Return to study ST001775 main page

Analysis: Other POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
10-heptadecenoate (17:1n7)10Z-Heptadecenoic acidME4102855312435-5555-
10-nonadecenoate (19:1n9)Nonadeca-10Z-enoic acidME4102865312513-5780-
10-undecenoate (11:1n1)10-Hendecenoic acidME41028714891C139105085.8-
1-(1-enyl-oleoyl)-GPE (P-18:1)*LPE P-18:1 or LPE O-18:2ME410266--6250-
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20...PC P-16:0/20:4 or PC O-16:1/20:4ME410267--2154-
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20...PE P-16:0/20:4 or PE O-16:1/20:4ME410268--2270-
1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2)...PC P-16:0/18:2 or PC O-16:1/18:2ME410269--2226-
1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)...PE P-16:0/18:2 or PE O-16:1/18:2ME410270--2351-
1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1)*PC P-16:0/18:1 or PC O-16:1/18:1ME410271--2443-
1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)*PE P-16:0/18:1 or PE O-16:1/18:1ME410272--2600-
1-(1-enyl-palmitoyl)-2-palmitoyl-GPC (P-16:0/16:0)...PC P-16:0/16:0 or PC O-16:1/16:0ME41027311146967-2454-
1-(1-enyl-palmitoyl)-GPC (P-16:0)*LPC P-16:0 or LPC O-16:1ME41027410917802-1547-
1-(1-enyl-palmitoyl)-GPE (P-16:0)*LPE P-16:0 or LPE O-16:1ME410275--1558-
1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:...PE P-18:0/20:4 or PE O-18:1/20:4ME4102769547058-2511-
1-(1-enyl-stearoyl)-2-linoleoyl-GPE (P-18:0/18:2)*PE P-18:0/18:2 or PE O-18:1/18:2ME410277--2633-
1-(1-enyl-stearoyl)-GPE (P-18:0)*LPE P-18:0 or LPE O-18:1ME410278--6500-
12,13-DiHOME12,13-DiHOMEME41028810236635C148295137-
1,2,3-benzenetriol sulfate (2)-ME410279--1709-
1,2-dilinoleoyl-GPC (18:2/18:2)PC 18:2/18:2ME4102805288075-2006-
1,2-dilinoleoyl-GPE (18:2/18:2)*PE 18:2/18:2ME4102819546812-2083-
1,2-dipalmitoyl-GPC (16:0/16:0)PC 16:0/16:0ME410282452110-2365-
1,2-dipalmitoyl-GPE (16:0/16:0)*PE 16:0/16:0ME410283445468-2498-
12-HEPE12-HEPEME41028910041593-5265-
12-HETE12-HETEME4102905312983-5326-
12-HHTrE12S-HHTrEME4102915283141C203885175-
13-HODE + 9-HODEHODEME41029243013-5275-
14-HDoHE/17-HDoHE-ME410293--5296-
1,5-anhydroglucitol (1,5-AG)1,5-AnhydrosorbitolME41028464960C07326802-
16-hydroxypalmitateJuniperic acidME41029410466C182185236.2-
(16 or 17)-methylstearate (a19:0 or i19:0)Methyloctadecanoic acidME4102633083779-5993-
18-methylnonadecanoate (i20:0)Isoarachidic acidME4102954383090-6170-
1-arachidonoyl-GPC (20:4n6)*LPC 20:4/0:0ME410296-C052081460-
1-arachidonoyl-GPE (20:4n6)*LPE 20:4/0:0ME41029742607465-1470-
1-arachidonoyl-GPI (20:4)*LPI 20:4/0:0ME410298--5482-
1-arachidonylglycerol (20:4)MG 20:4ME4102995282281C138576250-
1-carboxyethylisoleucine1-CarboxyethylisoleucineME410300--2628-
1-carboxyethylleucine1-CarboxyethylleucineME410301--2663-
1-carboxyethylphenylalanine1-CarboxyethylphenylalanineME410302--2844-
1-carboxyethyltyrosine1-CarboxyethyltyrosineME410303--1846-
1-carboxyethylvaline1-CarboxyethylvalineME410304--2008-
1-dihomo-linolenylglycerol (20:3)MG 20:3/0:0/0:0ME410305--6400-
1-dihomo-linoleoylglycerol (20:2)MG 20:2ME410306--6800-
1-docosahexaenoylglycerol (22:6)MG 22:6ME410307--1542-
1-heptadecenoylglycerol (17:1)*MG 17:1/0:0/0:0ME410308--6390-
1-lignoceroyl-GPC (24:0)LPC 24:0/0:0ME410309--1907-
1-linolenoylglycerol (18:3)MG 18:3ME41031053480978-6214-
1-linolenoyl-GPC (18:3)*LPC 18:3ME410311--1410-
1-linoleoyl-2-arachidonoyl-GPC (18:2/20:4n6)*PC 18:2/20:4ME410312--1969-
1-linoleoyl-2-arachidonoyl-GPE (18:2/20:4)*PE 18:2_20:4ME410313--2030-
1-linoleoyl-2-linolenoyl-GPC (18:2/18:3)*PC 18:2/18:3ME410314--1939-
1-linoleoylglycerol (18:2)MG 18:2ME4103155283469-6477-
1-linoleoyl-GPC (18:2)LPC 18:2/0:0ME41031611988421C041001465-
1-linoleoyl-GPE (18:2)*LPE 18:2/0:0ME41031752925130-1482-
1-linoleoyl-GPG (18:2)*LPG 18:2/0:0ME410318--5516-
1-linoleoyl-GPI (18:2)*LPI 18:2/0:0ME410319--5494-
1-methyl-4-imidazoleacetateMethylimidazoleacetic acidME41032075810C058282064-
1-methyl-5-imidazoleacetate1-Methyl-5-imidazoleacetic acidME4103216451814-1989-
1-methylhistamine1-MethylhistamineME4103233614C051273040-
1-methylhistidine1-MethylhistidineME41032492105C011521227-
1-methylnicotinamide1-Methyl nicotinamideME41032510129985C029181940-
1-myristoyl-2-arachidonoyl-GPC (14:0/20:4)*PC 14:0/20:4ME410326--1914-
1-myristoyl-2-palmitoyl-GPC (14:0/16:0)PC 14:0/16:0ME410327129657-2147-
1-myristoylglycerol (14:0)MG 16:3ME41032879050C018856353.3-
1-oleoyl-2-arachidonoyl-GPE (18:1/20:4)*PE 18:1/20:4ME410329--2200-
1-oleoyl-2-arachidonoyl-GPI (18:1/20:4) *PI 18:1/20:4ME410330--2568-
1-oleoyl-2-docosahexaenoyl-GPC (18:1/22:6)*PC 18:1/22:6ME410331--2011-
1-oleoyl-2-docosahexaenoyl-GPE (18:1/22:6)*PE 18:1/22:6ME410332--2119-
1-oleoyl-2-linoleoyl-GPC (18:1/18:2)*PC 18:1_18:2ME410333--2165-
1-oleoyl-2-linoleoyl-GPE (18:1/18:2)*PE 18:1/18:2ME4103349546753-2270-
1-oleoylglycerol (18:1)MG 18:1/0:0/0:0ME4103355283468-6650-
1-oleoyl-GPC (18:1)LPC 18:1/0:0ME41033616081932-1540-
1-oleoyl-GPE (18:1)LPE 18:1/0:0ME4103379547071-1554-
1-oleoyl-GPG (18:1)*LPG 18:1/0:0ME410338--5610-
1-oleoyl-GPI (18:1)LPI 18:1/0:0ME410339--5599-
1-palmitoleoyl-2-linolenoyl-GPC (16:1/18:3)*PC 16:1_18:3ME410340--1850-
1-palmitoleoyl-2-linoleoyl-GPC (16:1/18:2)*PC 16:1/18:2ME410341--2003-
1-palmitoleoylglycerol (16:1)*MG 16:1ME410342--6094-
1-palmitoleoyl-GPC (16:1)*LPC 16:1/0:0ME41034324779461-1450-
1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6)PC 16:0/20:4ME41034410747814-2091-
1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4)*PE 16:0/20:4ME4103459546800-2198-
1-palmitoyl-2-arachidonoyl-GPI (16:0/20:4)*PI 16:0/20:4ME410346--2567-
1-palmitoyl-2-docosahexaenoyl-GPC (16:0/22:6)PC 16:0/22:6ME4103476441886-2023-
1-palmitoyl-2-docosahexaenoyl-GPE (16:0/22:6)*PE 16:0/22:6ME4103489546799-2119-
1-palmitoyl-2-gamma-linolenoyl-GPC (16:0/18:3n6)*PC 16:0_18:3ME410349--2034-
1-palmitoyl-2-linoleoyl-GPC (16:0/18:2)PC 16:0/18:2ME4103505287971-2160-
1-palmitoyl-2-linoleoyl-GPE (16:0/18:2)PE 16:0/18:2ME4103519546747-2275-
1-palmitoyl-2-linoleoyl-GPI (16:0/18:2)PI 16:0/18:2ME410352--2730-
1-palmitoyl-2-oleoyl-GPC (16:0/18:1)PC 16:0/18:1ME4103536436017-2358-
1-palmitoyl-2-oleoyl-GPE (16:0/18:1)PE 16:0/18:1ME4103545283496-2509-
1-palmitoyl-2-oleoyl-GPI (16:0/18:1)*PI 16:0/18:1ME410355--3140-
1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)*PC 16:0/16:1ME410356--2160-
1-palmitoyl-2-stearoyl-GPC (16:0/18:0)PC 16:0/18:0ME410357--2653-
1-palmitoylglycerol (16:0)MG 16:0/0:0/0:0ME41035814900-6550-
1-palmitoyl-GPC (16:0)LPC 16:0/0:0ME41035986554-1525-
1-palmitoyl-GPE (16:0)LPE 16:0/0:0ME4103609547069-1544-
1-palmitoyl-GPG (16:0)*LPG 16:0/0:0ME4103613300276-5570-
1-palmitoyl-GPI (16:0)LPI 16:0/0:0ME410362--5564-
1-ribosyl-imidazoleacetate*Imidazoleacetic acid ribosideME4103635117448C051312006-
1-stearoyl-2-arachidonoyl-GPC (18:0/20:4)PC 18:0/20:4ME41036416219824-2300-
1-stearoyl-2-arachidonoyl-GPE (18:0/20:4)PE 18:0/20:4ME4103655289133-2424-
1-stearoyl-2-arachidonoyl-GPI (18:0/20:4)PI 18:0/20:4ME410366--3000-
1-stearoyl-2-docosahexaenoyl-GPC (18:0/22:6)PC 18:0/22:6ME410367--2197-
1-stearoyl-2-docosahexaenoyl-GPE (18:0/22:6)*PE 18:0/22:6ME4103689546798-2317-
1-stearoyl-2-linoleoyl-GPC (18:0/18:2)*PC 18:0/18:2ME410369--2380-
1-stearoyl-2-linoleoyl-GPE (18:0/18:2)*PE 18:0/18:2ME4103709546749-2522-
1-stearoyl-2-linoleoyl-GPI (18:0/18:2)PI 18:0/18:2ME410371--3185-
1-stearoyl-2-oleoyl-GPC (18:0/18:1)PC 18:0/18:1ME410372--2644-
1-stearoyl-2-oleoyl-GPE (18:0/18:1)PE 18:0/18:1ME410373--2858-
1-stearoyl-2-oleoyl-GPG (18:0/18:1)PG 18:0/18:1ME410374--717-
1-stearoyl-GPC (18:0)LPC 18:0/0:0ME410375497299-1606-
1-stearoyl-GPE (18:0)LPE 18:0/0:0ME4103769547068-1626-
1-stearoyl-GPI (18:0)LPI 18:0/0:0ME410377--5794-
2,2'-Methylenebis(6-tert-butyl-p-cresol)-ME4103798398-703-
2,3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)*2,3-Dihydroxy-5-methylthio-4-pentenoic acidME410380--1156-
2,3-dihydroxyisovalerate2,3-Dihydroxyisovaleric acidME410381677C040391050-
2-(4-hydroxyphenyl)propionate4-Hydroxyphenyl-2-propionic acidME410378102526C030801797.3-
2,6-dihydroxybenzoic acid2,6-Dihydroxybenzoic acidME4103829338-2575-
2,8-quinolinediol sulfate-ME410383--2612-
2-aminoadipatealpha-Aminoadipic acidME410384469C009563500-
2-aminoheptanoate2-Aminoheptanoic acidME410385227939-3160-
2-aminooctanoate2-Aminocaprylic acidME41038669522-750-
2-aminophenol sulfate2-Aminophenyl sulfateME410387181670-1677-
2-arachidonoylglycerol (20:4)MG 20:4ME4103885282280C138566170-
2-butenoylglycine2-ButenoylglycineME4103896303498-1380-
2'-deoxycytidineDeoxycytidineME41039013711C008812193-
2'-deoxyuridineDeoxyuridineME41039113712C005261586-
2-dihomo-linoleoylglycerol (20:2)*-ME410392--6700-
2-docosahexaenoylglycerol (22:6)*MG 22:6ME410393--6050-
2-hydroxy-3-methylvalerate2-Hydroxy-3-methyl-pentanoic acidME410394164623-1800-
2-hydroxyadipate2-Hydroxyadipic acidME410395193530C023603000-
2-hydroxybutyrate/2-hydroxyisobutyrate2-Hydroxybutyric acid/2-Hydroxyisobutyric acidME410396--1258-
2-hydroxydecanoate2-Hydroxycapric acidME41039721488-4840-
2-hydroxyglutarate2-Hydroxyglutaric acidME41039843C02630958-
2-hydroxyhippurate (salicylurate)Salicyluric acidME41039910253C075881123.9-
2-hydroxylaurate2-Hydroxylauric acidME41040097783-5211-
2-hydroxyoctanoate2-Hydroxyoctanoic acidME41040194180-3736.8-
2-hydroxypalmitate2-Hydroxypalmitic acidME41040292836-5511.2-
2-hydroxyphenylacetate2-Hydroxyphenylacetic acidME41040311970C05852858.6-
2-hydroxystearate2-Hydroxystearic acidME41040469417C030455695-
2-isopropylmalate2-Isopropylmalic acidME41040577C025042605-
2-linoleoylglycerol (18:2)MG 18:2ME4104065365676-6250-
2-methylbutyrylcarnitine (C5)CAR 4:0;2MeME4104076426901-3050-
2-methylbutyrylglycine2-MethylbutyrylglycineME410408193872-1884-
2-oleoylglycerol (18:1)MG 0:0/18:1(9Z)/0:0ME4104095319879-6500-
2'-O-methylcytidine2'-O-MethylcytidineME410410150971-2411-
2'-O-methyluridine2'-O-MethyluridineME410411102212-1831-
2-oxindole-3-acetate2-Oxindole-3-acetateME4104123080590-2076-
2-oxoadipateOxoadipic acidME41041371C003222635-
2-oxoarginine*2-OxoarginineME410414558C037711760-
2-palmitoleoylglycerol (16:1)*MG 16:1ME410415--6016-
2-palmitoleoyl-GPC (16:1)*LPC 0:0/16:1ME410416--5720-
2-palmitoylglycerol (16:0)MG 0:0/16:0/0:0ME410417123409-6400-
2-palmitoyl-GPC (16:0)*LPC 0:0/16:0ME41041815061532-6215-
2S,3R-dihydroxybutyrate4-Deoxythreonic acidME41041910964471-1660-
2-stearoyl-GPE (18:0)*LPE 0:0/18:0ME410420--6350-
3-(3-hydroxyphenyl)propionate3-(3-Hydroxyphenyl)propanoic acidME41042191C114571980-
3-(3-hydroxyphenyl)propionate sulfate3-(3-Sulfooxyphenyl)propanoic acidME410422187488-1294-
3,4-dihydroxybutyrate3,4-Dihydroxybutyric acidME410425--2204-
3-(4-hydroxyphenyl)lactateHydroxyphenyllactic acidME4104239378C036721379-
3-(4-hydroxyphenyl)propionateDesaminotyrosineME41042410394C017441670-
3,4-methylene heptanoylglycine-ME410426--3818-
3-acetylphenol sulfate3-Acetylphenol sulfateME410427--2477-
3-amino-2-piperidone3-Amino-2-piperidoneME4104285200225-2065-
3-carboxy-4-methyl-5-pentyl-2-furanpropionate (3-C...3-Carboxy-4-methyl-5-pentyl-2-furanpropanoic acidME410429194501-4000-
3-dehydrocholate3-Dehydrocholic acidME410430159655-5050-
3-formylindole1H-Indole-3-carboxaldehydeME41043110256C084933709-
3-hydroxy-2-ethylpropionate2-Ethyl-hydracrylic acidME410432188979-975-
3-hydroxy-3-methylglutarate3-Hydroxymethylglutaric acidME4104331662C037612850-
3-hydroxyadipate*3-Hydroxy-adipic acidME410434151913-3131-
3-hydroxybutyrate (BHBA)3-Hydroxybutyric acidME410435441C010891444-
3-hydroxycinnamate sulfate3-Hydroxycinnamate sulfateME4104366443141-1338-
3-hydroxydecanoate3-Hydroxydecanoic acidME41043726612-4634.7-
3-hydroxydodecanedioate*3-Hydroxy-dodecanedioic acidME41043816663321-2252-
3-hydroxyhexanoate3S-Hydroxyhexanoic acidME410439151492-1725-
3-hydroxyhexanoylcarnitine (1)CAR 6:0;3OHME410440--2918-
3-hydroxyhexanoylcarnitine (2)CAR 6:0;3OHME410441--2968-
3-hydroxyisobutyrate3-Hydroxyisobutyric acidME41044287C060011619-
3-hydroxylaurate3-Hydroxydodecanoic acidME41044394216-5175-
3-hydroxymyristate3-Hydroxytetradecanoic acidME41044416064-5335-
3-hydroxyoctanoate3-Hydroxyoctanoic acidME41044526613-3446-
3-hydroxyoleate*-ME410446--5508-
3-hydroxyoleoylcarnitineCAR 18:1(9Z);3OHME410447--1406-
3-hydroxypalmitate3-Hydroxyhexadecanoic acidME410448301590-5476-
3-hydroxypalmitoylcarnitineCAR 16:0;3OHME410449--1380-
3-hydroxypyridine sulfate3-Hydroxypyridine sulfateME410450--1595.5-
3-hydroxysebacate3-Hydroxysebacic acidME4104513017884-1282-
3-hydroxystearate3-Hydroxystearic acidME4104525282907-5674-
3-indoxyl sulfateIndoxyl sulfateME41045310258-2222.2-
3-methoxytyrosine3-MethoxytyrosineME4104541670-2555-
3-methyl-2-oxobutyrateKetoisovaleric acidME41045549C00141911-
3-methyl-2-oxovalerate3-Methyl-2-oxovaleric acidME41045647C006712064.2-
3-methyladipate3-Methyladipic acidME41045712292-2865-
3-methylcrotonylglycine3-MethylcrotonylglycineME410458169485-1980-
3-methylglutaconate3E-Methylglutaconic acidME4104591551553-2700-
3-methylhistidine3-MethylhistidineME41046064969C01152906.3-
3-phenylpropionate (hydrocinnamate)Hydrocinnamic acidME410461107C056292860-
3-phosphoglycerate3-Phosphoglyceric acidME410462724C00597590-
3-ureidoisobutyrateUreidoisobutyric acidME410463160663C051001910-
3-ureidopropionateUreidopropionic acidME410464111C02642875-
4-acetamidobutanoate4-Acetamidobutanoic acidME41046518189C029461350-
4-acetylphenol sulfate4-Acetylphenyl sulfateME4104664684006-2375-
4-allylphenol sulfate4-Allylphenol sulfateME410467--3805-
4-cholesten-3-oneCholestenoneME41046891477C005992520-
4-ethylcatechol sulfate-ME410469--3379-
4-ethylphenol glucuronide-ME410470--3167-
4-ethylphenylsulfate4-EthylphenolME410471-C136373580-
4-guanidinobutanoate4-Guanidinobutanoic acidME410472500C010352320-
4-hydroxybutyrate (GHB)4-Hydroxybutyric acidME41047310413C009891148-
4-hydroxycinnamatecis-p-Coumaric acidME410474637542C008111457-
4-hydroxycinnamate sulfate4-Hydroxycinnamate sulfateME4104756070438-1000-
4-hydroxyhippurate4-Hydroxyhippuric acidME410476151012-1475-
4-hydroxyphenylacetate4-Hydroxyphenyl acetateME410477127C006421361-
4-hydroxyphenylacetate sulfate        -ME410478--867-
4-hydroxyphenylpyruvate4-Hydroxyphenylpyruvic acidME410479979C011791690-
4-imidazoleacetateImidazoleacetic acidME41048096215C028352236-
4-methoxyphenol sulfate4-Methoxyphenol sulfateME410481--2412-
4-methyl-2-oxopentanoateKetoleucineME41048270C002332170-
4-methylcatechol sulfate-ME410483--2665-
4-methylhexanoylglycine-ME410484--3550-
4-vinylphenol sulfate4-HydroxystyreneME4104856426766C056273320-
5,6-dihydrothymineDihydrothymineME41048693556C009061280-
5,6-dihydrouracilDihydrouracilME410487649C004291120-
5,6-dihydrouridine5,6-DihydrouridineME41048894312-1119-
5-dodecenoate (12:1n7)5-Dodecenoic acidME4104895312378-5224-
5-dodecenoylcarnitine (C12:1)CAR 12:1(5)ME410490--1135-
5-hydroxyhexanoate5-Hydroxycaproic acidME410491170748-1267-
5-hydroxyindoleacetate5-Hydroxyindoleacetic acidME4104921826C056351510.2-
5-hydroxylysine5-HydroxylysineME4104931029C167412790-
5-methyl-2'-deoxycytidine5-Methyl-2'-deoxycytidineME410494440055C035922303-
5-methylcytidine5-MethylcytidineME41049592918-2227-
5-methylthioadenosine (MTA)5'-MethylthioadenosineME410496439176C001702752-
5-methyluridine (ribothymidine)RibothymidineME410497445408-1778.1-
5-oxoprolinePyroglutamic acidME4104987405C01879738.5-
6-beta-hydroxylithocholateMurideoxycholic acidME4104995283821C155154830-
6-hydroxyindole sulfate6-Hydroxyindole sulfateME410500--2498-
6-oxopiperidine-2-carboxylate6-oxopiperidine-2-carboxylic acidME4105013014237-965-
7-alpha-hydroxy-3-oxo-4-cholestenoate (7-Hoca)7alpha-Hydroxy-3-oxo-4-cholestenoic acidME4105023081085C173375288.1-
7-ketodeoxycholate7-Ketodeoxycholic acidME410503188292-4821-
7-methylguanine7-MethylguanineME41050411361C022422175-
9,10-DiHOME9,10-DiHOMEME4105059966640C148285180-
acetylcarnitine (C2)CAR 2:0ME4105061C025712282-
adenineAdenineME410507190C001472221-
adenosineAdenosineME41050860961C002122075.4-
adenosine 3',5'-cyclic monophosphate (cAMP)3',5' cyclic AMPME4105096076C005751952.2-
adenosine 5'-diphosphoribose (ADP-ribose)ADP-riboseME410510192C00301920-
adenosine 5'-monophosphate (AMP)AMPME4105226083C000201013-
adipate (C6-DC)Adipic acidME410511196C061043000-
adipoylcarnitine (C6-DC)CAR DC5:0ME41051271296139-2570-
adrenate (22:4n6)Adrenic acidME4105135497181C165275678-
alanineAlanineME4105145950C000411700-
allantoinAllantoinME410515204C023501672-
alpha-hydroxyisocaproate2-Hydroxyisocaproic acidME41051683697C032641840-
alpha-hydroxyisovalerate2-Hydroxy-3-methylbutyric acidME41051799823-1126-
alpha-ketoglutaramate*2-Keto-glutaramic acidME410518--1916-
alpha-ketoglutarate2-Oxoglutaric acidME41051951C000262700-
alpha-muricholatealpha-Muricholic acidME4105203083761C176474765-
alpha-tocopherolalpha-TocopherolME41052114985C024772522-
anserineAnserineME410523112072C012621124.8-
arabinoseArabinoseME41052466308C002161804.5-
arabitol/xylitolArabitolME4105256912C019041932.4-
arabonate/xylonateArabinonic acid/Xylonic acidME410526--2700-
arachidate (20:0)Arachidic acidME41052710467C064256240-
arachidonate (20:4n6)Arachidonic acidME410528444899C002195535-
arachidonoylcarnitine (C20:4)CAR 20:4ME410529--1353-
arachidoylcarnitine (C20)*CAR 20:0ME410530--1512-
argininate*Argininic acidME410531160437-2150-
arginineArginineME410532232C000622825-
asparagineAsparagineME4105336267C001521225-
aspartateAspartic acidME4105345960C000491165-
azelate (C9-DC)Azelaic acidME4105352266C082611276-
behenoylcarnitine (C22)*CAR 22:0ME410538--1561-
behenoyl dihydrosphingomyelin (d18:0/22:0)*SM 18:0;O2/22:0ME410536--3150-
behenoyl sphingomyelin (d18:1/22:0)*SM 18:1;O2/22:0ME410537--3083-
benzoateBenzoic acidME410539243C001801750-
beta-hydroxyisovalerate3-Hydroxyisovaleric acidME41054069362-1027-
betaineBetaineME410541247C007191064-
beta-muricholatebeta-Muricholic acidME4105425283853C177264794-
beta-sitosterolSitosterolME410543222284C017533054-
bilirubin (E,E)*BilirubinME4105455315454-4294-
bilirubin (E,Z or Z,E)*BilirubinME4105465799469-1265-
bilirubin (Z,Z)BilirubinME4105445280352C004861840-
biliverdinBiliverdinME4105475353439C005004695.6-
biopterinBiopterinME410548445040C063131398-
butyrylcarnitine (C4)CAR 4:0ME410549439829C028622860-
butyrylglycineN-ButyrylglycineME41055088412-1470-
caffeic acid sulfate-ME410551--1307-
campesterolCampesterolME410552173183C017892873-
caprate (10:0)Capric acidME4105532969C015715090.7-
caproate (6:0)Caproic acidME4105548892C015852713.7-
caprylate (8:0)Caprylic acidME410555379C064234362-
carboxyethyl-GABAN-Carboxyethyl-gamma-aminobutyric acidME4105562572-2085-
carnitineCarnitineME41055710917C003181978-
carnosineCarnosineME410558439224C003862942-
carotene diol (1)Carotene diolME410559--1720-
carotene diol (2)Carotene diolME410560--1904-
carotene diol (3)Carotene diolME410561--1948-
catechol sulfateCatechol sulfateME4105623083879-1906-
ceramide (d16:1/24:1, d18:1/22:1)*Cer 40:2;O2ME410563--3850-
ceramide (d18:1/14:0, d16:1/16:0)*Cer 36:1;O2ME410564--2477-
ceramide (d18:1/17:0, d17:1/18:0)*Cer 35:1;O2ME410565--3055-
ceramide (d18:1/20:0, d16:1/22:0, d20:1/18:0)*Cer 38:1;O2ME410566--3920-
C-glycosyltryptophanC-GlycosyltryptophanME41056710981970-1777-
chenodeoxycholateChenodeoxycholic acidME41056810133C025285264-
cholateCholic acidME410569221493C006955165-
cholesterolCholesterolME41057011025495C001872707-
cholineCholineME410571305C001141961-
choline phosphateCholine phosphateME4109101014C00588700-
cinnamoylglycineCinnamoylglycineME410572709625-3127-
cis-4-decenoate (10:1n6)*4Z-Decenoic acidME4105735312351-4890-
cis-4-decenoylcarnitine (C10:1)CAR 10:1ME410574--1057-
citrateCitric acidME410575311C00158582-
citrullineCitrullineME4105769750C003271520-
corticosteroneCorticosteroneME4105775753C021405040-
creatineCreatineME410578586C003001947-
creatinineCreatinineME410579588C007912055-
cystathionineCystathionineME410580439258C022912270-
cysteineCysteineME4105815862C000971475-
cysteine-glutathione disulfideS-Glutathionyl-cysteineME4105834247235-2465-
cysteine s-sulfateCysteine-S-sulfateME410582115015C05824565-
cysteinylglycine disulfide*Cysteinylglycine disulfideME410584--2547-
cystineCystineME41058567678C004913424-
cytidineCytidineME4105866175C004751325-
cytosineCytosineME410587597C003802060-
daidzeinDaidzeinME4105885281708C102083566-
daidzein 7-O-glucuronideDaidzein 7-O-glucuronideME41058911316354-2580-
daidzein sulfate (1)-ME410590--2843-
daidzein sulfate (2)-ME410591--3330-
decanoylcarnitine (C10)CAR 10:0ME41059210245190-1130-
deoxycarnitine3-DehydroxycarnitineME410593134C011812052-
deoxycholateDeoxycholic acidME410594222528C044835294-
diacylglycerol (14:0/18:1, 16:0/16:1) [2]*DG 32:1ME410595--3183-
diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1])*DG 34:3ME410596--2733-
dihomo-linoleate (20:2n6)11Z,14Z-Eicosadienoic acidME4105976439848C165255730-
dihomo-linolenate (20:3n3 or n6)Dihomo-gamma-linolenic acidME4105985280581C032425596-
dihomo-linolenoylcarnitine (C20:3n3 or 6)*CAR 20:3ME410599--1392-
dihomo-linoleoylcarnitine (C20:2)*CAR 20:2ME410600--1436-
dihydrobiopterin4a-Carbinolamine tetrahydrobiopterinME4106011879C002681552.3-
dihydrocaffeate sulfate (2)Dihydrocaffeic acid 3-sulfateME410602--930-
dihydroferulateDihydroferulic acidME41060314340-1928-
dihydroferulic acid sulfateDihydroferulic acid 4-sulfateME410604187489-1310-
dihydroorotate4,5-Dihydroorotic acidME410605648C003371910-
dimethylarginine (SDMA + ADMA)DimethylarginineME410607123831C036262850-
dimethylglycineDimethylglycineME410608673C010261104-
dimethyl sulfoneDimethyl sulfoneME4106066213C11142832-
docosadienoate (22:2n6)13Z,16Z-Docosadienoic acidME4106095282807C165336034-
docosadioate (C22-DC)Docosanedioic acidME410610244872C196255291.8-
docosahexaenoate (DHA; 22:6n3)LPC 22:6ME410611445580C064295525-
docosahexaenoylcarnitine (C22:6)*CAR 22:6ME410612--1349-
docosapentaenoate (n3 DPA; 22:5n3)DPAME4106136441454C165135571-
docosapentaenoate (n6 DPA; 22:5n6)Docosapentaenoic acid (22n-6)ME4106146441454C165135624.5-
docosatrienoate (22:3n3)13,16,19-Docosatrienoic acidME4106155312556C165345823-
docosatrienoate (22:3n6)*Docosatrienoic acidME410616--5850-
dodecadienoate (12:2)*Dodecadienoic acidME410617--5146-
dodecanedioate (C12-DC)Dodecanedioic acidME41061812736C026782990-
dopamine 3-O-sulfateDopamine 3-O-sulfateME410619122136C136901556.2-
ectoineEctoineME410620126041C062311980-
EDTAEdetic acidME4106216049C00284643-
eicosanedioate (C20-DC)Eicosanedioic acidME41062275502-5200.9-
eicosapentaenoate (EPA; 20:5n3)Eicosapentaenoic acidME410623446284C064285450-
eicosenoate (20:1)cis-Gondoic acidME4106245282768C165265950-
eicosenoylcarnitine (C20:1)*CAR 20:1ME410625--1484-
equol glucuronide-ME410626--3215-
equol sulfate-ME410627--3630-
ergothioneineErgothioneineME4106283032311C05570850-
erucate (22:1n9)cis-Erucic acidME4106295281116C083166355.6-
erucoylcarnitine (C22:1)*CAR 22:1ME410630--1535-
erythritolErythritolME410631222285C005031491-
erythronate*Erythronic acidME4106322781043-2186-
ethyl glucuronideEthyl glucuronideME410633152226-1181-
ethylmalonateEthylmalonic acidME41063411756-2785-
ferulatetrans-Ferulic acidME410636445858C014941755-
ferulic acid 4-sulfateFerulic acid 4-sulfateME4106376305574-1200-
flavin adenine dinucleotide (FAD)FADME410635643975C000162425-
formiminoglutamateFormiminoglutamic acidME410638439233C004391880-
fructoseFructoseME4106395984C000952065-
fumarateFumaric acidME410640444972C001223084-
galactonateGalactonic acidME410641128869C008803085-
gamma-glutamylalaninegamma-GlutamylalanineME410642440103-1986-
gamma-glutamyl-alpha-lysinegamma-GlutamyllysineME41064365254-2784-
gamma-glutamylcitrulline*-ME410644--1644-
gamma-glutamyl-epsilon-lysineEpsilon-(gamma-Glutamyl)-lysineME4106457015685-2725-
gamma-glutamylglutamategamma-Glutamylglutamic acidME41064692865C052821775-
gamma-glutamylglutaminegamma-GlutamylglutamineME410647150914C052831430-
gamma-glutamylglycinegamma-GlutamylglycineME410648165527-1535-
gamma-glutamylhistidinegamma-GlutamylhistidineME4106497017195-2740-
gamma-glutamylisoleucine*gamma-GlutamylisoleucineME41065014253342-2940-
gamma-glutamylleucinegamma-GlutamylleucineME410651151023-2991-
gamma-glutamylmethioninegamma-GlutamylmethionineME4106527009567-2640-
gamma-glutamylphenylalaninegamma-GlutamylphenylalanineME410653111299-2992-
gamma-glutamylthreoninegamma-GlutamylthreonineME41065476078708-1750-
gamma-glutamyltryptophangamma-GlutamyltryptophanME4106553989307-2975-
gamma-glutamyltyrosinegamma-GlutamyltyrosineME41065694340-2518-
gamma-glutamylvalinegamma-GlutamylvalineME4106577015683-2700-
gamma-tocopherol/beta-tocopherolbeta-tocopherolME410658--2384-
genisteinGenisteinME4106595280961C065633754-
genistein glucuronide*-ME410660--2895-
genistein sulfate*-ME410661--3616-
gentisateGentisic acidME4106623469C00628905-
gluconateGluconic acidME41066310690C002572922-
glucoseGlucoseME41066479025C000312342-
glucuronateGlucuronic acidME410665444791C001913233.3-
glucuronide of C10H18O2 (12)*-ME410666--4760-
glucuronide of C14H22O4 (1)*-ME410667--3891-
glucuronide of C14H22O4 (2)*-ME410668--3932-
glutamateGlutamic acidME410669611C000251500-
glutamineGlutamineME4106705961C000641291-
glutarate (C5-DC)Glutaric acidME410671743C004892900-
glutarylcarnitine (C5-DC)CAR DC5:0ME41067271464488-2393-
glutathione, oxidized (GSSG)Oxidized glutathioneME41067365359C001272667-
glycerateGlyceric acidME410674752C002582070.4-
glycerolGlycerolME410675753C00116758-
glycerol 3-phosphatesn-Glycero-3-phosphateME410676754C00093580-
glycerophosphoethanolaminesn-Glycero-3-phosphoethanolamineME410677123874C01233659-
glycerophosphoglycerolsn-Glycero-3-phosphoglycerolME410678439964C032742430-
glycerophosphorylcholine (GPC)sn-Glycero-3-phosphocholineME41067971920C00670672-
glycineGlycineME410680750C000371375-
glycine conjugate of C10H14O2 (1)*-ME410681--4335-
glycitein sulfate (2)-ME410682--3400-
glyco-alpha-muricholate**-ME410683--4734-
glyco-beta-muricholate**Glyco-beta-muricholic acidME410684--4762-
glycolate (hydroxyacetate)Glycolic acidME410685757C001601790.4-
glycosyl ceramide (d18:1/20:0, d16:1/22:0)*HexCer 38:1;O2ME410686--3414-
glycosyl ceramide (d18:1/23:1, d17:1/24:1)*HexCer 41:2;O2ME410687--3667-
glycosyl-N-nervonoyl-sphingosine (d18:1/24:1)*HexCer 18:1;O2/24:1ME410688--3990-
glycosyl-N-palmitoyl-sphingosine (d18:1/16:0)HexCer 18:1;O2/16:0ME410689--2623-
glycosyl-N-stearoyl-sphingosine (d18:1/18:0)HexCer 18:1;O2/18:0ME410690--3053-
glycosyl-N-tetracosadienoyl-sphingosine (d18:1/24:...-ME410691--3380-
guaiacol sulfateGuaiacol sulfateME41069222473-2344-
guanidinoacetateGuanidoacetic acidME410693763C005811937-
guanosineGuanosineME4106946802C003871662-
gulonate*Gulonic acidME4106959794176C002572750-
hemeHemeME41069626945C000321124-
heneicosapentaenoate (21:5n3)Heneicosapentaenoic acidME41069711998573-5514-
heptenedioate (C7:1-DC)*-ME410698--2816-
hexadecadienoate (16:2n6)Hexadecadienoic acidME410699--5398-
hexadecanedioate (C16-DC)Hexadecanedioic acidME41070010459C196154615-
hexadecenedioate (C16:1-DC)*-ME410701--4380-
hexanoylcarnitine (C6)CAR 6:0ME4107026426853-3358-
hexanoylglycineHexanoylglycineME41070399463-2900-
hippurateHippuric acidME410704464C015862106.9-
histamineHistamineME410705774C003883035-
histidineHistidineME4107066274C00135755.9-
histidine betaine (hercynine)*HercynineME4107073083620-2094-
homoarginineHomoarginineME4107089085C019242882-
homocitrullineHomocitrullineME41070965072C024271908-
homostachydrine*(S)-HomostachydrineME410710441447C082831750-
homovanillate sulfateHomovanillic acidME41071129981063-1047-
hydantoin-5-propionateHydantoin-5-propionic acidME410712782C055652080-
hydroquinone sulfateQuinol sulfateME410713161220C005301395-
hydroxyasparagine**HydroxyasparagineME41071497663C031241149-
hydroxypalmitoyl sphingomyelin (d18:1/16:0(OH))**SM 18:1;O2/24:0ME410715--2056-
hypotaurineHypotaurineME410717107812C005192763.4-
hypoxanthineHypoxanthineME410718790C002621291.2-
imidazole lactateImidazolelactic acidME410719440129C055682040-
imidazole propionateImidazole propanoateME41072070630-2263-
iminodiacetate (IDA)IminodiacetateME4107218897C19911830-
indole-3-carboxylateIndole-3-carboxylic acidME41072269867C198371710-
indoleacetateIndoleacetic acidME410723802C009542200-
indoleacetylcarnitine*-ME410724--3114-
indoleacetylglycineN-IndoleacetylglycineME410725446640-2610-
indoleacrylateIndoleacrylic acidME41072615030923-2511-
indolelactateIndolelactic acidME41072792904C020432286-
indolepropionate3-Indolepropionic acidME4107283744-3205-
indolepropionylglycineIndolepropionylglycineME4107297677842-2926-
inosineInosineME4107306021C002941602.1-
inosine 5'-monophosphate (IMP)IMPME4107318582C00130650-
isobutyrylcarnitine (C4)CAR 3:0;2MeME410732168379-2810-
isocaproylcarnitineIsocaproylcarnitineME410733--3322-
isocaproylglycineIsocaproylglycineME410734--2820-
isocitric lactoneIsocitric acid lactoneME41073598259-2970-
isoleucineIsoleucineME4107366306C004072800-
isovalerate (i5:0)Isovaleric acidME41073710430C082621564-
isovalerylcarnitine (C5)CAR 4:0;3MeME4107386426851-3085-
isovalerylglycineIsovalerylglycineME410739546304-1950-
itaconateItaconic acidME410740811C004902969-
kynurenateKynurenic acidME4107413845C017172224-
kynurenineKynurenineME410742161166C003282739-
lactateLactic acidME410743612C001861468.8-
lactosyl-N-palmitoyl-sphingosine (d18:1/16:0)LacCer 18:1;O2/16:0ME410744--2527-
laurate (12:0)Lauric acidME4107453893C026795300-
laurylcarnitine (C12)CAR 12:0ME41074610427569-1235-
leucineLeucineME4107476106C001232864-
lignoceroylcarnitine (C24)*CAR 24:0ME410749--1603-
lignoceroyl sphingomyelin (d18:1/24:0)SM 18:1;O2/24:0ME410748--3437-
linoleate (18:2n6)Linoleic acidME4107505280450C015955535-
linolenate [alpha or gamma; (18:3n3 or 6)]Octadecatrienoic acidME4107515280934C064265450-
linolenoylcarnitine (C18:3)*CAR 18:3ME410752--1310-
linoleoyl-arachidonoyl-glycerol (18:2/20:4) [1]*DG 18:2_20:4ME410754--2590-
linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]*DG 18:2_20:4ME410755--2650-
linoleoylcarnitine (C18:2)*CAR 18:2ME4107566450015-1430-
linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [1]...DG 18:2_22:6ME410757--2450-
linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [2]...DG 18:2_22:6ME410758--2500-
linoleoyl ethanolamideLinoleoyl-EAME4107535283446-6150-
linoleoyl-linolenoyl-glycerol (18:2/18:3) [1]*DG 18:2_18:3ME410759--2426-
linoleoyl-linolenoyl-glycerol (18:2/18:3) [2]*DG 18:2_18:3ME410760--2478-
linoleoyl-linoleoyl-glycerol (18:2/18:2) [1]*DG 18:2_18:2ME410761--2720-
lysineLysineME4107625962C000472850-
malateMalic acidME410763525C00149615.6-
maleateMaleic acidME410764444266C013842640-
malonateMalonic acidME410765867C003833447-
malonylcarnitineCAR DC3:0ME41076622833583-2086-
mannitol/sorbitolSorbitolME4107675780C007942320-
mannonate*Mannonic acidME4107683246006-2736-
mannoseMannoseME41076918950C001592200-
margarate (17:0)Margaric acidME41077010465-5731-
margaroylcarnitine (C17)*CAR 17:0ME410771--1424-
methionineMethionineME4107726137C000732526-
methionine sulfoneMethionine sulfoneME41077369961-1250-
methionine sulfoxideMethionine sulfoxideME410774158980C029891272-
methyl glucopyranoside (alpha + beta)Methyl glucoseME410775--1070-
methyl indole-3-acetateIndole-3-methyl acetateME41077674706-3380-
methylmalonate (MMA)Methylmalonic acidME410777487C021703078.4-
methylsuccinateMethylsuccinic acidME41077810349-2800-
myo-inositolMyo-inositolME410779892C001373506.3-
myristate (14:0)Myristic acidME41078011005C064245440-
myristoleate (14:1n5)Myristoleic acidME4107815281119C083225346.9-
myristoleoylcarnitine (C14:1)*CAR 14:1ME41078290659872-1316-
myristoylcarnitine (C14)CAR 14:0ME4107846426854-1350-
myristoyl dihydrosphingomyelin (d18:0/14:0)*SM 18:0;O2/14:0ME410783--2060-
N('1)-acetylspermidineN1-AcetylspermidineME410785496C006123075-
N1-Methyl-2-pyridone-5-carboxamideN1-Methyl-2-pyridone-5-carboxamideME41079069698C058421668-
N1-methyladenosine1-MethyladenosineME41032227476C024942120-
N1-methylinosine1-MethylinosineME41079165095-1430-
N1,N12-diacetylspermineN1,N12-DiacetylspermineME410789132680C034133105-
N-(2-furoyl)glycine2-FuroylglycineME41078621863-1525-
N2,N2-dimethylguanosineN2,N2-DimethylguanosineME41079292919-2210-
N2,N5-diacetylornithineN2,N5-DiacetylornithineME41079310398396-1367-
N2,N6-diacetyllysineN,N'-Diacetyl-lysineME41079491827-1604-
N4-acetylcytidineN4-AcetylcytidineME410795107461-2040-
N6-acetyllysineN6-AcetyllysineME41079892832C027272612.6-
N6-carbamoylthreonyladenosineN6-Carbamoyl-L-threonyladenosineME410799161466-2164-
N6-methyllysineN(6)-MethyllysineME410800164795C027282831-
N6,N6-dimethyllysineN(6),N(6)-Dimethyl-lysineME410797193344C055452831-
N6,N6,N6-trimethyllysineN-6-TrimethyllysineME410796440120C037932825-
N6-succinyladenosineSuccinyladenosineME410801165243-940-
N-acetyl-1-methylhistidine*N-Acetyl-3-methylhistidineME410802193270-2100-
N-acetyl-2-aminooctanoate*N-Acetyl-2-aminooctanoic acidME41080395555-3943-
N-acetyl-3-methylhistidine*N-Acetyl-3-methylhistidineME410804193270-1360-
N-acetylalanineN-AcetylalanineME41080588064C028471564.8-
N-acetylarginineN-AcetylarginineME41080667427C025622245-
N-acetylasparagineN-AcetylasparagineME41080799715-2250-
N-acetylaspartate (NAA)N-Acetylaspartic acidME41080865065C01042880-
N-acetyl-aspartyl-glutamate (NAAG)N-Acetyl-Asp-GluME4108095255C122701035-
N-acetyl-beta-alanineN-Acetyl-beta-alanineME41081076406C01073773-
N-acetylcitrullineN-AcetylcitrullineME410811656979C15532940-
N-acetylglucosamine/N-acetylgalactosamineN-AcetylhexosamineME41081224139-715-
N-acetylglutamateN-Acetylglutamic acidME41081370914C006241050-
N-acetylglutamineN-AcetylglutamineME410814182230C027162140-
N-acetylglycineN-AcetylglycineME41081510972-731-
N-acetylhistidineN-AcetylhistidineME41081675619C02997900-
N-acetylhomocitrulline-ME410817--1363-
N-acetylisoleucineN-AcetylisoleucineME4108182802421-2325-
N-acetyl-isoputreanine*N-AcetylisoputreanineME410819--2305-
N-acetylkynurenine (2)N-AcetylkynurenineME410820--2378-
N-acetylleucineN-AcetylleucineME41082170912C027102400-
N-acetylmethionineN-AcetylmethionineME410822448580C027121787-
N-acetylneuraminateN-Acetylneuraminic acidME410823439197C00270660-
N-acetylphenylalanineN-AcetylphenylalanineME41082474839C035192597-
N-acetylputrescineN-AcetylputrescineME410825122356C027142230-
N-acetylserineN-AcetylserineME41082665249-706-
N-acetyltaurineN-AcetyltaurineME410827159864-800-
N-acetylthreonineN-AcetylthreonineME410828152204-821.6-
N-acetyltryptophanN-Acetyl-tryptophanME410829700653C031372630-
N-acetyltyrosineN-AcetyltyrosineME41083068310-1680-
N-acetylvalineN-AcetylvalineME41083166789-1704-
N-behenoyl-sphingadienine (d18:2/22:0)*Cer 18:2;O2/22:0ME410832--3911-
N-delta-acetylornithineN(5)-Acetyl-ornithineME4108339920500-858-
nervonoylcarnitine (C24:1)*CAR 24:1ME410834--1602-
N-formylanthranilic acidFormylanthranilic acidME410835101399C05653900-
N-formylmethionineN-FormylmethionineME410836439750C031451543.8-
N-formylphenylalanineN-FormylphenylalanineME410837759256-2360-
N-glycolylneuraminateN-Glycoloylneuraminic acidME410838123802C034103327.5-
nicotinamideNiacinamideME410839936C001531796.8-
nicotinamide N-oxideNicotinamide N-oxideME41084072661-877-
nicotinamide ribosideNicotinamide ribosideME410841439924C031502040-
nicotinate ribonucleosideD-RibosylnicotinateME410842161234C058411536-
nisinate (24:6n3)THAME41084311792612-5657-
N-linoleoyltaurine*N-Linoleoyl taurineME410844--5505-
N-methylpipecolateN-methyl pipecolic acidME41084511286529-1932-
N-methylprolineN-Methyl-prolineME410846557-1335-
N-monomethylarginineTarginineME410847132862C038842845-
N,N,N-trimethyl-5-aminovalerateN,N,N-trimethyl-5-aminovalerateME410787--2186-
N,N,N-trimethyl-alanylproline betaine (TMAP)N,N,N-Trimethyl-alanylproline betaineME410788--2470-
N-octanoylglycineCapryloylglycineME41084884290-4335.4-
N-oleoyltaurineN-Oleoyl taurineME4108496437033-5610-
nonadecanedioate (C19-DC)-ME410850--5130-
nonadecanoate (19:0)Nonadecylic acidME41085112591C165356068-
N-palmitoyl-heptadecasphingosine (d17:1/16:0)*Cer 17:1;O2/16:0ME410852--2645-
N-palmitoyl-sphinganine (d18:0/16:0)Cer 18:0;O2/16:0ME4108535283572-3090-
N-palmitoyl-sphingosine (d18:1/16:0)Cer 18:1;O2/16:0ME4108545283564-2893-
N-palmitoyltaurineN-Palmitoyl taurineME410855--5560-
N-stearoyl-sphingosine (d18:1/18:0)*Cer 18:1;O2/18:0ME4108565283565-3392-
N-stearoyltaurineN-Stearoyl taurineME410857168274-5782-
N-tetracosadienoyl-sphingosine (d18:1/24:2)*-ME410858--3858-
octadecadienedioate (C18:2-DC)*Octadecanedioic acidME410859--4676-
octadecanedioate (C18-DC)Octadecanedioic acidME41086070095-5043-
octadecanedioylcarnitine (C18-DC)*CAR DC18:0ME410861--1227-
octadecenedioate (C18:1-DC)*-ME410862--4875-
octadecenedioylcarnitine (C18:1-DC)*CAR DC18:1ME410863--1180-
octanoylcarnitine (C8)CAR 8:0ME410864123701C02838950-
oleate/vaccenate (18:1)Oleic acidME410865--5655-
oleoyl-arachidonoyl-glycerol (18:1/20:4) [1]*DG 18:1_20:4ME410867--2907-
oleoyl-arachidonoyl-glycerol (18:1/20:4) [2]*DG 18:1_20:4ME410868--2990-
oleoylcarnitine (C18:1)CAR 18:1ME4108696441392-1423-
oleoyl ethanolamideOleoyl-EAME4108665283454-1661-
oleoyl-linoleoyl-glycerol (18:1/18:2) [1]DG 18:1_18:2ME410870--3115-
oleoyl-linoleoyl-glycerol (18:1/18:2) [2]DG 18:1_18:2ME410871--3223-
oleoyl-oleoyl-glycerol (18:1/18:1) [1]*DG 18:1_18:1ME410872--3571-
oleoyl-oleoyl-glycerol (18:1/18:1) [2]*DG 18:1_18:1ME410873--3695-
ophthalmateOphthalmic acidME4108747018721-919-
ornithineOrnithineME4108756262C000772800-
orotateOrotic acidME410876967C002951638.1-
orotidineOrotidineME41087792751-2250-
O-sulfo-L-tyrosineSulfotyrosineME410878514186-990-
palmitate (16:0)Palmitic acidME410879985C002495618-
palmitoleate (16:1n7)Palmitoleic acidME410880445638C083625475-
palmitoleoyl-arachidonoyl-glycerol (16:1/20:4) [2]...DG 16:1_20:4ME410881--2528-
palmitoleoylcarnitine (C16:1)*CAR 16:1ME41088271464547-1357-
palmitoleoyl-linoleoyl-glycerol (16:1/18:2) [1]*DG 16:1_18:2ME410883--2664-
palmitoyl-arachidonoyl-glycerol (16:0/20:4) [2]*DG 16:0_20:4ME410887--3015-
palmitoylcarnitine (C16)CAR 16:0ME410888461C029901425-
palmitoyl dihydrosphingomyelin (d18:0/16:0)*SM 18:0;O2/16:0ME4108849939965-2290-
palmitoyl ethanolamidePalmitoyl-EAME4108854671C165126300-
palmitoyl-linolenoyl-glycerol (16:0/18:3) [2]*DG 16:0_18:3ME410889--2834-
palmitoyl-linoleoyl-glycerol (16:0/18:2) [1]*DG 16:0_18:2ME4108909543695-3080-
palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]*DG 16:0_18:2ME410891--3197-
palmitoyl-oleoyl-glycerol (16:0/18:1) [2]*DG 16:0_18:1ME410892-C138613695-
palmitoyl sphingomyelin (d18:1/16:0)SM 18:1;O2/16:0ME4108869939941-2168-
pantothenatePantothenic acidME4108936613C008641667-
p-cresol glucuronide*P-Cresol glucuronideME410894154035-2420-
p-cresol sulfatep-Cresol sulfateME4108954615423-2890-
pentadecanoate (15:0)Pentadecylic acidME41089613849C165375521-
pentadecanoylcarnitine (C15)*CAR 15:0ME410897--1362-
perfluorooctanesulfonate (PFOS)Perfluorooctanesulfonic acidME41089874483C18142662-
phenol glucuronidePhenyl glucuronideME41089987235-1800-
phenol sulfatePhenyl hydrogen sulfateME41090074426C021802156-
phenylacetatePhenyl acetateME410901999C070862150-
phenylacetylcarnitine-ME410902101724840-3092-
phenylacetylglutaminealpha-N-PhenylacetylglutamineME41090392258C041482330-
phenylacetylglycinePhenylacetylglycineME41090468144C055982375-
phenylalaninePhenylalanineME4109056140C000792878-
phenyllactate (PLA)Phenyllactic acidME4109063848C056072208-
phenylpropionylglycinePhenylpropionylglycineME410907152323-2945-
phenylpyruvatePhenylpyruvic acidME410908997C001662515-
phosphatePhosphoric acidME4109091061C00009608-
phosphoethanolaminePhosphoethanolamineME4109111015C00346700-
p-hydroxybenzaldehyde4-HydroxybenzaldehydeME410912126C006332040-
picolinatePicolinic acidME4109131018C10164910-
pimelate (C7-DC)Pimelic acidME410914385C026562745-
pimeloylcarnitine/3-methyladipoylcarnitine (C7-DC)CAR DC7:0ME410915--2773-
pipecolatePipecolic acidME410916849C004081050-
pro-hydroxy-proPro-hydroxyProME41091811673055-2128-
prolineProlineME410917145742C001481603-
propionylcarnitine (C3)CAR 3:0ME410919107738C030172590-
propionylglycinePropionylglycineME41092098681-1502.5-
pseudouridinePseudouridineME41092115047C020671100-
putrescinePutrescineME4109221045C001343027-
pyridoxalPyridoxalME4109231050C002502343-
pyridoxaminePyridoxamineME4109241052C005342975-
pyridoxate4-Pyridoxic acidME4109256723C008472185-
pyroglutamine*PyroglutamineME410926134508-1900-
pyrralinePyrralineME410927122228-2304-
pyruvatePyruvic acidME4109281060C00022732.4-
quinateQuinic acidME4109296508C002962432.9-
quinolinateQuinolinic acidME4109301066C037223000-
(R)-3-hydroxybutyrylcarnitineCAR 4:0;3OHME41026453481617-2400-
retinalRetinalME410931638015C003761666-
retinol (Vitamin A)RetinolME410932445354C004731636-
ribitolRibitolME4109336912C004741789.6-
riboflavin (Vitamin B2)RiboflavinME410934493570C002553160-
ribonateRibonic acidME4109355460677C016852425-
ribulonate/xylulonate*-ME410936--2350-
S-1-pyrroline-5-carboxylate1-Pyrroline-5-carboxylic acidME4109381196C043221528-
(S)-3-hydroxybutyrylcarnitineCAR 4:0;3OHME410265--2340-
S-(3-hydroxypropyl)mercapturic acid (HPMA)N-Acetyl-S-(3-hydroxypropyl)-cysteineME4109373371179-1576-
S-adenosylhomocysteine (SAH)S-AdenosylhomocysteineME410939439155C000211832.4-
salicylateSalicylic acidME410940338C008052195-
sarcosineSarcosineME4109411088C002131280-
sebacate (C10-DC)Sebacic acidME4109425192C082771788-
serineSerineME4109435951C000651239-
serotoninSerotoninME4109445202C007802550-
S-methylcysteineMethylcysteineME41094524417-880-
S-methylglutathioneS-MethylglutathioneME4109463605667C113471075-
S-methylmethionineS-MethylmethionineME410947458C053192555-
spermidineSpermidineME4109481102C003153355-
sphingadienineSphingadienineME4109496449795-1350-
sphinganineSphinganineME4109503126C008361413-
sphinganine-1-phosphateSphinganine 1-phosphateME410951520-1431-
sphingomyelin (d17:1/14:0, d16:1/15:0)*SM 31:1;O2ME410952--1950-
sphingomyelin (d17:1/16:0, d18:1/15:0, d16:1/17:0)...SM 33:1;O2ME410953--2082-
sphingomyelin (d18:0/18:0, d19:0/17:0)*SM 36:0;O2ME410954--2362-
sphingomyelin (d18:0/20:0, d16:0/22:0)*SM 38:0;O2ME410955--2600-
sphingomyelin (d18:1/14:0, d16:1/16:0)*SM 32:1;O2ME41095611433862-1998-
sphingomyelin (d18:1/17:0, d17:1/18:0, d19:1/16:0)SM 35:1;O2ME410957--2312-
sphingomyelin (d18:1/18:1, d18:2/18:0)SM 36:2;O2ME4109586443882-2167-
sphingomyelin (d18:1/19:0, d19:1/18:0)*SM 37:1;O2ME410959--2330-
sphingomyelin (d18:1/20:0, d16:1/22:0)*SM 38:1;O2ME410960--2685-
sphingomyelin (d18:1/20:1, d18:2/20:0)*SM 38:2;O2ME410961--2383-
sphingomyelin (d18:1/20:2, d18:2/20:1, d16:1/22:2)...SM 18:1;O2/20:2ME410962--2039-
sphingomyelin (d18:1/21:0, d17:1/22:0, d16:1/23:0)...SM 39:1;O2ME410963--2793-
sphingomyelin (d18:1/22:1, d18:2/22:0, d16:1/24:1)...SM 40:2;O2ME410964--2666-
sphingomyelin (d18:1/22:2, d18:2/22:1, d16:1/24:2)...SM 40:3;O2ME410965--2209-
sphingomyelin (d18:1/24:1, d18:2/24:0)*SM 42:2;O2ME410966--3033-
sphingomyelin (d18:1/25:0, d19:0/24:1, d20:1/23:0,...SM 43:1;O2ME410967--3500-
sphingomyelin (d18:2/14:0, d18:1/14:1)*SM 32:2;O2ME410968--1860-
sphingomyelin (d18:2/16:0, d18:1/16:1)*SM 34:2;O2ME410969--2002-
sphingomyelin (d18:2/18:1)*SM 18:2;O2/18:1ME410970--1904-
sphingomyelin (d18:2/21:0, d16:2/23:0)*SM 39:2;O2ME410971--2330-
sphingomyelin (d18:2/23:0, d18:1/23:1, d17:1/24:1)...SM 41:2;O2ME410972--2845-
sphingomyelin (d18:2/23:1)*SM 18:2;O2/23:1ME410973--2315-
sphingomyelin (d18:2/24:1, d18:1/24:2)*SM 42:3;O2ME410974--2635-
sphingomyelin (d18:2/24:2)*SM 18:2;O2/24:2ME410975--2215-
sphingosineSphingosineME4109765353955C003191393-
sphingosine 1-phosphateSphingosine 1-phosphateME4109775283560C061241850-
stachydrineStachydrineME410978115244C101721440-
stearate (18:0)Stearic acidME4109795281C015305872-
stearidonate (18:4n3)Stearidonic acidME4109805312508C163005395-
stearoyl-arachidonoyl-glycerol (18:0/20:4) [1]*DG 18:0_20:4ME410983--3404-
stearoyl-arachidonoyl-glycerol (18:0/20:4) [2]*DG 18:0_20:4ME410984--3522-
stearoylcarnitine (C18)CAR 18:0ME4109856426855-1485-
stearoyl ethanolamideStearoyl-EAME41098127902-1787-
stearoyl-linoleoyl-glycerol (18:0/18:2) [2]*DG 18:0_18:2ME410986--3762-
stearoyl sphingomyelin (d18:1/18:0)SM 18:1;O2/18:0ME4109826453725C005502400-
suberate (C8-DC)Suberic acidME41098710457C08278804.3-
suberoylcarnitine (C8-DC)CAR DC8:0ME410988--2964-
succinateSuccinic acidME4109891110C00042603-
succinylcarnitine (C4-DC)CAR DC4:0ME41099071464481-2291-
sulfate*SulfateME4109911118C00059616-
taurineTaurineME4109921123C00245660-
tauro-beta-muricholateTauro-beta-muricholic acidME410993168408-4774-
taurochenodeoxycholateTaurochenodeoxycholic acidME410994387316C054655250-
taurocholateTaurocholic acidME4109956675C051225150-
taurocholenate sulfate*Taurocholenate sulfateME410996--4750-
taurodeoxycholateTaurodeoxycholic acidME4109972733768C054635257.4-
taurodeoxycholic acid 3-sulfateTaurodeoxycholic acid 3-sulfateME410998--4850-
taurohyodeoxycholic acidTaurohyodeoxycholic acidME410999119046-5073-
taurolithocholateTaurolithocholic acidME41100010595C025925345-
taurolithocholate 3-sulfateTaurolithocholic acid sulfateME411001440071C036425027-
tauroursodeoxycholateTauroursodeoxycholic acidME4110029848818-5025-
tetradecadienedioate (C14:2-DC)*-ME411003--3148-
tetradecadienoate (14:2)*Tetradecadienoic acidME4110045312409-5292-
tetradecanedioate (C14-DC)Tetradecanedioic acidME41100513185-3985-
thiamin (Vitamin B1)ThiamineME4110061130C003783050-
thioprolineThioprolineME41100793176-1250-
threonateThreonic acidME411008151152C016202384-
threonineThreonineME4110096288C001881514-
thymidineThymidineME4110105789C002141963.7-
thymineThymineME4110111135C001781654-
thyroxineThyroxineME4110125819C018294808-
tigloylglycineTiglylglycineME4110136441567-1886-
tiglylcarnitine (C5:1-DC)CAR DC5:1ME41101422833596-2962-
trans-2-hexenoylglycine-ME411015--2707-
trans-4-hydroxyprolinetrans-4-HydroxyprolineME4107165810C011571064-
triclosan sulfate-ME411016--5118-
tricosanoyl sphingomyelin (d18:1/23:0)*SM 18:1;O2/23:0ME411017--3200-
trigonelline (N'-methylnicotinate)TrigonellineME4110185570C010041388-
trimethylamine N-oxideTrimethylamine N-oxideME4110191145C011042100-
tryptophanTryptophanME4110206305C000782986-
tyrosineTyrosineME4110216057C000822430-
undecanedioate (C11-DC)Undecanedioic acidME41102215816-2440-
uracilUracilME4110231174C00106827-
urateUric acidME4110241175C00366757.1-
ureaUreaME4110251176C00086700-
uridineUridineME4110266029C002991457.6-
ursocholateUrsocholic acidME411027--4648-
ursodeoxycholateUrsodeoxycholic acidME41102831401C078805055-
valerylcarnitine (C5)CAR 5:0ME4110296426903-3112-
valerylglycineValerylglycineME4110304737557-2071-
valineValineME4110316287C001832479-
xanthineXanthineME4110321188C00385910-
xanthosineXanthosineME41103364959C017621075-
xanthurenateXanthurenic acidME4110345699C024702236-
xyloseXyloseME411035135191C001811727-


  logo