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Analysis: Reversed phase 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 acidME4294965312435-5555-
10-nonadecenoate (19:1n9)Nonadeca-10Z-enoic acidME4294975312513-5780-
1-(1-enyl-oleoyl)-GPE (P-18:1)*LPE P-18:1 or LPE O-18:2ME429391--1566-
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20...PC P-16:0/20:4 or PC O-16:1/20:4ME429392--2200-
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20...PE P-16:0/20:4 or PE O-16:1/20:4ME42939352925126-2300-
1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2)...PC P-16:0/18:2 or PC O-16:1/18:2ME42939424779386-2300-
1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)...PE P-16:0/18:2 or PE O-16:1/18:2ME42939552925127-2400-
1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)*PE P-16:0/18:1 or PE O-16:1/18:1ME42939652925128-2750-
1-(1-enyl-palmitoyl)-2-palmitoyl-GPC (P-16:0/16:0)...PC P-16:0/16:0 or PC O-16:1/16:0ME42939711146967-2550-
1-(1-enyl-palmitoyl)-GPC (P-16:0)*LPC P-16:0 or LPC O-16:1ME42939810917802-1547-
1-(1-enyl-palmitoyl)-GPE (P-16:0)*LPE P-16:0 or LPE O-16:1ME429399--1558-
1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:...PE P-18:0/20:4 or PE O-18:1/20:4ME4294009547058-2550-
1-(1-enyl-stearoyl)-2-linoleoyl-GPE (P-18:0/18:2)*PE P-18:0/18:2 or PE O-18:1/18:2ME429401--2750-
1-(1-enyl-stearoyl)-2-oleoyl-GPE (P-18:0/18:1)PE P-18:0/18:1 or PE O-18:1/18:1ME42940242607457-3100-
1-(1-enyl-stearoyl)-GPE (P-18:0)*LPE P-18:0 or LPE O-18:1ME429403--1649-
1,2-dilinoleoyl-GPC (18:2/18:2)PC 18:2/18:2ME4293845288075-2100-
1,2-dilinoleoyl-GPE (18:2/18:2)*PE 18:2/18:2ME4293859546812-2150-
1,2-dipalmitoyl-GPC (16:0/16:0)PC 16:0/16:0ME429386452110D035852450-
1,2-dipalmitoyl-GPE (16:0/16:0)*PE 16:0/16:0ME429387445468-2498-
1,2-dipalmitoyl-GPG (16:0/16:0)PG 16:0/16:0ME42938811846227-3157-
1,2-distearoyl-GPC (18:0/18:0)PC 18:0/18:0ME42938994190-2950-
12-HETE12-HETEME4294985283155C147775326-
12-HHTrE12S-HHTrEME4294995283141C203885175-
13-HODE + 9-HODEHODEME429500-C14767,C147625275-
1,5-anhydroglucitol (1,5-AG)1,5-AnhydrosorbitolME42939064960C07326802-
(16 or 17)-methylstearate (a19:0 or i19:0)Methyloctadecanoic acidME4293803083779-5993-
18-methylnonadecanoate (i20:0)Isoarachidic acidME4295014383090-6170-
1-arachidonoyl-GPA (20:4)LPA 20:4/0:0ME42940442607498-5499-
1-arachidonoyl-GPC* (20:4)*LPC 20:4/0:0ME42940524779476C052086074-
1-arachidonoyl-GPE (20:4n6)*LPE 20:4/0:0ME42940642607465-5874-
1-arachidonoyl-GPI* (20:4)*LPI 20:4/0:0ME429407121596217-5482-
1-arachidonylglycerol (20:4)MG 20:4ME429408-C138576250-
1-carboxyethylisoleucine1-CarboxyethylisoleucineME429409--2628-
1-carboxyethylleucine1-CarboxyethylleucineME429410--2663-
1-carboxyethylphenylalanine1-CarboxyethylphenylalanineME42941159100900-2844-
1-carboxyethyltyrosine1-CarboxyethyltyrosineME429412--1846-
1-carboxyethylvaline1-CarboxyethylvalineME429413--2008-
1-dihomo-linolenylglycerol (20:3)MG 20:3/0:0/0:0ME429414--6400-
1-dihomo-linoleoylglycerol (20:2)MG 20:2ME429415--6800-
1-docosahexaenoylglycerol (22:6)MG 22:6ME42941653480995-6150-
1-heptadecenoylglycerol (17:1)*MG 17:1/0:0/0:0ME429417--6390-
1-lignoceroyl-GPC (24:0)LPC 24:0/0:0ME42941824779481-1907-
1-linolenoylglycerol (18:3)MG 18:3ME42942153480978-6214-
1-linolenoyl-GPC (18:3)*LPC 18:3ME429419-C041001410-
1-linolenoyl-GPG (18:3)*-ME429420--5421-
1-linoleoyl-2-arachidonoyl-GPC (18:2/20:4n6)*PC 18:2/20:4ME42942224778979C052082000-
1-linoleoyl-2-arachidonoyl-GPE (18:2/20:4)*PE 18:2_20:4ME429423348279332-2080-
1-linoleoyl-2-linolenoyl-GPC (18:2/18:3)*PC 18:2/18:3ME42942452922731-1939-
1-linoleoylglycerol (18:2)MG 18:2ME4294305283469-6477-
1-linoleoyl-GPC (18:2)LPC 18:2/0:0ME42942511988421C041001465-
1-linoleoyl-GPE (18:2)*LPE 18:2/0:0ME42942652925130-5900-
1-linoleoyl-GPG (18:2)*LPG 18:2/0:0ME429427--5516-
1-linoleoyl-GPI* (18:2)*LPI 18:2/0:0ME42942811124828-5494-
1-linoleoyl-GPS (18:2)*LPS 18:2ME429429--5500-
1-meadoylglycerol (20:3n9)*MG 20:3/0:0/0:0ME429431--6450-
1-methyl-4-imidazoleacetateMethylimidazoleacetic acidME42943275810C058282064-
1-methyl-5-imidazoleacetate1-Methyl-5-imidazoleacetic acidME4294336451814-1989-
1-methyladenosine1-MethyladenosineME42991827476C024942120-
1-methylguanidineMethylguanidineME42943410111C022942149-
1-methylhistidine1-MethylhistidineME42943592105C011522755-
1-methylnicotinamide1-Methyl nicotinamideME429436457C029181940-
1-myristoyl-2-arachidonoyl-GPC (14:0/20:4)*PC 14:0/20:4ME42943724778634-1950-
1-myristoyl-2-palmitoyl-GPC (14:0/16:0)PC 14:0/16:0ME429438129657-2250-
1-oleoyl-2-arachidonoyl-GPE (18:1/20:4)*PE 18:1/20:4ME429439348281223-2200-
1-oleoyl-2-arachidonoyl-GPI (18:1/20:4)*PI 18:1/20:4ME429440--2568-
1-oleoyl-2-docosahexaenoyl-GPC (18:1/22:6)*PC 18:1/22:6ME42944124778955-2100-
1-oleoyl-2-docosahexaenoyl-GPE (18:1/22:6)*PE 18:1/22:6ME42944252922113-2119-
1-oleoyl-2-linoleoyl-GPC (18:1/18:2)*PC 18:1_18:2ME42944324778939-2250-
1-oleoyl-2-linoleoyl-GPE (18:1/18:2)*PE 18:1/18:2ME4294449546753-2270-
1-oleoylglycerol (18:1)MG 18:1/0:0/0:0ME4294505283468-6650-
1-oleoyl-GPC (18:1)LPC 18:1/0:0ME42944516081932C039161540-
1-oleoyl-GPE (18:1)LPE 18:1/0:0ME4294469547071-1554-
1-oleoyl-GPG (18:1)*LPG 18:1/0:0ME429447--5610-
1-oleoyl-GPI (18:1)LPI 18:1/0:0ME42944886289645-5599-
1-oleoyl-GPS (18:1)LPS 18:1/0:0ME42944985036846-5607-
1-palmitoleoyl-2-linolenoyl-GPC (16:1/18:3)*PC 16:1_18:3ME42945152922452-1900-
1-palmitoleoyl-2-linoleoyl-GPC (16:1/18:2)*PC 16:1/18:2ME42945224778768-2050-
1-palmitoleoylglycerol (16:1)*MG 16:1ME429454--6094-
1-palmitoleoyl-GPC* (16:1)*LPC 16:1/0:0ME42945324779461-1450-
1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6)PC 16:0/20:4ME42945510747814C052082200-
1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4)*PE 16:0/20:4ME4294569546800C052102250-
1-palmitoyl-2-arachidonoyl-GPI (16:0/20:4)*PI 16:0/20:4ME429457--892-
1-palmitoyl-2-docosahexaenoyl-GPC (16:0/22:6)PC 16:0/22:6ME4294586441886-2055-
1-palmitoyl-2-docosahexaenoyl-GPE (16:0/22:6)*PE 16:0/22:6ME4294599546799-2160-
1-palmitoyl-2-linoleoyl-GPC (16:0/18:2)PC 16:0/18:2ME4294605287971-2160-
1-palmitoyl-2-linoleoyl-GPE (16:0/18:2)PE 16:0/18:2ME4294619546747-2350-
1-palmitoyl-2-linoleoyl-GPG (16:0/18:2)-ME42946252927246-2730-
1-palmitoyl-2-linoleoyl-GPI (16:0/18:2)PI 16:0/18:2ME42946346891795-910-
1-palmitoyl-2-oleoyl-GPC (16:0/18:1)PC 16:0/18:1ME4294646436017C138752450-
1-palmitoyl-2-oleoyl-GPE (16:0/18:1)PE 16:0/18:1ME4294655283496-2600-
1-palmitoyl-2-oleoyl-GPG (16:0/18:1)PG 16:0/18:1ME42946670789105-3206-
1-palmitoyl-2-oleoyl-GPI (16:0/18:1)*PI 16:0/18:1ME42946771296232-893-
1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)*PC 16:0/16:1ME4294686443788-2200-
1-palmitoyl-2-stearoyl-GPC (16:0/18:0)PC 16:0/18:0ME42946924778686C038892750-
1-palmitoyl-2-stearoyl-GPE (16:0/18:0)*PE 16:0/18:0ME4294705326793-2850-
1-palmitoyl-GPA (16:0)LPA 16:0/0:0ME4294716419701C040365600-
1-palmitoyl-GPC (16:0)LPC 16:0/0:0ME42947286554C041021525-
1-palmitoyl-GPE (16:0)LPE 16:0/0:0ME4294739547069-1544-
1-palmitoyl-GPG (16:0)*LPG 16:0/0:0ME4294743300276-5570-
1-palmitoyl-GPI* (16:0)LPI 16:0/0:0ME42947571296207-5564-
1-ribosyl-imidazoleacetate*Imidazoleacetic acid ribosideME429476440569C051312006-
1-stearoyl-2-arachidonoyl-glycosyl-GPE (18:0/20:4)PE 18:0/20:4ME42947746891781-2423-
1-stearoyl-2-arachidonoyl-GPC (18:0/20:4)PC 18:0/20:4ME42947816219824-2400-
1-stearoyl-2-arachidonoyl-GPE (18:0/20:4)PE 18:0/20:4ME4294795289133C052102475-
1-stearoyl-2-arachidonoyl-GPI (18:0/20:4)PI 18:0/20:4ME429480--3000-
1-stearoyl-2-arachidonoyl-GPS (18:0/20:4)PS 18:0/20:4ME42948124779545-2565-
1-stearoyl-2-docosahexaenoyl-GPC (18:0/22:6)PC 18:0/22:6ME42948224778876-2300-
1-stearoyl-2-docosahexaenoyl-GPE (18:0/22:6)*PE 18:0/22:6ME4294839546798-2375-
1-stearoyl-2-linoleoyl-GPC (18:0/18:2)*PC 18:0/18:2ME4294846441487-2450-
1-stearoyl-2-linoleoyl-GPE (18:0/18:2)*PE 18:0/18:2ME4294859546749-2575-
1-stearoyl-2-linoleoyl-GPI (18:0/18:2)PI 18:0/18:2ME429486--910-
1-stearoyl-2-linoleoyl-GPS (18:0/18:2)PS 18:0/18:2ME4294879547091-2689-
1-stearoyl-2-oleoyl-GPC (18:0/18:1)PC 18:0/18:1ME42948824778825-2644-
1-stearoyl-2-oleoyl-GPE (18:0/18:1)PE 18:0/18:1ME4294899546742-2950-
1-stearoyl-2-oleoyl-GPS (18:0/18:1)PS 18:0/18:1ME4294909547087-901-
1-stearoyl-GPC (18:0)LPC 18:0/0:0ME429491497300-1606-
1-stearoyl-GPE (18:0)LPE 18:0/0:0ME4294929547068-1626-
1-stearoyl-GPG (18:0)LPG 18:0/0:0ME429493--5816-
1-stearoyl-GPI (18:0)LPI 18:0/0:0ME429494--5794-
1-stearoyl-GPS (18:0)*LPS 18:0/0:0ME42949574819135-5800-
2,3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)*2,3-Dihydroxy-5-methylthio-4-pentenoic acidME429510--1156-
2,3-dihydroxyisovalerate2,3-Dihydroxyisovaleric acidME429511677C040391050-
2,4-dihydroxybutyrate2,4-Dihydroxybutanoic acidME429513192742-1793-
2,4-di-tert-butylphenol2,4-Ditert-butylphenolME429512--5749-
2,6-dihydroxybenzoic acid2,6-Dihydroxybenzoic acidME4295149338-2575-
2,8-quinolinediol sulfate-ME429515--2612-
2-aminoadipatealpha-Aminoadipic acidME42951692136C009563500-
2-aminoheptanoate2-Aminoheptanoic acidME429517227939-3160-
2-aminophenol sulfate2-Aminophenyl sulfateME429518181670-1677-
2-arachidonoylglycerol (20:4)MG 20:4ME4295195282280C138566170-
2'-deoxyadenosineDeoxyadenosineME42950213730C005592252-
2'-deoxyadenosine 5'-monophosphatedAMPME42950312599C003601315-
2'-deoxycytidineDeoxycytidineME42950413711C008812193-
2'-deoxyguanosineDeoxyguanosineME429506135398592C003301700-
2'-deoxyinosineDeoxyinosineME429507135398593C055121688-
2'-deoxyuridineDeoxyuridineME42950813712C005261586-
2-docosahexaenoylglycerol (22:6)*MG 22:6ME42952046896303-6050-
2-hydroxy-3-methylvalerate2-Hydroxy-3-methyl-pentanoic acidME429521164623-1800-
2-hydroxybutyrate/2-hydroxyisobutyrate2-Hydroxybutyric acid/2-Hydroxyisobutyric acidME429522-C21297,C059841258-
2-hydroxydecanoate2-Hydroxycapric acidME42952321488-4840-
2-hydroxyglutarate2-Hydroxyglutaric acidME42952443C026303352.8-
2-hydroxyheptanoate*2-Hydroxy enanthoic acidME4295252750949-925-
2-hydroxyoctanoate2-Hydroxyoctanoic acidME429526--3736.8-
2-linoleoylglycerol (18:2)MG 18:2ME4295275365676-6250-
2-methylbutyrylcarnitine (C5)CAR 4:0;2MeME4295286426901-3050-
2-methylcitrate/homocitrateHomocitric acidME429529-C01251575-
2-methylmalonylcarnitine (C4-DC)CAR DC3:0;2MeME42953053481628-2440-
2-myristoylglycerol (14:0)MG 0:0/14:0/0:0ME429531137938-6230-
2-naphthol sulfate2-Naphthyl sulfateME42953274428-3658-
2-oleoylglycerol (18:1)MG 0:0/18:1(9Z)/0:0ME4295345319879-6500-
2-O-methylascorbic acid2-O-Methylascorbic acidME42953354726398-1512-
2'-O-methyluridine2'-O-MethyluridineME429509102212-1831-
2-oxoarginine*2-OxoarginineME429535558C037711760-
2-palmitoleoylglycerol (16:1)*MG 16:1ME42953653480960-6016-
2-palmitoylglycerol (16:0)MG 0:0/16:0/0:0ME429538123409-6400-
2-palmitoyl-GPC* (16:0)*LPC 0:0/16:0ME42953715061532-6215-
2R,3R-dihydroxybutyrate4-Deoxyerythronic acidME42954013120901-1543-
2S,3R-dihydroxybutyrate4-Deoxythreonic acidME42954110964471-1660-
2-stearoyl-GPE (18:0)*LPE 0:0/18:0ME429539--6350-
3-(3-hydroxyphenyl)propionate sulfate3-(3-Sulfooxyphenyl)propanoic acidME429546187488-1294-
3,4-dihydroxybutyrate3,4-Dihydroxybutyric acidME429545150929-2204-
3-(4-hydroxyphenyl)lactate (HPLA)4-Hydroxyphenyllactic acidME4295479378C036721379-
3-amino-2-piperidone3-Amino-2-piperidoneME4295485200225-2065-
3'-AMP3'-AMPME42961241211C012671245-
3'-dephospho-acetyl-CoA-ME429542193680-2313-
3'-dephospho-CoA-glutathione*-ME429543--1690-
3'-dephosphocoenzyme A3'-Dephospho-CoAME429544444485C008822013-
3-formylindole1H-Indole-3-carboxaldehydeME42954910256C084933709-
3-hydroxy-2-ethylpropionate2-Ethyl-hydracrylic acidME429550188979-1443.3-
3-hydroxy-3-methylglutarate3-Hydroxymethylglutaric acidME429551-C037612850-
3-hydroxyadipate3-Hydroxy-adipic acidME429552151913-3131-
3-hydroxybutyrate (BHBA)3-Hydroxybutyric acidME429553-C03197,C010891480-
3-hydroxydecanoylcarnitineCAR 10:0;3OHME429554121454166-961-
3-hydroxyhexanoate3S-Hydroxyhexanoic acidME429555151492-1725-
3-hydroxyhexanoylcarnitine (1)CAR 6:0;3OHME429556--2918-
3-hydroxyhexanoylcarnitine (2)CAR 6:0;3OHME429557--2968-
3-hydroxyisobutyrate3-Hydroxyisobutyric acidME42955811966314C01188,C060011619-
3-hydroxylaurate3-Hydroxydodecanoic acidME42955994216-5175-
3-hydroxymyristate3-Hydroxytetradecanoic acidME42956016064-5335-
3-hydroxyoctanoate3-Hydroxyoctanoic acidME42956126613C207933446-
3-hydroxyoctanoylcarnitine (1)CAR 8:0;3OHME429562--3445-
3-hydroxyoctanoylcarnitine (2)CAR 8:0;3OHME429563--3497-
3-hydroxyoleate*-ME429564--5508-
3-hydroxyoleoylcarnitineCAR 18:1(9Z);3OHME429565129637446-1406-
3-hydroxypalmitoylcarnitineCAR 16:0;3OHME429566126456228-1380-
3-indoxyl sulfateIndoxyl sulfateME42956710258-2222.2-
3-methoxytyrosine3-MethoxytyrosineME4295689307-2555-
3-methylglutaconate3E-Methylglutaconic acidME4295691551553-2700-
3-methylhistidine3-MethylhistidineME42957064969C01152906.3-
3-phenylpropionate (hydrocinnamate)Hydrocinnamic acidME429571107C056292860-
3-phosphoglycerate3-Phosphoglyceric acidME429572724C00597583-
3-ureidopropionateUreidopropionic acidME429573111C02642875-
4-acetylphenyl sulfate4-Acetylphenyl sulfateME4295744684006-2375-
4-chlorobenzoic acid4-Chlorobenzoic acidME4295756318C023703015-
4-cholesten-3-oneCholestenoneME42957691477C005992520-
4-ethylphenol glucuronide-ME429577--3167-
4-ethylphenyl sulfate4-EthylphenolME42957820822574C136373580-
4-guanidinobutanoate4-Guanidinobutanoic acidME429579500C010352320-
4-hydroxybutyrate (GHB)4-Hydroxybutyric acidME42958110413C009891765-
4-hydroxyglutamateErythro-4-hydroxy-glutamic acidME429582439902C030791141-
4-hydroxy-nonenal-glutathione-ME42958092970719-3319.2-
4-imidazoleacetateImidazoleacetic acidME42958396215C028352055-
4-methylcatechol sulfate-ME42958454104170-2665-
4-vinylphenol sulfate4-HydroxystyreneME4295856426766C056273320-
5,6-dihydrouridine5,6-DihydrouridineME42958694312-1119-
5-aminovalerate5-Aminopentanoic acidME429588138C004312220-
5-dodecenoate (12:1n7)5-Dodecenoic acidME4295895312378-5224-
5-dodecenoylcarnitine (C12:1)CAR 12:1(5)ME42959091825571-1135-
5-(galactosylhydroxy)-L-lysine5-(Galactosylhydroxy)-lysineME42958766995551-2755-
5'- GMPGMPME4297916804C00144800-
5-hydroxyindoleacetate5-Hydroxyindoleacetic acidME4295911826C056351510.2-
5-hydroxylysine5-HydroxylysineME4295923032849C167412790-
5-methyl-2'-deoxycytidine5-Methyl-2'-deoxycytidineME429593440055C035922303-
5-methylcytidine5-MethylcytidineME42959492918-2227-
5-methylthioadenosine (MTA)5'-MethylthioadenosineME429595439176C001702752-
5-methyluridine (ribothymidine)RibothymidineME429596445408-1778.1-
5-oxoprolinePyroglutamic acidME429597-C01879,C02237738.5-
6-phosphogluconate6-Phosphogluconic acidME42959891493C00345583.9-
7-HOCA7alpha-Hydroxy-3-oxo-4-cholestenoic acidME4295993081085C173375288.1-
7-ketodeoxycholate7-Ketodeoxycholic acidME429600188292-4821-
7-methylguanine7-MethylguanineME429601135398679C022422175-
acetylcarnitine (C2)CAR 2:0ME4296037045767C025712282-
acetylcholineAcetylcholineME429604187C019962220-
acetyl-CoAAcetyl-CoAME429602444493C000241691-
acetylphosphateAcetylphosphateME429605186C002274013.9-
acisogaAcisogaME429606129397-1813-
aconitate [cis or trans]cis-Aconitic acidME429607-C02341,C004174580-
adenineAdenineME429608190C001472221-
adenosineAdenosineME42960960961C002122169-
adenosine 3',5'-cyclic monophosphate (cAMP)3',5' cyclic AMPME4296106076C005751952.2-
adenosine 3',5'-diphosphateAdenosine 3',5'-diphosphateME429611159296C00054575-
adenosine 5'-diphosphoribose (ADP-ribose)ADP-riboseME429614192C00301553-
adenylosuccinateAdenylsuccinic acidME429616440122C03794560-
ADPADPME4296136022C00008680-
adrenate (22:4n6)Adrenic acidME429617-C165275678-
adrenoylcarnitine (C22:4)*CAR 22:4ME429618--1415-
AICA ribonucleotideAICARME42961965110C04677797-
alanineAlanineME4296205950C000411700-
alanylleucineAla-LeuME429621259583-3055-
allantoinAllantoinME429622-C02350,C02348,C015511672-
alpha-hydroxyisocaproate2-Hydroxyisocaproic acidME429623-C032641840-
alpha-hydroxyisovalerate2-Hydroxy-3-methylbutyric acidME42962499823-1052-
alpha-ketoglutaramate*2-Keto-glutaramic acidME42962548C009401916-
alpha-ketoglutarate2-Oxoglutaric acidME42962651C000262700-
alpha-muricholatealpha-Muricholic acidME42962753477700C176474765-
alpha-tocopherolalpha-TocopherolME42962886472C024772522-
alpha-tocotrienolalpha-TocotrienolME4296295282347C141531986-
AMPAMPME4296156083C000201013-
anserineAnserineME429630112072C012622924-
arabitol/xylitolArabitolME429631-C00542,C01904,C003791932.4-
arabonate/xylonateArabinonic acid/Xylonic acidME429632-C00502,C054112700-
arachidate (20:0)Arachidic acidME42963310467C064256240-
arachidonate (20:4n6)Arachidonic acidME429634444899C002195535-
arachidonoylcarnitine (C20:4)CAR 20:4ME429637136212424-1353-
arachidonoyl CoAArachidonyl-CoAME429635-C022492573-
arachidonoyl ethanolamideArachidonoyl-EAME4296365281969C116951560-
arachidoylcarnitine (C20)*CAR 20:0ME42963853477833-1512-
arginineArginineME4296396322C000622825-
argininosuccinateArgininosuccinic acidME42964060150382C034064311-
ascorbate (Vitamin C)Vitamin CME42964154670067C00072,D00018770-
ascorbic acid 3-sulfate*-ME42964211425365-2025-
asparagineAsparagineME4296436267C001521225-
aspartateAspartic acidME4296445960C000491165-
azelate (C9-DC)Azelaic acidME4296452266C082611276-
behenate (22:0)*Behenic acidME4296468215C082816745-
behenoylcarnitine (C22)*CAR 22:0ME42964871464577-1561-
behenoyl sphingomyelin (d18:1/22:0)*SM 18:1;O2/22:0ME42964744260125-3250-
benzoateBenzoic acidME429649243C001801750-
beta-alaninebeta-AlanineME429650239C000991905-
beta-citrylglutamateBeta-Citryl-glutamic acidME429651189741C20775530-
beta-hydroxyisovalerate3-Hydroxyisovaleric acidME42965269362-1149.8-
beta-hydroxyisovaleroylcarnitineCAR 4:0;OH,MeME429653--2584-
betaineBetaineME429656247C007191064-
beta-muricholatebeta-Muricholic acidME4296545283853C177264794-
beta-sitosterolSitosterolME429655222284C017533054-
bilirubinBilirubinME4296575280352C004861840-
biliverdinBiliverdinME4296585280353C005001016-
butenoylcarnitine (C4:1)CAR 4:1ME429659--2765-
butyrylcarnitine (C4)CAR 4:0ME429661439829C028622860-
butyrylglycine (C4)N-ButyrylglycineME42966288412-1470-
butyryl/isobutyryl CoAButyryl-CoAME429660-C001362375-
campesterolCampesterolME429664173183C017892873-
caproate (6:0)Caproic acidME4296658892C015852713.7-
caprylate (8:0)Caprylic acidME429666379C064234362-
carnitineCarnitineME429667288C00487,C003081978-
carnosineCarnosineME429668439224C003862942-
catechol sulfateCatechol sulfateME4296693083879-1906-
CDP-cholineCDP-cholineME42969413804C003074200-
CDP-ethanolamineCDP-EthanolamineME429698123727C005704210-
ceramide (d18:1/17:0, d17:1/18:0)*Cer 35:1;O2ME429670--3055-
C-glycosyltryptophanC-GlycosyltryptophanME42966310981970-2700-
chenodeoxycholateChenodeoxycholic acidME42967110133C025285264-
chiro-inositol1D-chiro-InositolME429672-C198913191.2-
cholateCholic acidME429673221493C006955165-
cholesterolCholesterolME429674-C001872707-
cholesterol sulfateCholesterol sulfateME42967565076C18043681-
cholineCholineME429676305C001141961-
cis-4-decenoate (10:1n6)*4Z-Decenoic acidME4296785282726-4890-
cis-4-decenoylcarnitine (C10:1)CAR 10:1ME42967957357170-1057-
citrateCitric acidME429680311C00158582-
citrullineCitrullineME4296819750C003271520-
CMPCMPME4296956131C00055835-
CoACoenzyme AME42968387642C000101448-
CoA-glutathione*Glutathionyl-CoAME42968246873828C009201326-
corticosteroneCorticosteroneME4296845753C021405040-
creatineCreatineME429685586C003001947-
creatine phosphatePhosphocreatineME429686-C023053831-
creatinineCreatinineME429687588C007912055-
cystathionineCystathionineME429688439258C022912270-
cysteineCysteineME4296895862C000971475-
cysteine-glutathione disulfideS-Glutathionyl-cysteineME4296903080690R009002465-
cysteinylglycineCys-GlyME429691439498C014192132-
cystineCystineME42969267678C004912000-
cytidineCytidineME4296936175C004752124-
cytidine 5'-monophospho-N-acetylneuraminic acidCMP-N-acetylneuraminic acidME429696448209C001283900-
cytidine diphosphateCDPME4296976132C00112580-
cytosineCytosineME429699597C003802060-
daidzeinDaidzeinME4297005281708C102083566-
daidzein sulfate (2)-ME42970112114465-3330-
dCMPdCMPME42950513945C00239975-
decanoylcarnitine (C10)CAR 10:0ME42970210245190-1130-
dehydroascorbateL-Dehydroascorbic acidME429703440667C05422739.6-
deoxycarnitine3-DehydroxycarnitineME42970422620C011812052-
diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1])*DG 34:3ME429705--2733-
dihomolinoleate (20:2n6)11Z,14Z-Eicosadienoic acidME4297066439848C165255730-
dihomolinolenate (20:3n3 or 3n6)Eicosatrienoic acidME4297075280581C032425596-
dihomo-linolenoylcarnitine (C20:3n3 or 6)*CAR 20:3ME429708--1392-
dihomo-linoleoylcarnitine (C20:2)*CAR 20:2ME429709--1436-
dihydroorotate4,5-Dihydroorotic acidME429710648C003371910-
dihydroxyacetone phosphate (DHAP)Dihydroxyacetone phosphateME429711668C00111539-
dimethylarginine (ADMA + SDMA)DimethylarginineME429712-C21189,C036262850-
dimethylglycineDimethylglycineME429713673C036261104-
dimethylmalonic acidDimethylmalonic acidME42971411686-2702-
docosadienoate (22:2n6)13Z,16Z-Docosadienoic acidME4297155282807C165336034-
docosadienoylcarnitine (C22:2)*CAR 22:2ME42971671464511-1493-
docosahexaenoate (DHA; 22:6n3)LPC 22:6ME429717445580C064295525-
docosahexaenoylcarnitine (C22:6)*CAR 22:6ME429719--1349-
docosahexaenoyl ethanolamideDocosahexenoyl-EAME4297185283451-1536-
docosapentaenoate (DPA; 22:5n3)DPAME4297206441454C165135571-
docosapentaenoate (n6 DPA; 22:5n6)Docosapentaenoic acid (22n-6)ME4297216441454C165135624.5-
docosapentaenoylcarnitine (C22:5n3)*CAR 22:5ME42972271464594-1387-
docosapentaenoylcarnitine (C22:5n6)*-ME42972371464594-1417-
docosatrienoylcarnitine (C22:3)*-ME429724--1460-
dodecadienoate (12:2)*Dodecadienoic acidME42972525480-5146-
eicosapentaenoate (EPA; 20:5n3)Eicosapentaenoic acidME429726446284C064285450-
eicosenoate (20:1n9 or 1n11)cis-Gondoic acidME429727-C165265950-
eicosenoylcarnitine (C20:1)*CAR 20:1ME429728--1484-
enterolactone sulfate-ME429729--3746-
equol glucuronide-ME42973046781484-3215-
equol sulfate-ME429731--3630-
ergothioneineErgothioneineME4297325351619C05570850-
erucate (22:1n9)cis-Erucic acidME429733-C083166355.6-
erucoylcarnitine (C22:1)*CAR 22:1ME429734--1535-
erythritolErythritolME429735222285C005031491-
erythronate*Erythronic acidME4297362781043-2186-
erythrose 4-phosphateErythrose 4-phosphateME429737122357C002793960-
ethyl beta-glucopyranoside-ME429738121667-1519-
ethylmalonateEthylmalonic acidME42973911756-2785-
FADFADME429741643975C000162425-
ferulic acid 4-sulfateFerulic acid 4-sulfateME4297406305574-1200-
FMNFMNME429742643976C000612390-
fructoseFructoseME4297432723872C000952065-
fructose 1,6-bisphosphateFructose 1,6-bisphosphateME429744445557C05378553.1-
fructosyllysineFructosyllysineME4297459839580-2784-
fumarateFumaric acidME429746444972C001223084-
galactonateGalactonic acidME429747-C15930,C008803085-
galactose 1-phosphateGalactose 1-phosphateME429748123912C004464552-
gamma-glutamyl-epsilon-lysineEpsilon-(gamma-Glutamyl)-lysineME4297497015685-2725-
gamma-glutamylglutamategamma-Glutamylglutamic acidME42975092865C052821775-
gamma-glutamylglutaminegamma-GlutamylglutamineME429751150914C052831430-
gamma-glutamylhistidinegamma-GlutamylhistidineME4297527017195-2740-
gamma-glutamylisoleucine*gamma-GlutamylisoleucineME42975322885096-2940-
gamma-glutamylleucinegamma-GlutamylleucineME429754151023-2991-
gamma-glutamylphenylalaninegamma-GlutamylphenylalanineME429755111299-1825-
gamma-glutamylthreoninegamma-GlutamylthreonineME42975676078708-1750-
gamma-glutamylvalinegamma-GlutamylvalineME4297577015683-2700-
gamma-tocopherol/beta-tocopherolbeta-tocopherolME429758-C14152,C024832384-
gamma-tocotrienolgamma-TocotrienolME4297595282349C141551918-
gluconateGluconic acidME429760-C002572922-
glucosamine-6-phosphateGlucosamine 6-phosphateME429761440997C003524521.5-
glucoseGlucoseME4297625793C000312342-
glucose 6-phosphateGlucose 6-phosphateME4297635958C000924537-
glucuronateGlucuronic acidME429764-C162453233.3-
glutamateGlutamic acidME42976533032C00025,C002171500-
glutamate, gamma-methyl esterGlutamic acid, gamma-methyl esterME42976668662-2170-
glutamineGlutamineME4297675961C000641291-
glutamine_degradant*-ME429768--1900-
glutarate (C5-DC)Glutaric acidME429769-C004892900-
glutathione, oxidized (GSSG)Oxidized glutathioneME42977065359D00031,C001272667-
glutathione, reduced (GSH)GlutathioneME429771124886D00014,C000512000-
glycerateGlyceric acidME429772-C002582070.4-
glycerolGlycerolME429773753C00116758-
glycerol 3-phosphatesn-Glycero-3-phosphateME429774754C00933938.7-
glycerophosphoethanolaminesn-Glycero-3-phosphoethanolamineME429775123874C012333075-
glycerophosphoglycerolsn-Glycero-3-phosphoglycerolME42977654575349C032742430-
glycerophosphoinositol*sn-Glycero-3-phosphoinositolME429777167572-3850-
glycerophosphorylcholine (GPC)sn-Glycero-3-phosphocholineME42977871920C00670672-
glycerophosphoserine*sn-Glycero-3-phosphoserineME4297793081457-577-
glycineGlycineME429780750C000371375-
glycochenodeoxycholateGlycochenodeoxycholic acidME42978112544C054665236.1-
glycocholateGlycocholic acidME42978210140C019215163-
glycosyl-N-palmitoyl-sphingosine (d18:1/16:0)HexCer 18:1;O2/16:0ME429783--2623-
glycosyl-N-stearoyl-sphingosine (d18:1/18:0)HexCer 18:1;O2/18:0ME429784--3053-
glycylleucineGly-LeuME42978592843C021553059-
glycylvalineGly-ValME4297862724807-2734-
guaiacol sulfateGuaiacol sulfateME42978722473-2344-
guanidinoacetateGuanidoacetic acidME429788763C005811937-
guanineGuanineME429789135398634C002422032-
guanosineGuanosineME4297906802C003871728-
gulonate*Gulonic acidME429792152304C008002750-
hemeHemeME42979326945C000325325-
heneicosapentaenoate (21:5n3)Heneicosapentaenoic acidME42979411998573-5514-
heptanoate (7:0)Heptylic acidME4297958094C177143670-
hexadecadienoate (16:2n6)Hexadecadienoic acidME42979613932172-5398-
hexadecanedioate (C16)Hexadecanedioic acidME42979710459C196154615-
hexadecatrienoate (16:3n3)7,10,13-Hexadecatrienoic acidME42979891820460-5330-
hexanoylcarnitine (C6)CAR 6:0ME4297996426853-800-
hexanoyltaurine-ME4298002245940-3040-
hippurateHippuric acidME429801464C015862106.9-
histamineHistamineME429802774C003883035-
histidineHistidineME4298036274C00135755.9-
histidine betaine (hercynine)*HercynineME4298043083620-2094-
histidine methyl ester-ME42980592893-3080-
homoarginineHomoarginineME4298069085C019242882-
homocitrullineHomocitrullineME42980765072C024271908-
homostachydrine*(S)-HomostachydrineME429808441447C082831750-
hydroquinone sulfateQuinol sulfateME429809161220C005301395-
hydroxy-N6,N6,N6-trimethyllysine*-ME429810--2759-
hydroxypalmitoyl sphingomyelin (d18:1/16:0(OH))SM 18:1;O2/24:0ME429811--2056-
hydroxyprolineHydroxyprolineME4300715810C011571064-
hypotaurineHypotaurineME429812107812C005192763.4-
hypoxanthineHypoxanthineME429813-C002621291.2-
imidazole lactateImidazolelactic acidME429814793C055682040-
imidazole propionateImidazole propanoateME42981570630-2263-
indoleacetateIndoleacetic acidME429816802C009542200-
indoleacrylateIndoleacrylic acidME4298175375048-2511-
indolelactateIndolelactic acidME42981892904C020432286-
indolepropionate3-Indolepropionic acidME4298193744-2795-
inosineInosineME4298206021C002941602.1-
inosine 5'-monophosphate (IMP)IMPME4298218582C00130650-
inositol 1-phosphate (I1P)Inositol 3-phosphateME429822440194C011774785-
isoleucineIsoleucineME4298236306C16424,C00407,C064182800-
isoleucylglycineIle-GlyME429824342532-1992-
isovalerylglycineIsovalerylglycineME429825546304-1950-
kynurenateKynurenic acidME4298263845C017172224-
kynurenineKynurenineME429827161166C003282739-
lactateLactic acidME429828612C00186681.6-
lactobacillic acidLactobacillic acidME429829656761-5822-
laurylcarnitine (C12)CAR 12:0ME429830168381-1235-
leucineLeucineME4298316106C001232864-
leucylalanineLeu-AlaME42983281721-2801-
leucylglutamine*Leu-GlnME4298334305457-2620-
leucylglycineLeu-GlyME42983479070-2050-
lignoceroylcarnitine (C24)*CAR 24:0ME429836--1603-
lignoceroyl sphingomyelin (d18:1/24:0)SM 18:1;O2/24:0ME429835--3437-
linoleate (18:2n6)Linoleic acidME4298375280450C015955535-
linolenate (18:3n3 or 3n6)Octadecatrienoic acidME429838-C06426,C064275450-
linolenoylcarnitine (C18:3)*CAR 18:3ME429839--1310-
linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]*DG 18:2_20:4ME4298419543796-2650-
linoleoylcarnitine (C18:2)*CAR 18:2ME4298426450015-1430-
linoleoylcholine*alpha-LinoleoylcholineME42984353481656-1388-
linoleoyl ethanolamideLinoleoyl-EAME4298405283446-6150-
lysineLysineME4298445962C00047,C007392850-
lyxonateD-Lyxonic acidME429845--2350-
malateMalic acidME429846525C00497,C00149,C00711615.6-
maleateMaleic acidME429847444266C013842640-
malonateMalonic acidME429848867C003833447-
malonylcarnitineCAR DC3:0ME42984922833583-2086-
maltitol/lactitol/cellobiotol/palatinol-ME429850--750-
maltoseMaltoseME42985110991489C002083329.4-
maltotetraoseMaltotetraoseME429852439639C020525000-
maltotrioseMaltotrioseME429853439586C01835812-
mannitol/sorbitolSorbitolME429854-C00392,C007942320-
mannonate*Mannonic acidME4298553246006-2736-
mannoseMannoseME429856-C00159,C02209,C009362200-
mannose 6-phosphateMannose 6-phosphateME429857439198C002754510-
margarate (17:0)Margaric acidME42985810465-5731-
margaroylcarnitine (C17)*CAR 17:0ME42985953477803-1424-
meadoylcarnitine (C20:3n9)*-ME429860--1408-
methionineMethionineME4298616137C000732526-
methionine sulfoxideMethionine sulfoxideME429862158980C029891272-
methyl-4-hydroxybenzoate sulfateMethyl-4-hydroxybenzoate sulfateME42986410657183-2873-
methyl glucopyranoside (alpha + beta)Methyl glucoseME429863--1070-
methylmalonate (MMA)Methylmalonic acidME429865487C021703078.4-
methylphosphateMethanolphosphateME42986613130-3760.1-
methylsuccinateMethylsuccinic acidME42986710349-2800-
myo-inositolMyo-inositolME429868892C001373506.3-
myristoleate (14:1n5)Myristoleic acidME4298695281119C083225346.9-
myristoleoylcarnitine (C14:1)*CAR 14:1ME429870129691961-1316-
myristoylcarnitine (C14)CAR 14:0ME4298716426854-1350-
N1-Methyl-2-pyridone-5-carboxamideN1-Methyl-2-pyridone-5-carboxamideME42991769698C058421668-
(N(1) + N(8))-acetylspermidineAsparagineME429381-C00612,C010293080-
N2-acetyllysineN(2)-AcetyllysineME42991992907C12989828.3-
N-(2-hydroxypalmitoyl)-sphingosine (d18:1/16:0(2OH...-ME42987672715801-2692-
N4-acetylcytidineN4-AcetylcytidineME429920107461-2040-
N6-acetyllysineN6-AcetyllysineME42992292832C027271059-
N6-carbamoylthreonyladenosineN6-Carbamoyl-L-threonyladenosineME429923161466-2164-
N6-carboxymethyllysineN(6)-Carboxymethyl-lysineME429924123800-2500-
N6-methyllysineN(6)-MethyllysineME429925164795C027282831-
N6,N6,N6-trimethyllysineN-6-TrimethyllysineME429921440120C037932825-
N6-succinyladenosineSuccinyladenosineME429926165243-940-
N-acetyl-1-methylhistidine*N-Acetyl-3-methylhistidineME42987753859791-2100-
N-acetylalanineN-AcetylalanineME42988188064C02847861-
N-acetylarginineN-AcetylarginineME42988267427C025622245-
N-acetylasparagineN-AcetylasparagineME42988399715-785-
N-acetylaspartate (NAA)N-Acetylaspartic acidME42988465065C010423143-
N-acetyl-aspartyl-glutamate (NAAG)N-Acetyl-Asp-GluME429878188803C122701035-
N-acetyl-glucosamine 1-phosphateN-Acetyl-D-glucosamine 1-phosphateME429879440364C042564052-
N-acetylglucosamine 6-phosphateN-Acetyl-glucosamine 6-phosphateME429885439219C003574114-
N-acetylglucosamine/N-acetylgalactosamineN-AcetylhexosamineME429886-C01074715-
N-acetylglucosaminylasparagineAspartylglycosamineME429887123826C045401212-
N-acetylglutamateN-Acetylglutamic acidME42988870914C006243106-
N-acetylglutamineN-AcetylglutamineME429889182230C02716845-
N-acetylglycineN-AcetylglycineME42989010972-1780-
N-acetylhistamineN-AcetylhistamineME42989169602C051351730-
N-acetyl-isoputreanineN-AcetylisoputreanineME429880131802901-2305-
N-acetylkynurenine (2)N-AcetylkynurenineME42989273817779-2378-
N-acetylleucineN-AcetylleucineME42989370912C027102400-
N-acetylmethionineN-AcetylmethionineME429894448580C027121787-
N-acetylmethionine sulfoxideN-Acetylmethionine sulfoxideME42989511902949-880-
N-acetylneuraminateN-Acetylneuraminic acidME429896439197C00270660-
N-acetylphenylalanineN-AcetylphenylalanineME42989774839C035192597-
N-acetylputrescineN-AcetylputrescineME429898122356C027142230-
N-acetylserineN-AcetylserineME42989965249-800-
N-acetyltaurineN-AcetyltaurineME429900159864-1249-
N-acetylthreonineN-AcetylthreonineME429901152204-821.6-
N-acetyltyrosineN-AcetyltyrosineME42990268310-1680-
NAD+NAD+ME4299305892C000061434-
N-arachidonoyltaurineN-Arachidonoyl taurineME42990342607331-5481-
N-delta-acetylornithineN(5)-Acetyl-ornithineME4299049920500C00437858-
nervonate (24:1n9)*Nervonic acidME4299275281120C083236804-
nervonoylcarnitine (C24:1)*CAR 24:1ME429928--1602-
N-formylmethionineN-FormylmethionineME429905439750C031451543.8-
N-glycolylneuraminateN-Glycoloylneuraminic acidME429906123802C034103327.5-
nicotinamideNiacinamideME429929936C001531942-
nicotinamide ribonucleotide (NMN)Nicotinamide ribotideME42993114180C00455766-
nicotinamide ribosideNicotinamide ribosideME429932439924C031502040-
nisinate (24:6n3)THAME42993311792612-5657-
N-linoleoyltaurine*N-Linoleoyl taurineME42990752922081-5505-
N-methyl-GABA4-(Methylamino)butyric acidME42990870703C159872109-
N-myristoyltaurine*-ME4299093810823-5405-
N,N-dimethylalanineN,N-DimethylalanineME4298755488191-1370-
N,N-dimethyl-pro-pro-ME429874--2500-
N,N,N-trimethyl-5-aminovalerateN,N,N-trimethyl-5-aminovalerateME42987214274897-2186-
N,N,N-trimethyl-alanylproline betaine (TMAP)N,N,N-Trimethyl-alanylproline betaineME429873--2470-
N-oleoyltaurineN-Oleoyl taurineME4299106437033-5610-
nonadecanoate (19:0)Nonadecylic acidME42993412591C165356068-
nonanoylcarnitine (C9)CAR 9:0ME42993591825642-1010-
N-palmitoyl-sphingadienine (d18:2/16:0)*Cer 18:2;O2/16:0ME429911--2490-
N-palmitoyl-sphinganine (d18:0/16:0)Cer 18:0;O2/16:0ME4299125283572-3090-
N-palmitoyl-sphingosine (d18:1/16:0)Cer 18:1;O2/16:0ME4299135283564-2893-
N-palmitoyltaurineN-Palmitoyl taurineME42991414504290-5560-
N-stearoyl-sphingosine (d18:1/18:0)*Cer 18:1;O2/18:0ME4299155283565-3392-
N-stearoyltaurineN-Stearoyl taurineME429916168274-5782-
octadecenedioate (C18:1-DC)-ME4299389543674-4875-
octanoylcarnitine (C8)CAR 8:0ME429939-C02838950-
oleate/vaccenate (18:1)Oleic acidME429940-C01712,C08367,C00712,C219445655-
oleoyl-arachidonoyl-glycerol (18:1/20:4) [2]*DG 18:1_20:4ME4299439543786-2990-
oleoylcarnitine (C18:1)CAR 18:1ME4299456441392-1423-
oleoylcholineOleoylcholineME42994659040790-1449-
oleoyl CoAOleoyl-CoAME4299415497111C005102569-
oleoyl ethanolamideOleoyl-EAME4299425283454-6450-
oleoyl-linoleoyl-glycerol (18:1/18:2) [1]DG 18:1_18:2ME42994414275396-3115-
O-methyltyrosineO-MethyltyrosineME429936-D007622790-
ophthalmateOphthalmic acidME4299477018721-2085-
ornithineOrnithineME4299486262C000772800-
orotateOrotic acidME429949967C002951638.1-
orotidineOrotidineME42995092751-2250-
O-sulfo-L-tyrosineSulfotyrosineME429937514186-990-
oxalate (ethanedioate)Oxalic acidME429951971C00209603-
oxindolylalanineOxyindolylalanineME42995220977764-2756-
palmitate (16:0)Palmitic acidME429954985C002495618-
palmitoleate (16:1n7)Palmitoleic acidME429955445638C083625475-
palmitoleoylcarnitine (C16:1)*CAR 16:1ME42995671464547-1357-
palmitoloelycholine-ME429957--1385-
palmitoylcarnitine (C16)CAR 16:0ME429965461C029901425-
palmitoylcholinePalmitoylcholineME429966151731-1482-
palmitoyl CoAPalmitoyl-CoAME429958644109C001542600-
palmitoyl dihydrosphingomyelin (d18:0/16:0)*SM 18:0;O2/16:0ME4299599939965-2290-
palmitoyl-docosahexaenoyl-glycerol (16:0/22:6) [1]...DG 16:0_22:6ME4299629543827-2749-
palmitoyl-docosahexaenoyl-glycerol (16:0/22:6) [2]...DG 16:0_22:6ME4299639543827-2830-
palmitoyl ethanolamidePalmitoyl-EAME4299604671C165126300-
palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]*DG 16:0_18:2ME429964131801744-3197-
palmitoyl sphingomyelin (d18:1/16:0)SM 18:1;O2/16:0ME4299619939941-2168-
pantetheinePantetheineME429967439322C008312056-
pantothenate (Vitamin B5)Pantothenic acidME4299686613C008641498.7-
p-cresol glucuronide*P-Cresol glucuronideME429953154035-2420-
pentadecanoylcarnitine (C15)*CAR 15:0ME429969123132011-1362-
phenol sulfatePhenyl hydrogen sulfateME42997074426C021802156-
phenylacetylglycinePhenylacetylglycineME42997168144C055982375-
phenylalaninePhenylalanineME4299726140C000792878-
phenylalanylalaninePhe-AlaME4299735488196-2745-
phenylalanylglycinePhe-GlyME4299746992304-2898-
phenyllactate (PLA)Phenyllactic acidME4299753848C05607908-
phosphatePhosphoric acidME4299761061C00009608-
phosphocholineCholine phosphateME4296771014C00588700-
phosphoenolpyruvate (PEP)Phosphoenolpyruvic acidME4299771005C00074587.3-
phosphoethanolamine (PE)PhosphoethanolamineME4299781015C00346638-
phosphopantetheinePantetheine 4'-phosphateME429979987C011341597-
phytosphingosinePhytosphingosineME429980122121C121441367-
pipecolatePipecolic acidME429981--2200-
prolineProlineME429983-C00148,C0007631603-
prolylglycinePro-GlyME4299846426709-2136-
prolylhydroxyprolinePro-hydroxyProME42998211902893-2128-
propionylcarnitine (C3)CAR 3:0ME429985107738C030172590-
pseudouridinePseudouridineME42998615047C02067800-
putrescinePutrescineME4299871045C001343027-
pyridoxalPyridoxalME4299881050C002502343-
pyridoxal phosphatePyridoxal 5'-phosphateME4299891051C00018943-
pyridoxaminePyridoxamineME4299901052C005342975-
pyridoxamine phosphatePyridoxamine 5'-phosphateME4299911053C006471932-
pyridoxate4-Pyridoxic acidME4299926723C00847846-
pyrralinePyrralineME42999314274616C210132750-
pyruvatePyruvic acidME4299941060C000222650-
quinolinateQuinolinic acidME4299951066C03722845-
(R)-3-hydroxybutyrylcarnitineCAR 4:0;3OHME42938253481617-2400-
retinol (Vitamin A)RetinolME429996445354C004731636-
ribitolRibitolME4299976912C00532,C01904,C00474,C003791789.6-
ribonateRibonic acidME4299985460677C016852425-
riboseRiboseME4299995779C001211508.2-
ribose 1-phosphateRibose 1-phosphateME430000439236C006204025-
ribulose/xyluloseXyluloseME430001--1400-
ribulose/xylulose 5-phosphateRibulose 5-phosphateME430002-C00199,C002313888-
S-(1,2-dicarboxyethyl)glutathione-ME4300039802383-543-
(S)-3-hydroxybutyrylcarnitineCAR 4:0;3OHME42938371464477-2340-
S-adenosylhomocysteine (SAH)S-AdenosylhomocysteineME430004439155C000211832.4-
S-adenosylmethionine (SAM)S-AdenosylmethionineME43000534755C000193002-
salicylateSalicylic acidME430009338C00805802-
sarcosineSarcosineME4300101088C002131280-
sebacate (C10-DC)Sebacic acidME4300115192C082771788-
sedoheptuloseGlucoheptuloseME4300125459879C020762255-
sedoheptulose-7-phosphateSedoheptulose 7-phosphateME430013616C05382599.6-
serineSerineME4300145951C000651239-
serotoninSerotoninME4300155202C007802550-
S-lactoylglutathioneS-LactoylglutathioneME430006440018C034511248-
S-methylcysteineMethylcysteineME430007--1955-
S-methylglutathioneS-MethylglutathioneME430008115260C113471075-
spermidineSpermidineME4300161102C003153355-
spermineSpermineME4300171103C007503350-
sphingadienineSphingadienineME4300186449795-1350-
sphinganineSphinganineME4300193126C008361413-
sphinganine-1-phosphateSphinganine 1-phosphateME430020520-1431-
sphingomyelin (d17:1/16:0, d18:1/15:0, d16:1/17:0)...SM 33:1;O2ME430021--2082-
sphingomyelin (d18:0/18:0, d19:0/17:0)*SM 36:0;O2ME43002244260130-2500-
sphingomyelin (d18:0/20:0, d16:0/22:0)*SM 38:0;O2ME430023--2850-
sphingomyelin (d18:1/14:0, d16:1/16:0)*SM 32:1;O2ME43002411433862-1998-
sphingomyelin (d18:1/17:0, d17:1/18:0, d19:1/16:0)SM 35:1;O2ME43002546891763-2350-
sphingomyelin (d18:1/18:1, d18:2/18:0)SM 36:2;O2ME4300266443882-2167-
sphingomyelin (d18:1/19:0, d19:1/18:0)*SM 37:1;O2ME430027--2550-
sphingomyelin (d18:1/20:0, d16:1/22:0)*SM 38:1;O2ME43002844260124-2800-
sphingomyelin (d18:1/20:1, d18:2/20:0)*SM 38:2;O2ME430029--2450-
sphingomyelin (d18:1/21:0, d17:1/22:0, d16:1/23:0)...SM 39:1;O2ME430030--3000-
sphingomyelin (d18:1/22:1, d18:2/22:0, d16:1/24:1)...SM 40:2;O2ME430031--2775-
sphingomyelin (d18:1/22:2, d18:2/22:1, d16:1/24:2)...SM 40:3;O2ME430032--2350-
sphingomyelin (d18:1/24:1, d18:2/24:0)*SM 42:2;O2ME43003344260126-3200-
sphingomyelin (d18:2/16:0, d18:1/16:1)*SM 34:2;O2ME430034--2002-
sphingomyelin (d18:2/21:0, d16:2/23:0)*SM 39:2;O2ME430035--2500-
sphingomyelin (d18:2/23:0, d18:1/23:1, d17:1/24:1)...SM 41:2;O2ME430036134757653-3000-
sphingomyelin (d18:2/23:1)*SM 18:2;O2/23:1ME430037--2500-
sphingomyelin (d18:2/24:1, d18:1/24:2)*SM 42:3;O2ME43003885336023-2750-
sphingomyelin (d18:2/24:2)*SM 18:2;O2/24:2ME430039--2400-
sphingosineSphingosineME4300405280335C003191393-
sphingosine 1-phosphateSphingosine 1-phosphateME4300415283560C061241375-
stachydrineStachydrineME430042115244C101721440-
stearate (18:0)Stearic acidME4300435281C015305872-
stearidonate (18:4n3)Stearidonic acidME4300445312508C163005395-
stearoyl-arachidonoyl-glycerol (18:0/20:4) [2]*DG 18:0_20:4ME4300476438587-3522-
stearoylcarnitine (C18)CAR 18:0ME4300483006797-1485-
stearoyl ethanolamideStearoyl-EAME43004527902-1787-
stearoyl sphingomyelin (d18:1/18:0)SM 18:1;O2/18:0ME4300466453725C005502450-
succinateSuccinic acidME4300491110C000423149-
succinoyltaurine-ME430050--615-
succinylcarnitine (C4-DC)CAR DC4:0ME43005171464481-2291-
sucroseSucroseME4300525988C000893092-
sulfate*SulfateME4300535152822C00059616-
tartronate (hydroxymalonate)Hydroxypropanedioic acidME43005445C02287610-
taurineTaurineME4300551123C00245660-
taurocholateTaurocholic acidME430056-C051225150-
taurocyamineTaurocyamineME43005768340C01959710-
taurohyodeoxycholic acidTaurohyodeoxycholic acidME43005812443252-5073-
tetracosadienoylcarnitine (C24:2)*-ME430059--1542-
tetradecadienoate (14:2)*Tetradecadienoic acidME4300605312409-5292-
thiamin diphosphateThiamine diphosphateME4300621132C000681195.1-
thiamin monophosphateThiamine monophosphateME430063-C010811448-
thiamin (Vitamin B1)ThiamineME4300611130DG00125,C00378,D085803050-
thioprolineThioprolineME43006493176-1250-
threonateThreonic acidME430065-C016202384-
threonineThreonineME4300666288C001881514-
thymidineThymidineME4300675789C002141963.7-
thymineThymineME4300691135C001781654-
tiglyl carnitine (C5)CAR 4:1;2MeME43007022833596-2962-
TMPTMPME4300689700C00364883-
tricosanoyl sphingomyelin (d18:1/23:0)*SM 18:1;O2/23:0ME430072--3350-
trigonelline (N'-methylnicotinate)TrigonellineME4300735570C010041388-
trimethylamine N-oxideTrimethylamine N-oxideME4300741145C011042100-
tryptophanTryptophanME4300756305C000782986-
tyrosineTyrosineME4300766057C000822430-
tyrosylglycineTyr-GlyME4300777021854-1635-
UDP-glucose/UDP-galactose-ME430078-C00052,C00029645-
UDP-glucuronateUDP-glucuronic acidME43007917473C00167588-
UDP-N-acetylglucosamine/galactosamineUDP-N-acetyl-D-hexosamineME430080-C00203,C000433665-
UMPUMPME4300866030C001054150-
uracilUracilME4300811174C001061089.7-
urateUric acidME4300821175C00366757.1-
ureaUreaME4300831176C00086700-
uridineUridineME4300846029C002991457.6-
uridine 5'-diphosphate (UDP)UDPME4300856031C00015599.5-
uridine 5'-triphosphate (UTP)UTPME4300876133C00075572-
valineValineME4300886287C001832479-
valylglutamineVal-GlnME4300895253209-1484-
valylglycineVal-GlyME430090136487-1506-
valylleucineVal-LeuME430091352039-3138-
xanthineXanthineME4300921188C003851032-
xanthosineXanthosineME43009364959C017621075-
ximenoylcarnitine (C26:1)*CAR 26:1ME430094--1607-


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