1.4077 0.9440 0.2909 1.1850 1.0840 0.8025 1.1206 1.2874 0.7409 0.8824 0.5139 0.8949 1.0265 0.6615 0.3175 0.6485 0.8602 0.4209 0.3756 phenylalanyltryptophan 1.5102 1.0396 0.7101 0.5230 0.5514 0.8899 1.2457 1.2002 0.8966 0.5550 0.9661 1.3302 1.3102 1.0405 1.0661 1.2423 1.5527 0.5123 0.5766 0.7677 0.8362 0.5158 0.8021 1.6507 0.7532 0.8538 0.9515 1.1668 1.2141 1.6061 1.1779 1.5376 0.9680 1.1749 0.9568 1.8128 1.3491 1.3953 1.4229 1.2230 1.2671 1.1678 1.4397 1.2869 1.3554 1.2201 2.0693 1.0350 0.8659 0.7302 0.6504 1.0003 0.6709 0.8772 0.6005 0.9402 1.0551 0.9109 0.7173 0.9244 0.7844 0.8771 0.8430 0.6736 1.5707 1.7687 1.0125 1.8380 1.3339 1.2174 1.0064 0.8055 1.5608 0.8314 1.2454 1.6762 1.1826 1.2266 1.3557 0.9334 0.6998 0.9935 0.6718 0.4964 1.8372 1.6362 1.0160 0.9942 0.9603 0.8675 1.0870 1.1659 0.8324 0.7256 0.6835 0.8056 0.8814 1.4196 1.2467 1.4042 1.7392 1.5895 1.6593 0.6864 0.9932 1.1113 0.6503 0.9997 1.1271 1.2865 0.9065 0.8711 0.8736 0.6082 0.8460 1.0020 0.7253 1.1863 0.7720 0.9328 1.2716 1.0058 1.3886 1.2827 0.5138 1.2000 1.1008 1.0454 0.9052 0.7256 1.2595 0.9602 1.0461 1.0963 0.7802 0.7268 0.8955 1.0791 0.7788 0.7150 1.0797 0.6900 0.7958 0.9789 0.6394 1.2774 0.6963 1.0766 0.8879 1.1831 2.0178 0.9496 1.6081 0.9442 1.0449 0.9405 0.9522 1.1101 1.1950 1.4388 1.8046 1.4153 1.6359 1.4384 1.5269 0.7181 0.5966 0.9608 1.3162 0.8863 0.6617 0.7078 1.0343 0.8825 0.8148 1.2540 0.4408 0.8315 0.4408 1.0863 0.7581 1.3182 0.9241 0.5951 1.3236 0.9455 0.7869 phenyllactate (PLA) 0.9811 0.8736 0.6499 1.0530 0.9408 1.0602 0.8467 0.7050 0.6611 0.8682 0.9739 1.7275 1.9546 2.2118 1.9401 1.7818 2.1265 1.0765 0.6547 1.3051 1.0999 1.2247 1.0331 0.6618 0.6392 0.7108 0.5912 0.8737 0.6670 1.2338 1.0164 1.1363 1.2959 1.2204 1.3661 0.8968 0.9933 0.9951 0.9513 0.9365 0.9567 1.0344 1.0255 1.0885 1.1941 1.0389 1.0991 0.6145 0.4754 0.7789 0.8814 0.5954 0.7217 0.9138 0.9270 0.9246 0.9986 0.8034 1.5120 1.9543 1.9295 2.1588 1.6839 2.1153 0.7588 0.7988 0.6027 0.5513 0.6142 0.7250 1.0000 0.8477 0.6230 0.9897 0.8671 0.9754 1.0035 0.8147 0.7913 0.9423 0.9531 0.7219 0.9013 0.8419 0.8397 0.7872 1.6052 1.6071 1.5560 1.5382 1.4224 1.4976 1.2266 1.2987 1.2747 1.1659 1.0387 0.9549 0.8804 0.9755 0.9004 1.1090 1.0267 1.3234 1.3453 1.1273 1.4185 0.7906 1.1437 0.9725 1.0021 0.8996 0.9224 1.0664 1.0647 0.4719 0.6320 0.6471 0.5604 0.5908 0.8321 0.8710 0.5589 0.7308 0.8689 0.7907 0.6964 0.8819 0.9868 2.3394 2.0351 1.8877 1.5400 1.8364 2.3712 1.7055 1.4643 1.7304 1.9322 1.6112 1.7676 1.3050 1.3268 1.1453 0.9832 1.2223 1.5225 1.2191 1.1221 1.0744 1.2159 1.1409 1.2288 0.9709 0.9276 0.9957 1.0161 1.0558 1.1117 0.9012 0.7363 0.9055 0.7940 0.8852 0.9843 1.1141 1.0916 0.6535 0.9889 1.0014 0.9859 0.7431 0.9118 0.9862 0.9519 1.0009 1.1158 0.8474 1.1438 1.1372 1.0812 1.3827 1.6495 1.1885 1.4562 1.3882 1.5728 phytanate 1.0787 1.0000 0.2339 0.7176 0.9131 0.6112 0.8903 0.7593 0.4219 0.6475 0.5500 1.8537 3.3674 1.8265 1.2531 2.1193 1.6951 1.7300 0.5000 3.1629 2.8019 5.5006 2.4638 0.7696 0.5366 0.7864 0.7338 2.9226 0.8459 0.9081 1.5505 0.7906 1.0028 1.4533 0.8720 2.4578 3.0433 1.1139 1.0229 0.6898 0.9630 1.4711 1.3537 1.3588 1.0874 1.1391 0.8399 0.8775 1.0930 1.4233 2.8329 3.1659 0.9778 0.6877 0.3890 0.4555 0.5244 0.3368 0.4824 0.7348 1.2124 1.3811 1.1212 1.3171 1.5508 0.9773 0.8063 1.3734 0.8504 0.5690 0.6071 0.4047 1.3673 0.5730 0.6927 1.0156 0.8889 1.2912 0.8784 1.0320 0.6871 0.1323 0.7116 0.6240 1.1225 0.8003 0.5370 0.5251 0.9745 0.7106 0.8251 0.7259 0.9038 0.7502 0.8479 0.5477 0.6469 3.1792 0.7709 1.0477 1.1110 1.5782 1.6130 1.0132 0.7908 0.7025 2.2210 0.3817 1.2583 1.2614 0.7636 0.9178 2.2024 0.8216 2.0998 2.6971 1.5040 0.8301 0.7298 0.8897 0.8682 0.8425 2.2292 0.9707 0.7782 1.0453 0.6456 1.3211 1.1711 1.0208 1.2890 1.2805 0.5250 1.0113 1.1474 0.6910 0.8895 1.1368 1.1573 0.6485 0.7668 3.1392 3.3953 1.7630 1.2378 1.8193 1.9169 0.9432 0.9856 1.0016 2.4511 0.8440 1.1997 1.0995 1.5891 1.2415 1.1212 0.9972 2.1781 1.0041 0.9492 0.8232 1.3986 1.3225 3.9587 1.0868 0.6874 1.8331 3.9495 1.1932 0.8055 0.4540 0.8619 1.8076 1.3805 3.1064 0.7513 0.3239 1.9380 1.7366 0.7832 0.8747 0.9242 0.5712 1.3340 1.4489 0.4841 pregnanediol-3-glucuronide 0.9142 0.8312 0.5294 0.3266 0.4781 0.5316 1.1157 1.1196 1.0926 0.7603 1.0056 0.9029 0.8298 0.6334 0.8594 0.6831 0.7395 0.2071 0.3601 0.4729 0.5260 0.2071 0.5827 0.2071 0.2071 0.2071 0.2071 0.2071 0.2071 0.4103 0.4672 0.2071 0.3408 0.6080 0.4866 7.6798 4.4536 6.1341 5.5539 4.9816 4.7843 1.6368 1.6275 1.5323 1.7653 1.5787 1.4768 0.9208 1.1350 1.1816 0.5871 0.9386 0.2071 1.3465 0.9919 1.1480 2.3489 1.9099 1.3912 1.4964 1.2178 1.1037 1.1201 1.2828 2.5873 1.2969 1.2014 1.2313 1.2129 0.2071 0.4131 0.3154 0.4824 0.4755 0.6551 1.0488 1.0845 1.0282 0.8811 1.1517 0.3257 0.6433 0.4257 0.2071 0.6977 0.6731 0.2071 0.2071 0.2272 0.2071 0.2071 0.2071 5.2507 5.9045 6.7680 5.6265 5.9513 1.1843 1.0771 0.8638 0.8284 0.8406 1.0000 0.5981 0.6448 0.6869 0.2071 0.7976 0.5756 1.2450 0.9981 1.3101 1.8486 1.1540 1.1799 0.2071 0.2071 0.2071 0.2071 1.5205 4.8990 8.1309 2.6731 2.6505 0.8514 0.9163 0.9239 1.0500 1.1171 0.2071 0.7807 0.5925 0.5839 0.8457 0.5458 4.3362 5.3492 4.5106 5.6056 4.9903 5.1616 0.7287 0.5889 0.6824 0.5301 0.9044 1.0000 0.8915 0.8979 1.0849 1.2438 0.8984 1.1119 0.4892 0.5948 0.7956 0.6739 0.7522 0.9336 0.7234 0.7325 0.7054 0.7919 0.7838 0.8554 3.3168 1.9150 15.0602 10.1123 11.2775 0.2071 0.4579 0.5631 0.6009 0.6645 0.7513 4.4195 3.4406 4.1687 1.5271 3.8759 12.2060 14.5222 13.9492 13.2678 12.0480 12.1529 pregnen-diol disulfate* 0.6363 0.6243 0.6244 0.6672 0.5865 0.6005 0.5686 0.4899 0.6462 0.6764 0.7999 1.9682 1.7419 1.5927 1.6843 1.6824 1.7781 1.4560 1.4904 1.6428 1.2346 1.6361 1.4348 0.2923 0.2956 0.2997 0.3178 0.3644 0.3191 1.2759 1.2710 1.2585 1.2989 1.7385 1.4942 2.0667 1.7982 1.8212 1.9713 1.8383 1.7216 1.0787 0.8610 0.9973 1.0646 0.9901 1.0748 0.8570 1.1356 1.4550 1.5002 0.8300 1.1613 1.1698 1.4801 1.2543 1.3135 1.3134 2.7430 2.4760 2.4304 2.1196 2.0581 1.9165 0.4897 0.4841 0.3874 0.4470 0.3728 1.4663 1.6064 1.3553 1.4641 1.7477 1.4882 0.9962 0.9064 0.8543 0.8472 0.8652 1.0000 0.8299 0.8401 0.9503 0.8257 0.7122 0.8008 0.6885 0.7781 0.7449 0.6690 0.7766 1.0862 1.0072 1.0429 1.0830 1.2187 0.3013 0.2802 0.2658 0.3166 0.2950 0.3269 0.6336 0.5949 0.5441 0.6726 0.5689 0.5125 0.9162 1.2474 1.2491 1.0545 0.8604 0.8648 0.2999 0.3672 0.3990 0.3268 0.7119 1.0244 1.1637 0.9243 0.9153 1.4924 1.2820 1.4517 1.5415 1.5236 2.0237 2.7031 2.2396 2.8607 2.5483 2.0762 0.7025 0.8278 0.8599 0.7681 0.6622 0.7711 4.3789 3.6157 3.6999 3.4381 4.0325 3.9786 2.3035 2.0160 2.6366 2.6054 2.1208 2.3495 0.8411 0.8465 0.8845 0.8800 0.8991 0.9789 0.9678 1.0558 0.9310 0.9770 0.8159 0.9928 0.6240 0.5505 0.9290 0.9168 0.9563 0.2831 0.2416 0.2068 0.2951 0.2942 0.2420 1.7744 1.6484 1.7005 1.5004 1.6123 1.6301 2.2716 1.8011 1.9534 1.9783 1.8504 pregnenediol sulfate (C21H34O5S)* 0.7689 0.8157 0.5690 0.5700 0.6966 0.8134 0.5079 0.3668 1.0719 0.4492 0.6355 1.9273 2.1098 1.5605 2.0331 2.0090 1.8667 1.1797 1.8050 2.0243 1.4600 2.0643 1.6452 0.2721 0.1524 0.2481 0.2859 0.2774 0.2138 0.7629 1.5698 0.9564 1.0746 2.0348 0.9874 1.5218 1.7779 1.8310 1.8624 1.2356 1.3017 1.3488 1.2683 1.0754 1.5130 1.0993 1.1139 0.7382 1.4556 1.9684 0.7405 0.7694 0.5909 1.5291 1.6802 1.4504 1.4995 2.4047 1.8195 1.6989 1.8279 1.4935 1.5635 1.5269 0.8039 0.6648 0.6284 0.4919 0.5437 0.6582 0.8109 0.6379 0.8189 0.9041 0.7738 1.4924 1.5174 1.1555 1.2963 1.1982 0.7606 0.7339 0.8799 0.6078 0.9144 0.6410 0.8465 0.6557 0.8360 0.6797 0.6781 0.7389 1.2155 1.2725 0.9717 1.0196 0.9189 0.6707 0.5397 0.5364 0.4017 0.4992 0.6184 0.8568 0.9496 0.7952 0.9784 0.7979 0.8123 1.3547 0.8504 1.3620 2.0616 1.0152 1.2409 0.3049 0.3065 0.3352 0.2921 0.7821 1.0126 1.0317 1.0875 0.9054 0.9127 0.7723 1.1436 1.4162 1.3725 1.8974 2.7308 2.2823 2.2775 2.6114 2.0650 0.8062 0.7762 1.1089 0.8819 0.7667 0.9844 2.2003 2.7140 1.9974 2.1489 2.2700 1.9849 1.8931 1.3747 1.9099 2.0983 1.3241 1.5822 1.1251 1.2852 1.3560 1.1582 1.0392 1.7334 0.8073 0.5993 0.4991 0.8878 0.7255 0.7733 0.6408 0.5767 1.8819 0.8803 0.6784 0.3734 0.3927 0.2835 0.4152 0.5065 0.4805 0.9451 1.0000 0.9493 0.9364 1.1447 1.8212 2.2013 2.7625 2.3225 1.8445 2.0195 pregnenetriol disulfate* 0.4218 0.4811 0.4827 0.4715 0.4043 0.5210 0.4682 0.3445 0.6524 0.5188 0.7845 1.3971 1.3014 1.2212 1.3406 1.3228 1.3439 1.0829 1.3830 1.4622 1.1310 1.2411 1.3264 0.4163 0.4168 0.5050 0.5618 0.6090 0.5018 1.5821 1.7314 1.5886 1.3092 2.3224 1.7264 1.5391 1.3934 1.4206 1.4079 1.3993 1.0764 0.8921 0.7752 0.8147 1.0000 0.9110 1.0247 0.7900 1.3689 1.5595 1.2225 0.7759 0.8980 0.9071 1.2162 1.0169 1.0710 1.2135 2.8039 2.1716 2.3325 1.7337 1.9631 1.3988 0.5838 0.5915 0.5410 0.5799 0.5064 1.6514 1.7142 1.6874 1.6517 1.8188 1.7458 0.6967 0.6287 0.4990 0.5394 0.5504 1.3141 1.3879 1.3146 1.1921 1.2188 1.0054 1.2482 1.0181 1.1944 1.0154 1.0586 1.1331 0.9999 0.7872 0.7965 0.9139 1.0407 0.4607 0.3905 0.3847 0.4663 0.4057 0.5208 0.5027 0.6227 0.4957 0.5072 0.6339 0.5156 0.5962 0.9478 0.9983 0.7101 0.5175 0.4548 0.2138 0.2563 0.3741 0.2918 0.6720 0.9302 0.9195 0.8484 0.9376 1.2249 0.9749 1.3299 1.4223 1.5190 1.2040 2.0564 1.4764 2.0090 1.7730 1.2325 0.4599 0.5742 0.5474 0.3761 0.3782 0.4816 2.5640 2.0373 2.3706 2.0562 2.5222 2.2457 2.1919 1.8846 2.5974 2.3455 1.7380 2.2812 0.9998 0.9974 0.9773 1.0870 1.0001 1.1309 0.9001 0.9209 0.8173 0.8972 0.7011 0.8880 0.3454 0.3206 0.5767 0.3997 0.4182 0.4266 0.5118 0.3397 0.4512 0.5848 0.4656 1.3894 1.7843 1.5687 1.7275 1.8233 1.0229 1.2083 1.2425 1.2080 1.0856 1.1722 pregnenetriol sulfate* 0.5512 0.6367 0.5628 0.4730 0.4965 0.6417 0.4231 0.3310 1.2446 0.3838 0.4931 1.7898 1.6806 1.5291 1.8247 1.7962 1.8437 1.0132 1.4074 1.4753 1.4183 1.3969 1.5487 0.4202 0.2523 0.3634 0.4291 0.4097 0.3651 1.1272 2.0302 1.2251 0.9507 2.1275 1.1512 1.3101 1.4030 1.5891 1.6005 1.0205 1.0566 1.0421 1.0142 0.7712 1.3203 0.8903 0.9467 0.8163 1.8596 1.7996 0.7629 0.7310 0.6478 1.0657 1.3321 0.9785 1.1934 2.0323 1.9340 1.3340 1.9910 1.3231 1.5942 1.3572 0.8605 0.7781 0.7558 0.6545 0.5748 1.0000 1.0049 0.8950 1.0683 1.1125 1.1136 0.9881 0.8848 0.6085 0.7941 0.6852 1.1623 1.2077 1.2595 0.8162 1.2527 0.9870 1.4581 1.0779 1.1999 1.2020 1.0874 1.2854 1.0868 0.9627 0.6273 0.8451 0.7714 0.6121 0.5270 0.5405 0.5022 0.4986 0.6316 0.5480 0.7401 0.7045 0.7326 0.6528 0.7317 1.1604 0.8890 1.1867 1.2662 0.9225 0.9192 0.2780 0.2563 0.3337 0.2658 0.7208 0.7843 0.7780 0.6929 0.6957 0.7900 0.6708 0.9283 1.1725 1.1088 1.1774 2.2580 1.4555 1.6113 1.9459 1.3841 0.5030 0.6475 1.0308 0.4863 0.5302 0.8603 1.7006 1.6011 1.7514 1.5721 2.0160 1.5388 1.7383 1.3826 2.1857 2.4244 1.2188 1.9897 1.3786 1.5087 1.5207 1.3841 1.3427 1.6979 0.8373 0.7398 0.5317 0.8092 0.7434 0.6842 0.4567 0.3385 0.9868 0.4648 0.3843 0.5748 0.6825 0.4240 0.5936 0.7380 0.7485 0.8188 1.2659 0.7387 1.1021 1.1626 1.2129 1.3743 1.7371 1.4130 1.1512 1.1784 pregnenolone sulfate 1.1160 1.1457 1.2366 0.6228 0.6091 1.3389 0.2172 0.2172 2.6075 0.2172 0.3198 1.1897 1.9594 0.9202 1.2585 1.4258 1.3243 0.8826 2.4333 0.9908 1.2050 1.7526 1.3890 0.2172 0.2172 0.2172 0.2886 0.2510 0.2172 0.7975 3.6122 0.7073 0.6707 1.6007 0.8592 1.1938 1.9142 1.0319 1.1260 0.7511 0.9366 1.4181 1.0514 0.8861 1.0048 0.9631 0.7593 0.8084 3.7603 2.0250 0.7876 0.9379 0.6004 1.1255 1.1881 0.7180 1.0000 5.3569 2.0527 1.3382 2.0622 1.4209 1.5723 1.7138 0.9558 0.6972 1.2397 0.5166 0.4993 0.3315 0.4775 0.3332 0.6156 0.7893 0.5649 3.4197 2.8848 1.9132 2.7129 2.8198 0.7916 1.2347 1.3010 0.6758 1.0423 0.7040 0.5675 0.2172 0.7991 0.3710 0.4090 0.5046 1.7759 1.8099 0.9572 0.9895 1.1448 0.6072 0.3290 0.4075 0.2724 0.4029 0.4477 0.4291 0.5885 0.6766 0.8467 0.9519 0.7161 1.1782 1.0583 2.2594 1.8145 0.4528 0.7694 0.5165 0.4038 0.3318 0.3475 0.9169 0.8966 1.2825 1.2090 0.9019 1.0167 0.9971 3.0431 2.0957 1.8331 1.3132 2.2690 2.0848 2.5185 2.0650 1.4384 0.6226 0.7913 0.9134 0.6205 0.6478 0.9952 1.9080 2.1222 1.6248 1.7334 1.8414 1.3136 1.8127 1.3833 2.5492 2.8228 1.1966 2.0365 0.8957 1.7200 1.4365 1.4053 0.8469 2.0636 0.8887 0.6720 0.5507 0.8937 0.8203 1.3195 0.7279 0.4339 8.0138 2.1548 1.3082 0.2438 0.5095 0.2172 0.2583 0.4483 0.6806 0.6410 1.5863 0.7352 0.6797 0.8948 1.7073 2.0247 3.8089 1.9953 1.5791 1.1832 propyl 4-hydroxybenzoate sulfate 0.9097 0.4804 0.5512 1.1901 0.8973 1.4716 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.7372 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 5.0277 3.2729 3.0055 4.9246 0.9432 0.6235 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.4121 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.9601 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 3.1522 0.5152 2.3097 2.5181 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.5602 1.7713 0.7024 0.2106 0.5956 0.8800 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 3.4230 1.2622 2.3977 1.4866 0.5948 0.4499 0.9034 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.5047 1.0300 1.1321 1.5561 1.6773 2.1293 1.6238 0.4088 0.5768 0.9700 5.8350 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 0.3517 1.1064 2.2887 2.7503 1.0000 0.1275 0.1275 0.1275 0.1275 0.1275 0.1275 pseudouridine 1.0895 0.9616 1.0000 0.7684 0.8317 0.9000 1.0261 1.0239 0.9064 0.8369 0.9265 1.1653 1.0754 1.0025 1.0378 1.1702 1.0985 0.6855 0.7378 0.7104 0.8651 0.7116 0.8853 0.7969 0.8034 0.7289 0.8033 0.8164 0.8583 1.1606 1.1060 1.1851 0.8763 0.9020 0.9294 1.0141 1.1457 1.1158 1.1006 1.0704 1.0167 1.2899 1.2073 1.1753 1.0824 1.1748 1.1067 0.9964 0.9270 0.7622 0.7708 0.9764 0.7225 1.0067 0.7360 0.8504 1.0508 0.9394 0.8436 0.9315 1.0615 0.8914 1.0150 0.8758 1.0122 1.0347 1.0138 1.0213 1.0029 1.0550 0.8725 0.8503 1.0697 1.0560 1.1203 0.9910 1.0399 0.9620 0.9565 0.9490 0.9849 1.0899 1.0373 0.8882 1.3463 1.2401 1.2262 1.1801 1.2918 1.2957 1.1865 1.2564 0.9881 0.8131 0.7937 1.0145 0.9373 1.1512 1.1242 1.2187 1.1640 1.2483 1.1538 0.8525 0.8871 0.9922 0.9259 0.9408 1.0329 1.2330 1.2529 1.2113 1.0119 0.9732 1.0037 0.8719 0.7118 0.7744 0.6623 1.0621 1.0145 0.9971 1.0337 1.0650 0.7480 0.9639 0.9281 0.9382 0.8245 0.8120 1.0161 0.8007 0.9439 0.9487 0.9173 0.7388 0.8421 0.9571 0.8087 0.7477 1.0186 0.7920 0.8622 0.9555 0.8947 1.0013 0.8161 0.9941 0.8718 1.1556 1.2028 0.9766 1.2514 1.0341 1.0305 1.0745 1.0133 1.1090 1.0838 1.1083 1.0265 1.0298 0.9586 0.9623 1.1253 0.7805 0.7729 0.9751 1.0998 1.0502 0.9383 1.2620 1.5461 1.1023 1.0233 1.6140 0.8151 0.9776 0.8061 1.0426 0.8181 1.1693 1.0282 1.0477 1.1496 0.8210 0.8139 pyridoxate 1.0000 0.6989 0.7207 1.0994 0.9227 1.2831 0.8305 0.6760 0.7562 0.7422 0.9731 0.9954 1.2139 0.8106 1.3992 1.3637 1.0614 0.7856 1.0972 1.0866 0.9351 1.0359 1.0871 0.5366 0.8577 0.8621 0.5351 1.0079 0.6845 0.9186 0.8799 1.1533 0.8528 1.3136 0.9584 0.8011 0.8157 0.8631 1.2143 1.0066 0.9441 1.6409 1.4261 2.0123 1.9674 2.4510 1.5951 0.7374 0.7586 0.7680 0.6578 0.7546 0.5605 0.9757 0.8391 0.8293 0.9855 0.7417 0.6805 0.9921 0.8516 0.9209 0.6560 0.8716 1.1090 1.2396 1.2353 1.0793 1.3175 0.6952 0.6513 0.7928 0.8674 0.9399 0.6146 1.5620 1.8878 1.1084 1.2469 0.9956 0.6404 0.7857 1.1676 0.7416 1.3409 0.7931 1.1969 1.2176 1.6502 1.0608 0.9482 1.1429 0.7338 1.0274 1.2447 0.9071 0.7343 0.8105 1.2300 1.0657 0.7358 1.3077 0.9693 1.3731 1.8893 1.8733 1.5272 1.6183 1.7356 1.1742 1.1760 1.1992 1.1809 1.6498 1.4564 0.5553 0.6959 0.4971 0.4786 0.5229 0.8104 1.0308 0.4738 0.5951 0.4428 0.4224 0.4307 0.5369 0.4993 1.5791 1.7497 1.9758 1.4660 1.6463 1.2802 0.6683 0.5653 0.6594 1.0329 1.1933 0.6673 0.8855 1.2433 0.7433 0.8369 0.9905 0.8700 1.4961 1.1211 0.9014 1.0657 1.2948 0.8660 1.5273 1.5631 1.7023 2.2075 1.4243 1.8515 1.9563 1.3651 2.1170 1.6084 1.6645 1.8142 0.7771 0.5864 0.8514 1.0099 0.7158 1.6057 1.3019 1.7326 1.7804 1.7443 1.8625 1.0406 1.1854 1.0897 1.1063 1.1167 0.4504 1.0199 0.5829 0.7874 0.6998 0.7152 stearate (18:0) 1.4465 1.0597 0.4055 1.1127 1.1491 0.6220 1.1306 0.9958 0.5703 0.8579 0.7717 1.3106 1.4452 0.8517 0.9522 0.9891 1.0636 1.0785 0.6227 2.3743 0.8820 2.4195 1.2158 0.9740 0.7117 0.9314 0.9081 2.0390 0.9850 0.7656 0.9820 0.9059 1.3988 1.5988 0.8410 2.2938 1.8233 1.1805 1.1003 1.3097 0.9969 1.1521 1.0247 0.7794 0.8540 0.8849 1.0651 0.7323 0.6706 1.7444 2.1590 1.8936 1.4560 0.8326 1.0662 1.1059 0.9529 0.6336 0.4461 0.7422 0.9568 1.1262 0.7550 0.9973 0.9904 0.8191 1.0287 1.6174 0.9852 0.7968 1.1465 0.6208 1.6806 1.0293 0.9075 0.6736 0.6605 1.1689 0.7771 0.7752 0.8745 0.4590 0.7675 1.0481 1.2180 0.8085 0.8637 0.8411 1.1196 1.2554 0.9611 1.0987 0.8646 0.9157 0.8934 0.8604 0.7947 1.9893 1.0724 0.9013 1.2468 0.9598 1.6758 0.8921 0.8439 0.8239 1.8089 0.5014 0.8804 1.3790 0.7174 0.7257 1.9785 1.0952 1.6088 2.0133 1.5646 1.0856 1.1233 1.0494 1.1328 1.3152 1.6889 1.0438 0.9339 0.8777 0.7146 1.1024 1.1880 1.2232 1.4773 1.4955 0.9115 1.3876 1.5874 0.8746 0.4972 0.9396 1.3916 1.0633 1.0000 1.6909 2.0972 0.9413 0.6000 1.0902 0.9123 0.7139 0.9277 0.7093 2.0186 0.8706 0.9724 1.1052 1.1042 1.1066 0.9506 1.1828 1.8319 0.8902 1.2060 0.6725 1.1978 0.9100 1.6709 1.0027 0.9599 1.2766 1.7925 0.7687 0.7191 0.5315 0.6956 1.2733 1.1566 1.8375 1.1161 0.5574 1.4001 1.3145 1.2851 0.7877 1.3213 0.8467 1.1890 1.3052 0.6433 stearidonate (18:4n3) 1.7035 1.1484 0.1718 0.8234 0.8016 0.1389 1.7882 1.2538 0.1389 0.5141 0.6657 2.6441 1.4147 1.3589 1.4021 0.8728 3.0232 0.9811 0.1389 0.1389 0.7350 1.9682 1.3486 1.3958 0.6596 0.4422 0.3520 1.3379 1.3630 0.9994 0.1389 0.1389 0.1389 0.6580 0.7073 4.7148 2.3468 2.5496 2.5792 2.9850 2.1968 0.3107 0.1389 0.2862 0.4783 0.5342 0.6458 0.8426 0.4257 1.0000 0.9650 1.6379 0.7827 0.7058 0.7804 0.4614 0.7756 0.1389 0.1389 0.1389 0.3133 0.7240 0.1389 0.2743 0.6114 0.6746 0.8245 0.1389 0.1389 1.0763 1.1328 0.5222 1.8753 0.7923 1.3588 0.8870 1.1328 1.9586 2.5782 0.8362 0.8531 0.2018 0.1389 1.0923 1.6916 0.9902 0.6329 0.9071 0.7905 1.8943 1.0316 0.1389 0.5629 0.5638 0.4967 1.4021 0.1389 1.8921 0.6594 0.1389 0.1389 0.1389 1.5862 0.6865 0.6779 0.3137 1.1503 0.2198 0.5375 1.9912 1.1442 0.5525 0.9424 1.0617 1.6871 5.2251 2.5627 1.6493 1.7358 1.2324 0.9581 2.3634 1.4068 0.5796 0.1389 1.3225 0.1389 1.2884 0.1389 1.0315 1.6653 1.2232 0.8369 1.6958 1.6646 1.4083 0.5814 1.7625 1.9015 2.5260 1.5262 0.5928 1.0741 0.8135 0.2602 0.9135 0.5141 0.8531 1.1605 0.6475 3.3575 0.7408 0.7903 1.3392 1.4537 1.1147 0.1389 1.6209 3.2437 1.0006 1.4820 0.8668 2.2822 1.2398 0.1389 0.1389 0.1389 0.1389 2.1729 0.9762 1.2444 0.4063 1.8706 1.7281 1.6455 4.7584 0.7763 0.1538 0.4050 0.7059 0.7040 0.8898 1.7040 0.1389 1.3467 0.6978 0.3095 sulfate of piperine metabolite C16H19NO3 (2)* 2.7744 3.7009 2.9902 2.0446 2.6643 4.3904 0.8051 1.2228 0.8721 0.6191 1.3154 0.2741 0.2780 0.3228 0.9748 0.2741 0.2741 1.4877 0.2741 0.9900 0.3884 0.8078 0.3606 0.7439 1.0014 1.0698 0.5422 0.4857 0.5451 1.8090 1.0631 1.2922 1.3967 2.3987 1.1102 1.0535 1.9261 1.2018 0.9698 1.1803 0.9534 1.4651 0.8209 0.3541 0.3856 0.2741 0.3607 0.4216 0.2741 0.3739 0.2741 0.2741 0.2741 0.6279 0.7383 0.2741 0.4969 0.4293 0.2741 1.2439 0.2741 0.2741 0.4196 0.7238 0.3554 0.4356 1.1931 0.8087 1.2469 4.6464 3.2779 4.2561 4.9136 2.8969 6.8834 2.6472 2.8443 2.6810 3.5907 5.0008 0.6369 0.6733 1.0852 0.7308 0.6219 0.7224 1.6259 1.6859 3.7712 1.9990 4.0148 2.5824 0.9233 0.2741 0.5974 0.4727 0.4980 1.3802 1.0685 0.7108 0.6391 1.3308 0.8546 0.2741 0.2741 0.5566 0.3500 0.5161 1.0342 0.3991 0.6666 0.4338 0.9804 0.8554 0.4752 1.2179 1.3250 1.6302 1.0000 1.0003 1.2332 1.2776 1.0273 1.1208 0.4162 0.5249 0.4552 0.4258 0.2741 0.3502 0.8119 1.3129 0.3911 0.3563 0.9472 0.7941 0.6992 0.9086 0.4935 0.6625 0.8364 1.0751 0.8979 0.3636 0.2741 0.2741 0.2990 1.2155 0.8387 0.8667 0.9253 1.1368 1.0482 0.9997 1.4559 0.6054 1.3343 0.8229 1.0686 2.7436 3.1688 4.4173 4.0162 3.1266 5.6726 1.0864 1.1268 0.7096 0.9362 1.3636 1.2092 1.5414 2.7243 0.9860 1.8453 1.8087 1.3216 2.1003 1.8695 2.5591 1.4385 1.1192 0.2741 0.6192 0.7017 0.2741 0.5590 sulfate of piperine metabolite C16H19NO3 (3)* 3.1379 3.4246 2.8825 1.3982 2.1418 3.4363 0.8641 1.0250 0.7203 0.4920 1.0425 0.2940 0.2940 0.2940 0.9795 0.2940 0.2940 1.6791 0.2940 1.0368 0.5442 0.6011 0.2940 0.9558 1.1078 1.1055 0.5524 0.5683 0.6835 1.9555 0.9579 1.2987 1.2250 1.9763 1.0091 0.8156 1.7653 1.3352 1.1082 1.6252 0.8593 1.3214 0.7134 0.3014 0.5055 0.2940 0.4570 0.2940 0.2940 0.2940 0.2940 0.2940 0.2940 0.5622 0.8464 0.2940 0.4966 0.4172 0.2940 1.7158 0.2940 0.2940 0.4331 0.7386 0.2940 0.5051 1.1350 0.7869 1.1029 3.6607 2.6575 3.4932 4.4161 2.5499 7.0864 2.4816 2.5748 3.1744 3.4681 4.7273 0.4579 0.5521 0.7150 0.5859 0.5754 0.7934 1.3575 1.5936 3.4233 2.3225 4.0206 2.9274 0.9860 0.2940 0.5400 0.6839 0.6187 1.0327 0.8013 0.4843 0.5253 1.3692 0.8625 0.2940 0.2940 0.4626 0.3542 0.4515 0.8207 0.2940 0.6508 0.3393 0.7470 0.7483 0.4414 1.3332 1.3666 1.3687 0.8292 1.1610 1.1753 1.2188 0.9909 1.0887 0.4179 0.5598 0.4638 0.5686 0.2940 0.2940 0.7328 1.0313 0.2940 0.2940 0.9275 0.7669 0.6449 0.9699 0.4424 0.5867 0.6642 0.9090 0.6477 0.3877 0.2940 0.2940 0.2940 1.1363 0.6910 0.9020 1.0466 1.1191 1.0205 1.1067 1.6756 0.5390 1.5082 0.7087 1.0670 3.1764 3.5798 5.0150 4.4099 2.9765 4.9446 0.9109 1.0764 0.8038 0.7397 0.8844 1.0378 1.3102 2.7078 1.0357 1.7991 1.8744 1.2335 1.7854 1.4810 2.1398 1.3160 0.8495 0.2940 0.4560 0.6197 0.2940 0.5744 sulfate of piperine metabolite C18H21NO3 (3)* 3.0428 2.8816 2.0486 2.8878 2.8034 2.4250 0.7594 0.7231 0.4074 0.3953 0.8450 0.3855 0.3855 0.3855 0.5768 0.3855 0.3855 0.9567 0.3855 0.8450 0.3855 0.5747 0.6318 0.3855 0.3855 0.6191 0.3855 0.3855 0.3855 0.6314 0.3855 0.5734 0.7478 1.3489 0.3855 1.0791 1.7073 1.2031 1.1851 1.1549 0.8950 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.7962 0.3855 0.3855 0.3855 0.3855 0.7946 0.7563 1.4711 1.1099 1.1616 2.4788 3.2478 2.5878 3.0098 5.0546 3.3835 3.0672 3.2385 2.9859 2.9803 3.0191 0.4453 0.5996 0.6248 0.5709 0.7745 0.8049 1.3828 1.2815 1.9816 1.1547 1.4223 1.5844 1.0034 0.3855 0.8532 0.6939 0.3855 0.7761 0.3855 0.3855 0.4377 1.0000 0.3855 0.6149 0.3855 0.3855 0.7440 0.4751 0.6389 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.8801 1.2077 0.8624 0.7215 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 0.9442 0.3855 0.3855 0.6739 0.9321 0.5700 1.0718 0.5960 0.6234 0.8266 0.5271 0.3855 0.3855 0.3855 0.3855 0.3855 0.4297 0.3855 0.3855 0.3855 0.4885 0.3855 0.9438 1.3823 0.8562 1.5238 0.9325 1.1015 2.4332 3.3545 3.1658 2.7317 2.4591 2.8763 0.3855 0.3855 0.3855 0.3855 0.3855 0.9158 0.8619 1.6798 0.9260 1.1940 1.5626 1.0919 1.0679 1.3867 1.2189 1.1786 0.3855 0.3855 0.3855 0.3855 0.3855 0.3855 sulfate* 1.0071 0.9096 1.0262 0.8115 0.9026 1.0024 0.9575 1.0051 1.2143 0.8662 0.9538 0.9425 0.9465 0.9203 0.8583 0.9491 0.9530 0.7974 1.0410 0.8379 0.8114 0.8960 0.8785 0.6854 0.6967 0.7208 0.8187 0.8427 0.8250 1.0137 1.5957 1.0522 0.9295 0.9424 0.8599 0.9946 0.9907 0.9845 0.9883 0.7716 1.0111 1.0104 1.0235 1.0480 1.0301 1.0600 0.9580 0.8654 1.2571 0.7481 0.9337 0.8802 0.8155 1.1716 0.9990 1.1850 1.2133 1.4469 0.9258 0.9852 1.0771 1.0881 0.9961 0.9493 0.9855 1.0302 0.9982 1.0091 0.9006 0.8763 0.9858 0.8493 0.9427 1.0366 0.9230 1.1638 1.1894 0.9239 1.1404 1.1854 0.9974 1.3605 1.1466 1.0201 1.2341 1.1152 1.0147 0.9552 0.9824 0.9818 0.9601 1.0316 1.0229 0.9337 0.8815 1.1073 0.9763 1.0810 1.0761 1.0903 1.1080 1.1131 1.1570 1.0221 0.9594 0.9394 1.0194 1.2096 0.9892 1.0861 1.3424 1.4990 1.0346 0.8878 1.0518 0.9146 0.8401 0.9754 0.8731 1.0683 1.1458 0.9882 0.8637 1.0568 0.8327 1.1034 1.1227 1.0801 1.0010 0.9116 0.9615 0.9097 0.9713 0.9386 0.8531 0.9151 1.1268 1.0876 1.0637 0.8861 1.1931 0.8275 0.8965 0.8114 0.8036 0.9008 0.8519 1.0716 1.0285 1.1454 1.2265 1.0000 1.2117 0.9740 1.0692 1.0323 1.0479 0.9357 1.0253 1.0635 1.0575 1.1585 1.0306 1.1002 1.1276 0.9886 0.8376 1.4980 1.2072 1.2188 0.9750 1.4343 1.4365 1.2352 1.0112 1.4326 0.8809 1.3189 0.9361 1.0352 0.9375 1.1364 1.2729 1.2992 1.2005 1.0050 0.9458 tartronate (hydroxymalonate) 1.0199 0.9966 0.6843 0.8951 1.0314 1.0745 0.7603 0.8398 0.6331 0.9641 1.0059 0.4230 0.2765 0.2757 0.8031 0.4126 0.4674 0.9811 1.8892 1.2509 1.0666 1.0574 1.2799 0.5884 0.8280 0.6248 0.6049 0.9627 0.9318 1.0857 0.8023 1.1943 0.7736 1.1272 0.8535 0.5424 0.7699 0.7883 0.9384 0.2247 0.8548 1.4034 1.0071 1.0133 1.5037 1.1722 1.1896 1.0335 0.9920 1.0023 1.0881 1.1320 1.2495 0.7993 0.8882 0.8979 0.8673 0.5734 0.8599 0.9663 1.0285 1.1755 1.2161 1.0888 1.3780 1.2889 1.3885 1.1929 1.2371 0.6065 0.7365 0.4776 0.8988 0.6096 0.6868 1.7000 1.7246 0.7172 1.2125 1.4216 1.0106 0.5731 1.0238 1.0932 0.8302 0.7094 1.1252 0.9248 0.9527 1.0764 0.9912 0.9463 1.1754 1.0143 0.9867 1.2535 1.3548 1.0008 1.1955 1.5811 1.1387 1.4584 1.1685 1.2988 1.4339 1.2281 1.1281 1.1799 1.1656 1.2720 1.2189 1.1514 1.7390 0.8498 1.3684 2.0789 1.6993 1.5768 1.7271 0.6833 1.1381 0.9341 0.3277 0.6278 0.2347 0.3597 0.2695 0.3263 0.3830 1.4467 1.0435 0.8752 0.8386 1.0073 1.1013 0.1971 0.1559 0.1548 0.3462 0.4368 0.1721 1.3405 1.3667 1.4119 1.2518 1.6200 1.5565 0.4219 0.4686 0.3058 0.4459 0.4560 0.5478 1.0474 0.8776 1.0849 0.9174 0.9686 0.9992 1.1259 1.4040 1.2252 1.2020 1.3048 1.3620 0.7551 0.7313 0.7415 0.9912 0.8024 1.1521 0.6275 0.8793 1.4213 1.1152 1.3019 1.0318 1.0884 1.0370 1.1825 0.9284 0.3439 1.0000 0.5084 0.6451 0.5943 0.6363 taurochenodeoxycholate 1.5524 1.2140 0.1462 1.1994 0.8024 0.9498 0.9972 0.8799 0.1462 0.4607 4.7175 0.2529 0.5543 1.0028 0.2093 0.8238 0.5392 1.2090 0.2425 1.7671 1.7019 4.9993 1.1901 0.8068 2.2935 1.9253 0.5373 1.1646 2.9316 0.8781 2.5521 0.9552 0.5072 1.0471 1.6494 3.2579 3.9604 2.5961 2.6205 1.8677 5.9082 0.2882 0.1602 0.1462 0.3895 2.7165 0.4717 0.3114 0.1462 1.9976 2.9128 1.2004 1.0225 2.2674 0.7080 1.7583 1.1815 3.8957 0.3746 1.1036 0.7005 1.1953 0.4006 0.1874 0.1845 0.6547 0.3596 0.1574 0.1462 0.1462 0.3653 0.2423 0.8918 0.5503 1.6208 2.9857 3.0247 1.8678 2.0392 0.8960 1.0425 1.1394 2.0286 0.7795 0.4595 1.1671 0.9170 0.8700 2.2669 0.3355 0.4762 0.9381 0.3002 0.3329 0.6848 0.4773 0.4387 3.4049 1.0528 0.9352 2.3166 3.5979 3.5263 0.4304 0.9519 1.4920 7.2121 0.1462 7.2184 1.0326 1.6725 0.1462 0.5924 0.7416 0.4082 0.4903 0.2885 0.3828 0.1462 0.8402 0.5252 0.4931 1.2742 0.8910 0.2520 0.3797 0.1819 0.4210 1.5443 0.2870 1.0586 9.1420 0.1837 0.7649 0.8373 0.8777 0.5773 1.1992 1.6197 1.0677 1.0871 1.4468 1.9526 4.3068 0.5157 1.4974 0.9001 0.2857 0.3956 0.1462 0.8216 0.3949 1.0905 1.7150 2.0828 0.8262 3.2045 2.1373 2.0177 0.9578 2.9240 2.0405 0.6139 1.0000 2.5582 2.1100 2.0627 2.9224 6.7004 1.6090 3.0435 1.0963 2.9680 1.6547 0.6810 2.6495 0.3368 0.1462 0.7856 0.3923 0.5647 0.6117 2.0104 0.2478 1.2140 0.8471 1.3771 taurocholate 0.7038 0.7284 0.2530 0.8133 0.6044 0.8197 1.6909 0.8581 0.2530 0.5736 8.6941 0.2530 0.2530 0.7372 0.2530 0.3153 0.3541 1.2222 0.2530 3.8615 2.7203 8.3679 0.8505 0.4975 3.1084 0.8150 0.2530 0.8347 2.1047 0.3674 2.5108 0.5158 0.2530 0.2530 1.4789 2.0800 2.2394 1.3822 2.2895 0.6766 3.4003 0.2530 0.2530 0.2530 0.2530 2.6015 0.2530 0.7877 0.2530 1.0142 2.4415 1.0399 0.6042 7.2080 0.4094 1.6714 1.2492 9.3468 0.8652 1.0453 0.6014 0.7635 0.4001 0.2530 0.2530 0.2895 0.2685 0.2530 0.2530 0.2530 0.2978 0.2530 0.2530 0.2530 0.9709 2.5475 2.7386 1.8124 1.9638 0.8822 0.8991 2.2109 1.2391 0.7086 0.2530 0.7315 0.9516 0.6269 2.7055 0.6738 0.7042 1.0000 0.2530 0.2530 0.3706 0.2530 0.4624 1.8507 0.4847 0.4854 1.0403 1.3120 1.4005 0.2530 0.5374 1.5399 3.0607 0.2530 4.7445 0.7398 1.0434 0.2530 0.5222 0.7958 0.6868 0.2530 0.2530 0.3909 0.2530 0.3276 0.2530 0.2530 0.2530 0.2530 0.2530 0.2530 0.2530 0.2530 0.6089 0.2530 0.4399 7.7249 0.2530 0.4627 0.7216 0.8316 0.6035 1.1068 1.0886 0.4797 1.1083 1.3231 2.1183 3.3411 0.9858 1.4289 0.9734 0.2530 0.2530 0.2530 0.3417 0.2530 0.5430 1.1642 1.4898 0.5367 2.6203 1.5739 0.8907 0.4093 1.9352 1.8494 0.2530 0.5943 1.8971 2.3534 2.5033 2.4949 7.0197 1.0046 2.9442 1.2989 5.5445 1.5295 0.2530 3.9721 0.4410 0.2530 1.1370 0.5251 0.6436 0.2530 1.7340 0.2530 0.5962 0.2530 1.3130 taurocholenate sulfate* 1.0523 1.0065 1.4394 0.6983 0.7889 1.3510 0.9924 0.8898 1.6474 0.8798 1.4097 0.4707 0.3661 0.3374 0.2791 0.2062 0.3285 0.6623 1.2291 1.6715 0.6497 1.2185 0.6509 1.0397 0.7188 0.9678 0.9775 0.9505 0.8544 0.7732 1.9009 0.9548 0.4728 0.7423 0.7471 2.6057 1.3043 1.7016 1.9816 1.5502 1.2196 0.3089 0.2708 0.2739 0.4291 0.3662 0.4581 0.7653 1.6448 1.6049 1.0965 0.9034 0.6056 2.2083 2.6400 3.6783 2.2631 3.0321 2.1725 0.9641 0.8986 0.6498 0.6943 0.4566 0.6152 0.7569 0.7595 1.1280 0.8079 0.8021 1.0020 0.8533 0.8361 0.7533 0.7184 1.1975 1.0445 0.9400 0.9460 0.8518 1.1692 2.9317 2.1976 0.7538 1.0104 1.0809 1.4563 0.8579 0.9518 0.7534 0.6388 0.8617 0.7681 0.9942 1.2529 1.0377 2.1098 0.8607 0.6490 0.8141 0.7834 1.0195 0.9107 1.2889 1.2865 0.6684 1.5708 1.3138 0.5783 0.8050 1.1073 1.8151 0.6990 0.4683 0.3261 0.8860 0.6678 1.2151 1.0000 0.5925 0.9069 0.4577 0.8754 0.8448 1.5638 1.0058 1.7114 1.3970 1.8077 1.1010 1.7947 1.5587 2.2128 1.3792 1.0898 0.6553 1.4501 0.6149 0.7184 0.6805 1.0745 0.8115 0.6409 0.8459 0.6695 0.9529 0.5535 1.3322 1.1283 2.0991 1.5964 1.4078 1.4093 2.2290 1.8360 1.6223 1.3207 2.7651 2.1084 1.9516 2.6801 1.8475 1.8712 1.0879 1.9372 0.9820 0.9061 4.5209 2.6376 0.9478 0.6703 1.7060 0.9127 0.8472 0.9420 1.1772 2.7174 2.8946 3.1400 1.2565 3.0173 1.0822 1.3656 1.8451 1.5802 1.2926 1.5586 taurodeoxycholate 2.4032 1.9194 0.1020 1.7636 1.5386 1.9501 2.0071 1.4074 0.1020 0.7119 8.4753 0.3181 1.3821 1.4511 0.3407 1.0945 0.8411 0.7422 0.1765 1.3578 1.0043 3.6240 0.7447 0.6605 3.2827 1.5467 0.3230 1.1175 2.3583 0.4913 1.4121 0.6300 0.2781 0.6583 1.2243 1.9823 2.4343 1.6756 1.8740 1.2665 3.8248 0.3629 0.1300 0.2322 0.4260 4.9209 0.4479 0.1020 0.1020 1.0000 1.8288 0.4543 0.4934 2.1401 0.3286 0.9852 0.7649 2.2739 0.1020 1.1075 0.6588 1.3596 0.4051 0.1562 0.2065 0.7889 0.3189 0.1420 0.1020 0.1020 0.2191 0.1687 0.3412 0.2507 1.1786 5.0946 5.3151 3.4044 2.6754 1.3591 0.5573 0.4170 1.2736 0.4149 0.2851 0.4389 1.2375 0.9957 3.1913 0.2691 0.6258 1.1290 0.1200 0.2606 0.3820 0.2607 0.1660 5.1712 1.1782 1.3138 2.8678 4.4992 3.9281 0.4213 0.8854 1.2211 7.0508 0.1020 4.0564 1.6248 2.9039 0.1020 1.1952 1.2802 0.7769 0.2827 0.1020 0.2602 0.1020 0.2178 0.1116 0.1591 0.3822 0.3262 0.1020 0.2172 0.1020 0.2058 0.8425 0.3091 0.7788 9.5712 0.1669 0.9197 0.8382 1.0062 0.6388 1.3119 2.0506 1.7471 1.2580 0.6624 0.9989 1.9634 0.1020 0.5201 0.4257 0.1020 0.1960 0.1020 0.2238 0.2076 0.4258 2.7544 2.6359 1.3587 5.2601 3.0444 2.1497 2.0154 5.1227 5.5058 1.2905 2.6596 4.8489 2.1057 1.8908 3.7579 8.3143 2.1194 2.9431 0.9612 2.4389 1.4426 0.7235 2.4599 0.2735 0.1020 0.6832 0.2934 0.4489 0.1757 1.5847 0.1247 0.5833 0.3411 1.0330 taurolithocholate 3-sulfate 2.0813 1.1763 1.1041 0.9420 1.7845 2.7888 1.5426 0.6990 0.9421 0.7979 2.1535 0.1118 0.2743 0.3450 0.3127 0.3703 0.2422 0.2123 0.7438 1.3069 0.3144 1.4129 0.2847 0.4908 0.5774 0.2554 0.1948 0.7848 0.4225 0.5873 1.0749 0.9689 0.2831 0.4778 0.7715 4.1304 1.3447 1.9382 2.4252 1.5651 1.0963 0.3740 0.3313 0.6974 0.5974 1.7068 0.5717 1.0130 0.8242 2.4354 1.8221 1.4425 0.4756 2.1898 1.3520 3.5354 1.4433 0.8484 1.1375 3.1556 1.6618 0.8736 1.1107 0.6817 0.1854 0.6848 0.5903 0.5928 0.3876 0.3061 0.7420 0.7863 0.2681 0.4688 0.4540 2.0759 2.5842 1.9585 2.0168 1.2550 1.5323 2.1182 3.3615 0.8349 1.7381 1.9204 0.9062 0.5299 2.3721 0.2374 0.7311 1.0311 0.2947 0.6021 1.2929 0.8145 1.3434 0.8178 0.5795 0.2707 0.2700 0.4014 0.4603 1.0284 2.9413 1.4377 1.8943 0.6160 0.5401 2.0228 0.5756 1.3044 2.0269 0.4656 0.8840 0.5799 0.4502 2.3621 1.1261 1.1712 1.3651 0.4256 1.0581 0.8132 1.9117 0.9570 0.6291 1.6301 3.9054 1.0943 1.1408 2.5044 1.2880 1.7451 1.5897 1.1892 0.9521 0.7542 0.9704 1.0000 1.1717 1.8347 3.0451 1.1196 0.4763 1.7928 1.3023 0.3431 0.4216 0.1493 0.1945 0.3594 0.2380 1.3013 1.9466 1.2680 3.6894 4.0161 1.4019 1.5417 3.2210 3.9432 1.4074 2.2121 2.1297 0.5764 0.6364 5.6195 2.5136 1.1584 0.4784 0.8222 0.8791 0.8901 0.4656 1.0091 1.9910 0.8649 2.4726 0.7682 2.4365 0.5077 2.9101 0.7367 1.3585 0.8357 2.9169 tetradecadienedioate (C14:2-DC)* 1.0861 0.6900 0.2391 0.7854 0.7873 0.2833 0.2391 0.2391 0.2391 0.2391 0.2391 0.4586 0.2391 0.2391 0.2391 0.2391 0.2391 0.2391 0.2391 0.8838 0.2391 0.2391 0.2391 0.7053 0.4642 0.2391 0.2391 1.7616 0.2391 0.2391 0.2391 0.9699 0.2391 0.2391 0.2391 2.3671 1.0365 1.1284 1.2611 0.9412 0.9253 0.6565 0.6232 0.9174 0.9350 0.6821 1.3803 0.2391 0.3055 1.9973 1.4279 0.9952 1.0039 0.6551 1.5196 1.5550 0.9275 0.2391 0.2391 0.2391 0.2391 0.8316 0.2391 0.2391 0.2391 0.2391 0.2391 0.2391 0.2391 1.3634 1.9055 1.1361 1.9309 2.0463 1.3890 1.5007 1.0052 2.2532 2.0122 0.9990 2.0418 0.2391 0.4715 0.7560 1.2081 1.4693 1.0373 0.2391 0.3781 1.0359 0.8993 0.2391 0.2391 0.8109 0.6515 0.2391 0.2391 0.9163 0.9095 0.7118 2.7207 0.2391 1.2472 0.7379 0.9458 0.7265 0.9408 0.2391 0.5845 1.1598 0.2391 0.4387 1.0372 1.4479 1.8994 0.5914 0.8583 0.7161 1.1769 1.9650 1.2812 1.5490 1.5113 1.4308 1.0000 0.2391 0.2391 0.2391 1.1054 0.2391 0.2391 0.2391 0.2391 0.2391 1.0728 0.4903 0.3260 0.2391 1.0174 0.6353 0.5224 0.9316 0.6505 0.5003 0.3941 1.1017 0.9225 1.2037 1.4463 1.4828 2.2835 2.6161 2.6173 0.2391 0.2391 0.2391 0.2391 1.0848 0.2391 0.6806 2.4587 0.2391 0.9567 0.8638 0.2391 1.5576 2.2581 0.2391 0.8613 0.2391 1.4751 0.6075 0.8831 2.2421 1.0010 1.4470 0.3396 0.2391 0.3021 0.2391 0.6506 0.9929 5.1750 0.8729 1.9488 2.4951 2.1191 tetradecadienoate (14:2)* 2.2059 1.0256 0.1874 1.3770 0.8638 0.4271 1.2728 0.9387 0.2292 0.5470 0.4933 2.4162 1.6019 1.3226 2.1383 1.4142 2.9193 0.8940 0.2159 0.9097 0.4078 1.0867 0.8669 1.2151 1.1145 0.5949 0.4238 1.3283 1.8671 0.7710 0.6676 1.0483 1.0912 0.8189 0.8830 2.6459 1.1777 1.7754 1.4383 1.3190 1.3231 0.4785 0.4757 0.4185 0.5381 0.5758 1.0000 0.6682 0.3662 0.8305 1.0927 1.2344 0.9897 1.5076 2.2271 1.9508 2.1497 0.3415 0.3142 0.9947 1.1998 1.5563 0.8101 1.3773 0.6472 0.6608 0.7202 1.0198 0.5381 0.8017 1.1773 0.5584 1.5629 1.3432 0.9703 0.9211 0.7419 1.3239 1.5141 0.5862 1.3838 0.1465 0.5007 1.2430 1.5337 1.1189 1.0053 0.7857 0.7768 1.4460 1.0142 1.7774 0.7219 1.0378 0.9829 1.1710 1.1596 1.4878 0.9532 0.8689 1.9947 0.7164 1.7081 1.3863 1.0981 1.1961 1.7766 0.3500 0.8862 1.0186 0.4407 0.2763 0.6296 0.5673 0.7694 1.6611 1.6722 1.2006 1.9332 1.0311 0.9167 1.4867 1.1936 1.5986 1.2513 0.9034 0.1989 0.9496 1.0988 1.2601 2.0156 1.2760 0.6622 1.5020 1.9558 1.0714 0.6551 1.1172 1.5841 2.0167 1.8549 0.9013 1.1921 0.8220 0.3997 1.8772 1.0551 0.6097 0.9058 0.6867 2.2935 1.1395 1.3180 0.8279 0.7646 1.0186 0.6681 1.4368 1.2683 1.1083 2.8124 0.6347 1.4521 0.7978 0.9360 0.6979 0.7925 0.2570 0.9585 0.4468 0.9495 0.2260 0.9059 1.6838 0.9455 2.1426 0.7910 0.0926 0.5794 0.6256 0.9340 0.8039 1.5653 0.4941 1.3824 0.9817 0.7315 tetradecanedioate (C14) 1.1038 0.8812 0.4900 0.8180 1.0202 0.8588 1.0577 0.9034 0.7774 0.8908 1.0419 1.4498 0.7696 0.8069 0.7222 0.7369 0.8752 0.7885 0.5296 1.7719 0.6100 1.0369 0.7037 1.2779 0.9924 1.2475 0.8522 1.4813 1.4880 0.7972 0.8375 0.8852 0.6381 0.7881 0.7993 1.9592 0.8327 0.9603 0.9001 0.7247 0.8326 0.8360 0.9192 0.9662 1.0359 1.2417 1.4472 0.7020 0.5475 2.3384 1.3076 0.9780 0.7064 0.7159 1.0458 1.7583 0.8265 0.6643 0.7763 1.1668 0.9969 1.2941 0.9180 0.8527 0.7193 0.7573 0.6206 1.0093 0.7134 0.7714 0.9876 0.9070 1.0562 0.8696 0.8408 1.2093 1.0618 1.8485 1.5669 1.0024 1.1429 0.6554 0.7028 0.6780 1.1196 1.2340 0.6161 0.5887 0.5958 0.6876 0.6877 0.6364 0.7986 1.0789 0.9749 1.0031 0.9407 1.3401 0.9586 0.9866 1.7228 1.0955 1.3008 1.2969 1.3290 0.6953 1.2467 0.6071 0.6939 1.3887 0.8661 0.9457 1.3998 0.9113 1.0761 0.9191 1.1854 1.8105 1.8311 1.1970 1.0534 1.1779 1.1102 1.0702 1.1313 0.9530 0.5869 0.8317 1.4657 0.8446 1.1352 1.3297 0.6031 0.9677 1.0511 0.8808 0.5729 0.7093 1.0000 0.9601 0.7187 0.8599 1.0642 0.6173 0.5812 1.3000 1.1383 2.4605 2.7712 2.2568 3.9303 2.8902 4.2359 1.0279 0.9443 1.0910 0.8587 1.7144 1.1406 1.1499 2.0823 1.0117 1.1406 1.0179 1.1985 1.4432 1.5220 1.1536 1.3136 1.1540 1.5037 1.2435 1.5426 2.0282 1.7002 1.6904 0.6323 0.4573 0.6295 0.5491 1.1163 1.3268 3.4956 1.1091 1.9763 2.5660 2.2200 theophylline 1.5251 1.6534 1.1827 0.6539 1.3057 1.2691 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 1.6454 0.2036 0.2036 0.5383 0.2036 0.2036 0.6729 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.3502 0.2036 0.2575 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 3.0641 0.2036 0.2036 0.8853 1.0000 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.5641 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 2.0002 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2185 2.7937 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2403 0.2036 2.2232 0.2036 0.2036 1.0171 0.8741 0.2036 0.3768 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 1.0000 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.5625 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 2.8345 0.6050 3.5217 0.2036 12.7628 0.2036 0.2036 0.6569 0.7182 1.5949 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 0.2036 1.2910 0.2036 0.2036 0.2036 0.2036 0.2036 thymol sulfate 3.5172 6.7163 2.4407 0.8570 4.0569 1.2777 0.8684 4.2377 0.6359 0.0433 0.3363 0.5559 0.0377 4.1923 0.0259 0.1516 0.6984 0.8829 7.4180 4.7126 17.0042 2.2089 9.0582 5.7959 0.0444 0.6139 1.0338 0.1558 1.3753 8.2411 1.2033 1.7653 0.0666 0.5368 0.1600 0.5985 5.4105 0.8510 0.0479 0.2553 0.0628 6.2111 8.2701 4.7881 1.3260 5.4737 0.8628 6.8282 2.0985 1.4053 1.0266 2.4082 0.6571 5.6226 0.0259 0.2336 1.0110 0.7162 1.0198 0.0259 1.3668 0.0745 6.4246 0.0259 0.0259 0.0259 0.1017 0.0729 0.6881 0.2638 0.0318 0.1116 0.3922 0.0259 3.3252 0.0956 0.1998 1.2949 1.7644 6.4200 0.0339 0.2837 0.0259 0.0259 0.4729 2.8484 0.1711 0.2308 0.8787 1.5129 11.0429 2.1907 4.4088 0.0765 0.1663 0.4726 0.3066 7.6683 0.0259 0.0893 1.0000 0.4777 1.4028 0.4843 0.7197 1.2989 2.2192 0.8717 4.2554 1.4874 6.6227 1.2882 0.4922 0.0259 0.0949 3.5692 0.1791 1.3926 0.4268 7.0520 0.5742 0.2770 1.2558 1.6794 0.0259 3.4216 0.3806 0.5979 0.1591 0.1131 8.2802 0.6158 1.2268 1.6312 0.0554 0.4527 0.6481 8.1741 0.0915 0.0259 1.0000 0.3612 1.4714 10.5465 1.6943 2.5717 0.7658 0.5414 0.1556 0.8673 1.1477 0.0925 5.0906 0.2506 12.8053 0.6523 2.1684 3.1822 4.6365 0.0772 1.0000 0.4370 1.2618 0.1415 7.4406 0.3065 0.1659 1.1392 1.6928 7.9387 0.4007 4.7557 13.3585 1.1436 3.0425 6.0650 0.0259 0.2831 0.0619 3.6024 0.1152 11.6550 0.2146 3.5486 4.6755 0.5894 1.6491 thyroxine 1.0886 0.8616 0.9477 1.1546 1.0691 0.9534 0.9171 0.8456 0.8826 1.0832 0.8823 0.9576 0.9523 0.7867 0.9277 0.9006 0.8307 0.7643 0.7437 0.7989 0.6918 0.8837 0.8286 0.8758 0.8540 0.8372 0.9132 0.9239 1.0774 1.0083 1.0320 1.0657 1.2105 1.1252 1.1453 1.3214 1.3049 1.3143 1.2183 1.3015 1.0531 1.2448 1.0433 1.1500 1.2012 1.1710 1.1864 0.8903 1.0468 1.0546 1.1705 0.9943 0.9646 0.7378 0.8695 0.7697 0.7657 0.7785 0.8874 0.9450 0.9195 1.0431 0.8657 1.0957 0.8921 0.9253 0.9325 1.0048 0.8420 0.9071 1.0309 0.7820 0.9769 1.1681 1.0344 0.7137 0.7220 0.7538 0.7094 0.7815 1.1827 1.2087 1.2387 1.3988 1.4711 1.1753 1.0498 1.0211 1.1789 1.0480 0.8769 1.0067 0.8184 0.8718 0.9004 0.8862 0.9282 1.0499 0.9735 0.9558 0.9387 1.0128 1.0365 0.8874 0.7179 0.6825 0.9914 0.6988 0.8223 1.0088 0.9112 1.1191 0.9884 1.0710 1.1682 1.4916 1.1375 0.8839 1.0342 0.7870 0.9224 1.0412 0.9156 0.8958 1.2803 1.0120 1.0930 1.1093 1.1200 1.0670 1.0264 1.0700 1.0179 0.8830 1.0130 0.9154 0.8983 0.9208 1.1948 0.9889 1.0262 1.5002 1.3759 1.1156 1.2202 1.1121 1.3207 0.8963 0.9315 0.9331 1.0481 0.9822 0.9378 1.2341 1.0406 1.2022 1.1590 1.1343 1.3586 1.0480 1.0162 0.9579 0.9898 0.9713 1.5270 1.1511 1.3251 1.3416 1.2007 0.9952 1.0068 0.9629 0.9382 1.0683 0.9922 1.0254 0.9906 1.2250 1.1310 1.0151 1.1210 0.7469 1.0000 0.8288 0.8943 0.8872 0.7632 trans-2-hexenoylglycine 0.7814 0.3641 0.3641 1.1888 0.7851 0.3641 0.3641 0.3641 0.3641 0.3641 0.3641 1.9608 0.3641 0.3641 0.3641 0.6805 0.8787 0.3641 0.3641 1.1434 0.3641 0.7904 0.3641 0.8497 0.3641 1.2088 0.3641 1.6177 1.1783 0.3641 0.3641 0.3641 0.7391 0.3641 0.3641 1.3405 0.3641 0.9151 1.0649 0.3641 0.4407 0.8331 0.9265 0.6331 1.0309 1.1068 3.1866 0.9797 0.8415 0.9175 1.5287 2.1812 1.8562 0.3641 0.9234 0.7220 0.3641 0.3641 0.3641 0.3641 0.3641 0.3641 0.3641 0.3641 0.3641 0.3641 0.5697 0.8240 0.3641 2.0395 3.1464 2.2838 2.8011 4.6021 1.2346 0.9919 0.3641 2.9224 1.6357 0.3641 0.8420 0.3641 0.3641 0.9395 0.6024 0.7026 0.3641 0.3641 0.3641 0.7243 0.3641 0.3641 0.3641 0.3641 0.3641 0.3641 0.3641 0.7877 1.0587 0.3641 1.8708 1.0827 1.0914 0.6938 0.7919 0.9311 1.0000 0.3641 0.3641 0.3641 0.3641 0.3641 0.3641 0.8561 0.7862 1.1381 1.7660 1.6475 1.9084 3.9999 3.9703 5.0598 5.0713 3.7469 0.8992 0.3641 0.3641 0.3641 0.3641 0.8305 1.2960 1.2160 0.3641 0.7274 1.2424 0.3641 0.3641 0.3641 0.9943 0.8294 0.3641 0.3641 0.6483 0.3641 0.3641 0.3641 0.3641 0.9214 1.1715 0.4633 1.9674 1.3562 1.3815 0.3641 0.3641 0.3641 0.3641 0.6882 0.3641 0.3641 0.9192 0.3641 0.3641 0.3641 0.3641 0.6590 0.9413 0.3641 0.3641 0.3641 1.6262 0.3641 0.3641 2.5190 0.9984 0.3641 1.1030 0.3641 0.6784 0.7864 0.6969 0.5645 2.2131 0.3641 1.2591 1.6202 1.0475 tridecenedioate (C13:1-DC)* 0.7773 0.6945 0.4586 0.7203 0.7593 0.4567 0.6405 0.5108 0.4445 0.7270 0.6702 2.0861 0.9758 1.0900 1.0388 0.8740 1.1659 0.6612 0.4340 1.1400 0.4349 0.9448 0.6778 1.4738 1.2572 1.0515 0.9620 1.9983 1.6705 0.8537 0.8114 1.0206 1.0540 0.7214 1.1621 1.4011 0.6683 0.9619 0.7800 0.5140 0.5432 1.0414 1.3482 1.2531 1.6010 1.2200 1.9310 0.6554 0.5306 1.5028 1.5015 0.9657 0.8276 0.5853 0.6419 0.9465 0.6043 0.3033 0.7583 0.9529 0.8930 0.8912 0.7428 0.7818 0.7132 0.7727 0.7077 1.2937 0.7114 0.6586 0.8844 0.7434 0.9274 0.8908 0.7722 0.9689 0.8837 1.6105 1.2261 0.9126 1.3299 0.4181 0.4818 0.7366 1.0491 1.0749 0.9446 0.7629 0.6685 1.3569 0.9923 1.1491 0.8544 1.2846 1.0588 1.0565 1.2063 1.0291 0.9088 0.9449 1.7580 1.0077 1.1708 1.1824 1.2842 0.9276 1.2491 0.6933 0.6423 1.1506 0.6612 1.0768 1.2363 1.4392 1.5595 0.7338 0.8130 0.8725 0.9062 1.1920 1.1827 1.6031 1.4763 1.5106 1.0391 0.7134 0.3837 0.7068 1.0720 0.8096 1.4769 1.0665 0.6485 1.2319 1.1208 0.6274 0.6431 0.6182 1.0202 0.9121 0.7678 1.1438 1.0000 0.7727 0.9617 1.7215 1.3857 1.2226 1.6678 2.0566 2.1819 1.8505 2.0224 1.0751 0.9680 1.0465 0.7772 1.8660 1.3787 0.9068 2.0323 0.8247 1.0863 0.8822 1.0472 1.3945 1.2356 1.0870 1.1040 0.8451 1.5950 1.0835 1.1130 2.3593 1.5188 1.7366 1.2182 0.6452 1.1734 0.9936 1.3176 1.3285 3.2663 1.2366 2.0153 2.0648 1.5322 undecanedioate (C11-DC) 0.5777 0.9538 0.5752 0.6383 0.8736 1.2359 0.7737 0.8590 1.1025 1.1452 1.2836 1.1451 0.5752 0.5752 0.5752 1.0480 0.7597 0.6039 0.5752 1.1363 1.1217 0.5752 1.0679 1.0246 0.5752 1.2578 0.5752 0.9839 0.8985 0.5752 0.5752 0.9213 0.5752 0.6776 0.5752 1.5532 0.6549 1.0694 1.3549 0.5752 0.7286 0.8622 1.3001 1.0630 0.9069 1.1775 0.8720 0.7159 0.5752 1.0848 0.5752 0.9863 0.5752 1.1047 0.5752 1.1768 0.5752 0.5752 0.8553 1.3531 1.0170 0.5752 0.5752 0.5752 0.5752 0.8672 0.5752 0.9891 0.5752 0.5752 0.5752 0.8756 0.5752 1.4202 0.7534 0.8726 1.1086 0.5752 0.6965 0.7509 0.5752 0.5752 1.0137 0.5752 0.5752 0.9206 1.1898 0.5752 1.3237 0.5752 0.5752 0.9141 0.7959 0.5752 0.7421 0.7796 0.5752 0.9920 0.5752 0.5752 0.8246 1.3873 0.6926 0.9747 1.7816 0.5752 0.5752 0.5752 0.7524 1.0284 1.2596 0.5752 1.1146 1.2029 0.5752 0.8208 1.1108 0.5752 0.5752 0.6154 0.9641 1.1735 1.3991 1.1729 0.5752 0.5752 0.7984 0.5752 1.0080 0.5752 0.8403 1.0722 0.9916 0.5752 1.1502 0.5752 0.5752 0.5752 0.5752 1.0210 0.5752 0.9830 1.1903 0.9523 0.5752 0.8952 1.2633 1.0894 0.7398 0.5752 0.5858 0.9258 1.1763 0.5752 0.8037 1.5154 1.1222 1.0184 1.1151 1.2904 0.5752 0.5752 0.5752 0.5752 0.5752 0.9690 0.5752 0.5752 1.2092 0.7214 1.0235 0.5752 0.8444 1.3296 1.5271 0.5752 0.8289 0.5752 0.5752 0.5752 0.5752 0.5752 1.1273 0.5752 0.5752 1.2457 0.7188 urate 0.8954 0.9093 0.8362 0.6605 0.7761 0.8494 1.1155 1.1456 1.1467 0.8243 0.9777 1.2347 1.1765 1.0826 1.0764 1.2002 1.1354 0.7581 0.9818 0.9688 0.8822 0.8900 1.0120 0.7580 0.6447 0.6860 0.7541 0.7266 0.7704 1.4466 1.4949 1.5343 1.1161 1.3463 1.0967 1.2728 1.2702 1.3022 1.2311 1.2172 1.2145 1.5354 1.4501 1.4547 1.4748 1.5009 1.5017 0.9067 0.9346 0.8587 0.8758 0.9323 0.7383 1.1624 0.8938 1.0525 1.1654 1.0177 1.1662 1.0602 1.1953 0.9839 1.1345 0.9296 1.0172 1.0440 0.9845 0.9969 1.0031 1.1631 1.2616 1.2110 1.1509 1.2138 1.1780 0.7942 0.7482 0.7262 0.7600 0.7982 0.9145 0.9167 0.9269 0.7742 1.0272 1.0078 1.1606 1.0966 1.2347 1.1492 1.1166 1.1900 1.0993 0.8359 0.8950 1.1444 1.0852 1.0552 1.0892 1.1197 1.1213 1.1807 1.1538 0.9379 1.0000 1.0175 0.8794 0.9879 0.9868 1.1097 1.1599 1.1649 0.9990 0.7574 0.9395 0.7726 0.7120 0.7864 0.7522 0.9468 0.9178 0.7803 0.8157 0.9140 0.6369 1.0059 0.9237 1.0052 0.8308 0.8300 1.0658 0.8819 0.9875 0.9780 0.8593 0.8879 1.1066 1.0906 0.8989 0.7442 1.1465 0.7963 0.9818 1.0538 1.1075 1.1340 0.8939 1.0255 0.9107 1.2274 1.2587 0.9309 1.2339 0.8492 0.8789 0.8944 0.8829 0.9164 0.9637 1.1134 1.1772 1.1202 1.1819 1.0898 1.2103 0.6614 0.5427 0.8352 0.8861 0.8611 0.7199 1.1408 1.1911 0.9123 0.8828 1.3207 0.6838 0.9681 0.7570 0.9451 0.8300 1.2248 1.1503 1.1459 1.2492 1.0365 0.9530 uridine 0.9323 0.8576 0.6580 1.0140 0.9755 0.7164 1.0646 1.0346 0.5860 0.9949 0.9128 0.9950 0.7496 0.6930 0.8497 0.7837 0.8476 1.1744 0.7683 1.2077 1.0340 1.1947 1.1213 0.8145 0.9398 0.8873 0.5492 1.0941 0.8424 0.8588 0.5841 1.0441 1.0912 0.8166 1.1379 1.0000 1.1165 1.0913 0.9559 1.0547 1.0175 1.0373 0.9268 0.9521 1.0020 0.9531 1.0459 0.9312 0.6482 1.2113 1.2783 1.0883 1.2160 1.1728 1.3012 1.0933 1.2426 0.6315 0.6089 0.9790 0.9798 1.0766 1.0180 1.1191 0.9545 0.9229 0.9321 0.8842 0.9075 0.7744 1.0968 0.7373 0.9612 1.2988 0.9763 1.0352 0.9698 0.9643 1.0178 0.9795 1.3143 0.5473 0.7559 1.4077 1.0957 0.9454 0.9587 0.9856 0.9595 1.1233 0.9879 1.0673 1.2652 1.2453 1.3986 1.2775 1.0189 0.9633 0.9649 0.9419 1.0054 1.0045 1.0739 1.1491 1.0923 1.1991 1.2808 0.9149 1.1139 1.0440 1.1076 0.6841 1.0154 0.8974 1.1444 0.8663 1.0376 0.9654 1.0926 0.8442 0.8332 0.8474 0.8177 0.8620 1.0599 0.9590 0.6058 0.9740 1.0701 1.2204 1.0986 1.1859 0.7994 1.0764 1.3551 0.7673 0.6515 0.8539 1.0869 0.8631 0.9083 1.2493 1.1096 1.0353 0.8456 1.0469 1.2356 0.9221 1.0216 0.6754 1.0744 1.1106 1.0238 0.9654 0.8545 0.9857 0.9531 0.9192 1.0131 1.1543 1.0956 1.1167 1.1792 1.0362 1.2448 1.0585 1.0255 0.7881 0.9955 0.9008 0.9537 0.6437 1.0472 1.0744 0.9621 1.0003 1.0468 0.6582 0.9619 1.0647 0.8111 1.0716 1.1926 0.7031 1.0470 1.1603 0.8578 ursodeoxycholate 0.9672 0.9852 0.0614 0.0614 0.1873 0.4354 1.3737 1.4085 0.0614 1.3948 0.9700 1.7686 4.5972 2.1372 3.0441 4.1008 6.2744 0.2073 0.0614 0.4756 0.5918 0.3213 0.6065 6.8437 5.1582 3.6957 3.4412 3.4847 7.2483 9.4183 3.4964 5.3458 4.1864 3.5183 4.4547 1.2090 1.5102 0.9489 0.9602 1.4721 0.6719 1.5852 1.2130 1.5737 1.0002 2.0218 0.0614 0.0614 0.0614 0.0614 0.0614 0.0614 0.5035 0.5273 0.0614 0.0614 1.3578 0.0614 0.0614 1.3901 0.2154 0.6368 0.1714 0.0614 0.8146 0.8742 0.4487 0.0614 0.4361 0.1701 0.3047 0.4179 0.5449 0.3849 0.8268 1.5189 1.5718 0.7583 1.4808 0.6606 0.5868 0.0614 0.5664 0.4936 0.0614 1.0509 1.7776 0.8212 1.0000 0.3555 1.0888 0.8408 1.0932 1.6566 1.5864 0.8470 0.0614 4.2285 4.6789 3.8259 3.2124 5.6447 3.1526 1.1277 1.9190 1.5797 1.9235 0.4987 2.1227 0.0614 0.0869 0.0614 0.0614 0.0614 0.0614 0.6840 0.5378 0.0614 0.3787 0.0614 0.0614 0.7544 0.0614 0.0614 0.0614 0.5406 0.0614 0.5939 0.8173 0.0614 0.3995 0.0614 0.0614 0.1567 0.0614 0.6596 0.5236 0.5280 0.9391 0.9295 0.6397 0.2108 0.7537 0.1717 0.0614 0.0614 1.8291 4.6239 6.8555 1.6966 3.8201 3.6600 4.7940 1.1069 1.0182 1.8136 1.1123 0.2555 0.2689 0.6553 0.6593 0.5017 0.8569 1.9251 0.9926 0.0614 0.0614 0.0614 0.0614 0.0614 1.6502 1.4873 1.8833 0.5518 2.2545 2.6249 0.0614 0.0614 0.0614 0.3633 0.0614 0.4018 2.7295 0.2715 1.8807 0.2611 1.0000 vanillylmandelate (VMA) 1.8921 1.3793 1.7875 1.4042 1.0212 1.5527 0.8012 0.7980 1.0459 0.5999 0.8873 1.1140 0.8191 0.8852 0.9054 0.9992 1.0070 0.4608 0.5355 0.4608 0.4608 0.4608 0.4608 1.1791 1.0277 0.9707 1.2218 1.0300 1.1642 1.0643 1.1221 1.2786 0.9505 1.0628 0.8922 0.4608 0.7926 1.0074 0.8062 1.0416 0.6464 0.8176 1.0184 1.1177 0.9356 1.1413 0.9187 0.8839 0.8256 0.7676 0.8400 1.0632 0.5553 0.9891 0.7777 0.4608 1.1187 0.9519 0.7941 0.8309 0.9349 0.6411 0.6429 0.7462 0.6860 0.6489 0.4608 0.4608 0.4608 1.1594 0.9285 1.1840 1.4042 1.4626 1.2035 1.0409 1.0905 1.1831 1.3545 1.0234 0.4814 0.5975 0.6529 0.4977 0.6527 0.6823 0.4608 0.9520 0.9658 1.0929 1.1044 1.1529 0.6913 0.6001 0.4608 0.7121 0.8592 1.2323 1.2233 1.4290 1.1662 1.3575 1.1751 1.1948 1.0000 1.1073 1.1495 1.0566 1.2059 1.4580 1.4103 1.6399 1.1862 1.8258 1.2957 1.0114 0.9797 0.4608 0.8787 1.7715 1.7326 1.5618 1.9510 1.4926 0.7856 0.9724 1.0699 1.0077 0.7682 1.0409 0.8500 0.4608 0.8954 0.9177 0.9991 0.4608 0.4608 0.4608 0.6642 0.6866 0.9076 0.8869 0.7480 0.9762 0.9710 0.9655 0.9740 1.1601 0.9616 1.4379 1.6103 1.4060 1.2754 1.0366 0.7436 0.9473 0.9272 1.0009 1.3184 1.8035 1.1687 1.6815 1.7056 1.4036 1.5278 0.4924 0.7138 0.5896 0.9513 0.6516 0.9925 1.0946 1.1143 1.1578 0.8557 1.5501 0.9528 1.0076 1.0693 0.8898 0.8836 0.9138 0.8263 0.8711 1.1959 0.6517 0.5281 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name Retention Index MASS PUBCHEM KEGG (14 or 15)-methylpalmitate (a17:0 or i17:0) 5695 269.2487 17903417 (16 or 17)-methylstearate (a19:0 or i19:0) 5993 297.2799 3083779 (2 or 3)-decenoate (10:1n7 or n8) 4990 169.1234 1,2,3-benzenetriol sulfate (2) 1709 204.9812 1,5-anhydroglucitol (1,5-AG) 802 163.0612 64960 C07326 10-heptadecenoate (17:1n7) 5555 267.233 5312435 10-nonadecenoate (19:1n9) 5780 295.2643 5312513 10-undecenoate (11:1n1) 5085.8 183.1391 14891 C13910 11beta-hydroxyandrosterone glucuronide 4209 481.2443 12,13-DiHOME 5137 313.2384 10236635 C14829 13-HODE + 9-HODE 5275 295.2283 43013 16a-hydroxy DHEA 3-sulfate 4240 383.1534 16-hydroxypalmitate 5236.2 271.2279 10466 C18218 1-carboxyethylphenylalanine 2844 236.0928 1-carboxyethylvaline 2008 188.0928 1H-indole-7-acetic acid 2862 174.0561 1-linoleoyl-GPA (18:2)* 5483 433.2361 1-linoleoyl-GPG (18:2)* 5516 507.2728 1-palmitoyl-GPG (16:0)* 5570 483.2728 3300276 1-stearoyl-GPS (18:0)* 5800 524.2994 9547101 2,3-dihydroxy-2-methylbutyrate 787 133.0506 301941 2,3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)* 1156 177.0227 2,3-diphosphoglycerate 555 264.952 186004 C01159 2,6-dihydroxybenzoic acid 2575 153.0193 9338 21-hydroxypregnenolone disulfate 3935 245.0671 134595 2-acetamidophenol sulfate 2251 230.0129 181671 2-aminophenol sulfate 1677 188.0023 181670 2-hydroxy-3-methylvalerate 1800 131.0714 164623 2-hydroxyacetaminophen sulfate* 1674 246.0078 86290013 2-hydroxyarachidate* 5990 327.2905 5225199 2-hydroxybehenate 6384 355.3218 193484 2-hydroxydecanoate 4840 187.134 21488 2-hydroxynervonate* 6345 381.3374 5312783 2-hydroxyoctanoate 3736.8 159.1027 94180 2-hydroxypalmitate 5511.2 271.2279 92836 2-hydroxyphenylacetate 2164.6 151.0401 11970 C05852 2-hydroxyphytanate* 5751 327.2905 189026 2-hydroxystearate 5695 299.2592 69417 C03045 2-methoxyacetaminophen glucuronide* 1633 356.0987 14367271 2-methoxyacetaminophen sulfate* 1949 260.0234 86290014 2-naphthol sulfate 3658 223.0071 74428 3-(3-hydroxyphenyl)propionate 1980 165.0557 91 C11457 3-(4-hydroxyphenyl)lactate (HPLA) 1379 181.0506 9378 C03672 3-(methylthio)acetaminophen sulfate* 2265 276.0006 3-(N-acetyl-L-cystein-S-yl) acetaminophen 2094 311.0707 83967 3,4-methyleneheptanoate 3807 141.0921 3beta-hydroxy-5-cholestenoate 5398 415.3218 165511 C17333 3-bromo-5-chloro-2,6-dihydroxybenzoic acid* 4505 264.8909 3-carboxy-4-methyl-5-pentyl-2-furanpropionate (3-CMPFP) 4000 267.1238 194501 3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF) 2800 239.0925 123979 3-hydroxy-2-ethylpropionate 975 117.0557 188979 3-hydroxybutyroylglycine 889 160.0615 3-hydroxydecanoate 4634.7 187.134 26612 3-hydroxyhexanoate 1725 131.0714 151492 3-hydroxylaurate 5175 215.1653 94216 3-hydroxyoctanoate 3446 159.1027 26613 3-hydroxyoleate* 5508 297.2435 3-hydroxypyridine sulfate 1595.5 173.9867 3-indoleglyoxylic acid 2140 188.0353 73863 3-indoxyl sulfate 2222.2 212.0023 10258 3-methoxycatechol sulfate (1) 2163 218.9969 3-methyl-2-oxobutyrate 1465 115.0401 49 C00141 3-methyl-2-oxovalerate 2064.2 129.0557 47 C00671 3-methylxanthine 1700 165.0418 70639 C16357 3-phenylpropionate (hydrocinnamate) 2860 149.0608 107 C05629 4-acetamidobutanoate 894 144.0666 18189 C02946 4-acetamidophenylglucuronide 1400 326.0881 83944 4-acetaminophen sulfate 1792 230.0129 83939 C06804 4-allylcatechol sulfate 3571 229.0176 4-allylphenol sulfate 3805 213.0227 4-ethylcatechol sulfate 3379 217.0176 4-ethylphenyl sulfate 3580 201.0227 C13637 4-hydroxychlorothalonil 4427 244.9082 34217 4-hydroxyhippurate 1475 194.0459 151012 4-hydroxyphenylacetate 1361 151.0401 127 C00642 4-hydroxyphenylpyruvate 1690 179.035 979 C01179 4-methoxyphenol sulfate 2412 203.002 4-methyl-2-oxopentanoate 2170 129.0557 70 C00233 4-methylbenzenesulfonate 2350 171.0121 6101 C06677 4-methylcatechol sulfate 2665 203.002 4-methylguaiacol sulfate 2978 217.0176 4-vinylphenol sulfate 3320 199.0071 6426766 C05627 5,6-dihydrothymine 1637.8 127.0513 93556 C00906 5,6-dihydrouracil 1120 113.0357 649 C00429 5,6-dihydrouridine 1119 245.0779 94312 5alpha-androstan-3alpha,17beta-diol monosulfate (1) 4925 371.1898 5alpha-androstan-3alpha,17beta-diol monosulfate (2) 5080 371.1898 5alpha-androstan-3beta,17alpha-diol disulfate 4215 225.0697 5alpha-androstan-3beta,17beta-diol disulfate 3880 225.0697 242332 C12525 5alpha-androstan-3beta,17beta-diol monosulfate (2) 4685 371.1898 5alpha-pregnan-3beta,20alpha-diol disulfate 3962 239.0853 5alpha-pregnan-3beta,20alpha-diol monosulfate (2) 5060 399.2211 5alpha-pregnan-3beta,20beta-diol monosulfate (1) 5180 399.2211 5alpha-pregnan-diol disulfate 4310 239.0853 5127902 5-dodecenoate (12:1n7) 5224 197.1547 5312378 5-methyluridine (ribothymidine) 1778.1 257.0779 445408 5-oxoproline 738.5 128.0353 7405 C01879 6-bromotryptophan 3565 280.9931 6-hydroxyindole sulfate 2498 212.0023 6-oxopiperidine-2-carboxylate 965 142.051 3014237 7-HOCA 5288.1 429.301 3081085 C17337 9,10-DiHOME 5180 313.2384 9966640 C14828 9-hydroxystearate 5384 299.2592 9570127 acesulfame 1581 161.9867 36573 acisoga 2297 183.1139 129397 aconitate [cis or trans] 580 173.0092 adrenate (22:4n6) 5678 331.2643 5497181 C16527 alpha-hydroxycaproate 1920 131.0714 99824 alpha-hydroxyisocaproate 1840 131.0714 83697 C03264 andro steroid monosulfate C19H28O6S (1)* 3871 383.1534 C04555 androstenediol (3alpha, 17alpha) monosulfate (2) 4712 369.1741 androstenediol (3alpha, 17alpha) monosulfate (3) 5180 369.1741 androstenediol (3beta,17beta) disulfate (1) 3740 224.0618 87120982 C04295 androstenediol (3beta,17beta) disulfate (2) 4065 224.0624 87120982 C04295 androstenediol (3beta,17beta) monosulfate (1) 4535 369.1741 13847309 androstenediol (3beta,17beta) monosulfate (2) 4500 369.1741 androsterone glucuronide 4953 465.2494 114833 C11135 androsterone sulfate 5022 369.1741 159663 arachidate (20:0) 6240 311.2956 10467 C06425 arachidonate (20:4n6) 5535 303.233 444899 C00219 behenate (22:0)* 6745 339.3269 8215 C08281 benzoate 1750 121.0295 243 C00180 beta-citrylglutamate 530 320.0623 72715786 C20775 beta-hydroxyisovalerate 1027 117.0557 69362 bilirubin (E,E)* 4294 583.2562 5315454 bilirubin 4796 583.2562 5280352 C00486 branched chain 14:0 dicarboxylic acid 3849 257.1758 branched-chain fatty acid 18:0 (2) 5634 283.2642 branched-chain, straight-chain, or cyclopropyl 10:1 fatty acid (1)* 4805 169.1234 branched-chain, straight-chain, or cyclopropyl 10:1 fatty acid (2)* 4853 169.1234 branched-chain, straight-chain, or cyclopropyl 10:1 fatty acid (3)* 4931 169.1234 branched-chain, straight-chain, or cyclopropyl 12:1 fatty acid* 5261 197.1546 butyrate (4:0) 1062 87.0452 264 C00246 butyrylglycine (C4) 1470 144.0666 88412 caprate (10:0) 5090.7 171.1391 2969 C01571 caproate (6:0) 2713.7 115.0765 8892 C01585 catechol sulfate 1906 188.9863 3083879 C-glycosyltryptophan 1777 365.1354 10981970 chenodeoxycholate 5264 391.2854 10133 C02528 cholate 5165 407.2803 221493 C00695 cinnamoylglycine 3127 204.0666 709625 cis-4-decenoate (10:1n6)* 4890 169.1234 5312351 citrate 582 191.0197 311 C00158 cortisol 4710 361.202 5754 C00735 cortisone 4575 359.1864 222786 C00762 cortolone glucuronide (1) 4600 541.2654 daidzein sulfate (2) 3330 333.0076 dehydroepiandrosterone sulfate (DHEA-S) 4745 367.1585 12594 C04555 delta-CEHC 3422 249.1132 11536125 deoxycholate 5294 391.2854 222528 C04483 deoxycholic acid (12 or 24)-sulfate* 4580 235.1175 deoxycholic acid glucuronide 4800 567.3175 desmethylnaproxen 3045 215.0714 13393711 desmethylnaproxen sulfate 2250 295.0282 184679 dihomolinoleate (20:2n6) 5730 307.2643 6439848 C16525 dihomolinolenate (20:3n3 or 3n6) 5596 305.2486 5280581 C03242 docosadienoate (22:2n6) 6034 335.2956 5282807 C16533 docosahexaenoate (DHA; 22:6n3) 5525 327.233 445580 C06429 docosapentaenoate (DPA; 22:5n3) 5571 329.2486 6441454 C16513 docosapentaenoate (n6 DPA; 22:5n6) 5624.5 329.2486 6441454 C16513 docosatrienoate (22:3n3) 5823 333.2799 5312556 C16534 dodecadienoate (12:2)* 5146 195.1391 dodecanedioate (C12) 2990 229.1445 12736 C02678 dodecenedioate (C12:1-DC)* 2700 227.1289 dopamine 3-O-sulfate 1556.2 232.0285 122136 C13690 EDTA 643 291.0834 6049 C00284 eicosanedioate (C20-DC) 5200.9 341.2697 75502 eicosapentaenoate (EPA; 20:5n3) 5450 301.2173 446284 C06428 eicosenedioate (C20:1-DC)* 5095 339.2541 eicosenoate (20:1n9 or 1n11) 5950 309.2799 5282768 C16526 epiandrosterone sulfate 4855 369.1741 9929317 erucate (22:1n9) 6355.6 337.3112 5281116 C08316 etiocholanolone glucuronide 4915 465.2494 270605 ADSGEGDFXAEGGGVR* 2474 766.8353 16133137 DSGEGDFXAEGGGVR* 2535 731.3168 ADpSGEGDFXAEGGGVR* 2016 806.8185 Fibrinopeptide B (1-13) 2482 696.7717 gamma-CEHC 3843 263.1289 133098 gamma-glutamylleucine 1685 259.1299 151023 gamma-glutamylphenylalanine 1825 293.1143 111299 genistein sulfate* 3616 349.0024 glucuronide of piperine metabolite C17H21NO3 (4)* 3992 462.177 glutamine conjugate of C6H10O2 (2)* 2526 241.1194 glycerol 758 91.0401 753 C00116 glycine conjugate of C10H14O2 (1)* 4335 222.1136 glyco-beta-muricholate 4762 464.3018 glycochenodeoxycholate 5236.1 448.3068 12544 C05466 glycochenodeoxycholate 3-sulfate 4820 263.6282 glycochenodeoxycholate glucuronide (1) 4806 311.6658 glycocholate 5163 464.3018 10140 C01921 glycocholenate sulfate* 4750 254.6229 glycodeoxycholate 5281 448.3068 3035026 C05464 glycodeoxycholate 3-sulfate 4875 263.6282 glycohyocholate 5020 464.3018 glycolithocholate 5357.1 432.3119 115245 C15557 glycolithocholate sulfate* 5011 255.6307 72222 C11301 glycoursodeoxycholate 5033 448.3068 12310288 guaiacol sulfate 2344 203.002 22473 heptanoate (7:0) 3670 129.0921 8094 C17714 hexadecadienoate (16:2n6) 5398 251.2017 hexadecanedioate (C16) 4615 285.2071 10459 C19615 hexadecenedioate (C16:1-DC)* 4380 283.1915 hippurate 2106.9 178.051 464 C01586 histidine 755.9 154.0622 6274 C00135 hydrochlorothiazide 2046 295.9572 3639 C07041 hydroquinone sulfate 1395 188.9863 161220 C00530 hyocholate 5046 407.2803 92805 C17649 hypoxanthine 1291.2 135.0312 790 C00262 indoleacetate 2200 174.0561 802 C00954 indolelactate 2286 204.0666 92904 C02043 indolepropionate 2795 188.0717 3744 isobutyrylglycine (C4) 1420 144.0666 10855600 isoursodeoxycholate 4809 391.2854 127601 C17662 isovalerate (C5) 1564 101.0608 10430 C08262 isovalerylglycine 1950 158.0823 546304 kynurenate 2224 188.0353 3845 C01717 laurate (12:0) 5300 199.1704 3893 C02679 linoleate (18:2n6) 5535 279.233 5280450 C01595 linolenate (18:3n3 or 3n6) 5450 277.2173 5280934 C06426 linoleoyl ethanolamide 6150 322.2752 5283446 lithocholate sulfate (1) 4811 227.12 malate 615.6 133.0143 525 C00149 margarate (17:0) 5731 269.2486 10465 metabolonic lactone sulfate 4802 427.216 methyl glucopyranoside (alpha + beta) 1070 193.0718 methyl-4-hydroxybenzoate sulfate 2873 230.9969 myristate (14:0) 5440 227.2017 11005 C06424 myristoleate (14:1n5) 5346.9 225.186 5281119 C08322 N1-Methyl-2-pyridone-5-carboxamide 1668 151.0513 69698 C05842 N6-carbamoylthreonyladenosine 2164 411.127 161466 N-acetyl-2-aminooctanoate* 3943 200.1292 95555 N-acetylaspartate (NAA) 620.5 174.0408 65065 C01042 N-acetylleucine 2400 172.0979 70912 C02710 N-acetylmethionine 1787 190.0543 448580 C02712 N-acetylphenylalanine 2597 206.0823 74839 C03519 N-acetylthreonine 821.6 160.0615 152204 N-acetylvaline 1704 158.0823 66789 naproxen 4155 229.087 156391 C01517 nervonate (24:1n9)* 6804 365.3425 5281120 C08323 N-formylmethionine 1543.8 176.0387 439750 C03145 nonadecanoate (19:0) 6068 297.2799 12591 C16535 N-palmitoylglycine 5580 312.2544 151008 N-palmitoylserine 5557 342.265 6453686 octadecadienedioate (C18:2-DC)* 4676 309.2071 octadecanedioate (C18) 5043 313.2384 70095 octadecenedioate (C18:1-DC)* 4875 311.2228 oleate/vaccenate (18:1) 5655 281.2486 oleoyl ethanolamide 6450 324.2908 5283454 O-sulfo-L-tyrosine 990 260.0234 514186 oxalate (ethanedioate) 603 88.988 971 C00209 palmitate (16:0) 5618 255.233 985 C00249 palmitoleate (16:1n7) 5475 253.2173 445638 C08362 palmitoyl ethanolamide 6300 298.2752 4671 C16512 pantothenate (Vitamin B5) 1498.7 218.1034 6613 C00864 p-cresol sulfate 2890 187.0071 4615423 pentadecanoate (15:0) 5521 241.2173 13849 C16537 perfluorooctanesulfonate (PFOS) 5233 498.9302 74483 C18142 phenol sulfate 2156 172.9914 74426 C02180 phenylacetate 2150 135.0452 999 C07086 phenylacetylglutamine 2330 263.1037 92258 C04148 phenylalanyltryptophan 4165 350.151 134906 phenyllactate (PLA) 2208 165.0557 3848 C05607 phytanate 5908 311.2956 26840 C01607 pregnanediol-3-glucuronide 5145 495.2963 123796 pregnen-diol disulfate* 3868 238.0775 pregnenediol sulfate (C21H34O5S)* 5000 397.2054 pregnenetriol disulfate* 3504 246.0749 pregnenetriol sulfate* 4749 413.2003 pregnenolone sulfate 5100 395.1898 105074 propyl 4-hydroxybenzoate sulfate 3971 259.0282 pseudouridine 1100 243.0623 15047 C02067 pyridoxate 2185 182.0459 6723 C00847 stearate (18:0) 5872 283.2643 5281 C01530 stearidonate (18:4n3) 5395 275.2017 5312508 C16300 sulfate of piperine metabolite C16H19NO3 (2)* 4112 352.086 sulfate of piperine metabolite C16H19NO3 (3)* 4200 352.086 sulfate of piperine metabolite C18H21NO3 (3)* 4630 378.1017 sulfate* 616 96.9601 1118 C00059 tartronate (hydroxymalonate) 610 118.9986 45 C02287 taurochenodeoxycholate 5250 498.2895 387316 C05465 taurocholate 5150 514.2844 6675 C05122 taurocholenate sulfate* 4750 279.6142 taurodeoxycholate 5257.4 498.2895 2733768 C05463 taurolithocholate 3-sulfate 5027 280.6221 440071 C03642 tetradecadienedioate (C14:2-DC)* 3148 253.1445 tetradecadienoate (14:2)* 5292 223.1704 5312409 tetradecanedioate (C14) 3985 257.1758 13185 theophylline 2356.9 179.0575 2153 C07130 thymol sulfate 4410 229.054 C09908 thyroxine 4808 775.6794 5819 C01829 trans-2-hexenoylglycine 2707 170.0823 tridecenedioate (C13:1-DC)* 3051 241.1445 undecanedioate (C11-DC) 2440 215.1289 15816 urate 757.1 167.0211 1175 C00366 uridine 1457.6 243.0623 6029 C00299 ursodeoxycholate 5055 391.2854 31401 C07880 vanillylmandelate (VMA) 941 197.0456 1245 C05584 METABOLITES_END #END