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Analysis: Reversed phase NEGATIVE 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 acidME2765505312435---
10-hydroxystearateRosilic acidME2765519561835---
10-nonadecenoate (19:1n9)Nonadeca-10Z-enoic acidME2765525312513---
1-(1-enyl-oleoyl)-2-oleoyl-GPE (P-18:1/18:1)PE P-18:1/18:1ME276526----
1-(1-enyl-oleoyl)-GPE (P-18:1)LPE P-18:1 or LPE O-18:2ME276527----
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20...PC P-16:0/20:4 or PC O-16:1/20:4ME276528----
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20...PE P-16:0/20:4 or PE O-16:1/20:4ME276529----
1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2)PC P-16:0/18:2 or PC O-16:1/18:2ME276530----
1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)PE P-16:0/18:2 or PE O-16:1/18:2ME276531----
1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1)PC P-16:0/18:1 or PC O-16:1/18:1ME276532----
1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)PE P-16:0/18:1 or PE O-16:1/18:1ME276533----
1-(1-enyl-palmitoyl)-GPC (P-16:0)LPC P-16:0 or LPC O-16:1ME27653410917802---
1-(1-enyl-palmitoyl)-GPE (P-16:0)LPE P-16:0 or LPE O-16:1ME276535----
1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:...PE P-18:0/20:4 or PE O-18:1/20:4ME2765369547058---
1-(1-enyl-stearoyl)-2-oleoyl-GPE (P-18:0/18:1)PE P-18:0/18:1 or PE O-18:1/18:1ME276537----
1-(1-enyl-stearoyl)-GPE (P-18:0)LPE P-18:0 or LPE O-18:1ME276538----
1,1-kestotetraose-ME276540166775---
12,13-DiHOME12,13-DiHOMEME27655410236635C14829--
12(13)-EpOME12(13)-EpOMEME2765535283014C14826--
1,2,3-benzenetriol sulfate (2)-ME276541----
12-dehydrocholate12-Ketochenodeoxycholic acidME27655594235---
1,2-dilinolenoyl-digalactosylglycerol (18:3/18:3)-ME276542----
1,2-dilinolenoyl-galactosylglycerol (18:3/18:3)MGDG 18:3/0:0/18:3ME2765435282287C13871--
1,2-dilinoleoyl-digalactosylglycerol (18:2/18:2)-ME276544----
1,2-dilinoleoyl-galactosylglycerol (18:2/18:2)-ME2765456535011---
1,2-dilinoleoyl-GPC (18:2/18:2)PC 18:2/18:2ME2765465288075---
1,2-dilinoleoyl-GPE (18:2/18:2)PE 18:2/18:2ME2765479546812---
1,2-dipalmitoyl-GPC (16:0/16:0)PC 16:0/16:0ME276548452110---
(12 or 13)-methylmyristate (a15:0 or i15:0)Isopentadecylic acidME276512151014---
1-(3-aminopropyl)-2-pyrrolidone-ME27653982111---
13-HODE + 9-HODEHODEME27655643013---
(14 or 15)-methylpalmitate (a17:0 or i17:0)Methylpalmitic acidME27651317903417---
1,5-anhydroglucitol (1,5-AG)1,5-AnhydrosorbitolME27654964960C07326--
16-hydroxypalmitateJuniperic acidME27655710466C18218--
(16 or 17)-methylstearate (a19:0 or i19:0)Methyloctadecanoic acidME2765143083779---
1-arachidonylglycerol (20:4)MG 20:4ME2765585282281C13857--
1-carboxyethylphenylalanine1-CarboxyethylphenylalanineME276559----
1-carboxyethylvaline1-CarboxyethylvalineME276560----
1-cerotoyl-GPC (26:0)LPC 26:0/0:0ME276561----
1-dihomo-linolenylglycerol (20:3)MG 20:3/0:0/0:0ME276562----
1-dihomo-linoleoylglycerol (20:2)MG 20:2ME276563----
1-docosahexaenoylglycerol (22:6)MG 22:6ME276564----
1-eicosapentaenoylglycerol (20:5)MG 20:5ME276565----
1-heptadecenoylglycerol (17:1)MG 17:1/0:0/0:0ME276566----
1-kestose1-KestoseME276567440080C03661--
1-lignoceroyl-GPC (24:0)LPC 24:0/0:0ME276568----
1-linolenoylglycerol (18:3)MG 18:3ME27656953480978---
1-linolenoyl-GPC (18:3)LPC 18:3ME276570----
1-linoleoyl-2-arachidonoyl-GPC (18:2/20:4n6)PC 18:2/20:4ME276571----
1-linoleoyl-2-linolenoyl-digalactosylglycerol (18:...DGDG 18:2_18:3ME276572----
1-linoleoyl-2-linolenoyl-galactosylglycerol (18:2/...MGDG 18:2_18:3ME276573----
1-linoleoyl-2-linolenoyl-GPC (18:2/18:3)PC 18:2/18:3ME276574----
1-linoleoyl-galactosylglycerol (18:2)-ME2765755320254---
1-linoleoylglycerol (18:2)MG 18:2ME2765765283469---
1-linoleoyl-GPC (18:2)LPC 18:2/0:0ME27657711988421C04100--
1-linoleoyl-GPE (18:2)LPE 18:2/0:0ME27657852925130---
1-linoleoyl-GPG (18:2)LPG 18:2/0:0ME276579----
1-linoleoyl-GPI (18:2)LPI 18:2/0:0ME276580----
1-margaroylglycerol (17:0)MG 17:0ME276581107036---
1-methyl-4-imidazoleacetateMethylimidazoleacetic acidME27658275810C05828--
1-methyladenine1-MethyladenineME27658378821C02216--
1-methyladenosine1-MethyladenosineME27705827476C02494--
1-methylguanidineMethylguanidineME27658410111C02294--
1-methylguanosine1-MethylguanosineME27705996373---
1-methylhistamine1-MethylhistamineME2765853614C05127--
1-methylnicotinamide1-Methyl nicotinamideME27658610129985C02918--
1-myristoyl-2-palmitoyl-GPC (14:0/16:0)PC 14:0/16:0ME276587129657---
1-myristoylglycerol (14:0)MG 16:3ME27658879050C01885--
1-oleoyl-2-linoleoyl-GPC (18:1/18:2)PC 18:1_18:2ME276589----
1-oleoyl-2-linoleoyl-GPE (18:1/18:2)PE 18:1/18:2ME2765909546753---
1-oleoylglycerol (18:1)MG 18:1/0:0/0:0ME2765915283468---
1-oleoyl-GPC (18:1)LPC 18:1/0:0ME27659216081932---
1-oleoyl-GPE (18:1)LPE 18:1/0:0ME2765939547071---
1-oleoyl-GPG (18:1)LPG 18:1/0:0ME276594----
1-oleoyl-GPI (18:1)LPI 18:1/0:0ME276595----
1-palmitoleoylglycerol (16:1)MG 16:1ME276596----
1-palmitoleoyl-GPC (16:1)LPC 16:1/0:0ME27659724779461---
1-palmitoyl-2-alpha-linolenoyl-GPC (16:0/18:3n3)PC 16:0_18:3ME276598----
1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6)PC 16:0/20:4ME27659910747814---
1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4)PE 16:0/20:4ME2766009546800---
1-palmitoyl-2-docosahexaenoyl-GPC (16:0/22:6)PC 16:0/22:6ME2766016441886---
1-palmitoyl-2-docosahexaenoyl-GPE (16:0/22:6)PE 16:0/22:6ME2766029546799---
1-palmitoyl-2-linolenoyl-digalactosylglycerol (16:...DGDG 16:0_18:3ME276603----
1-palmitoyl-2-linolenoyl-galactosylglycerol (16:0/...MGDG 16:0_18:3ME276604----
1-palmitoyl-2-linoleoyl-digalactosylglycerol (16:0...DGDG 16:0_18:2ME276605----
1-palmitoyl-2-linoleoyl-galactosylglycerol (16:0/1...MGDG 16:0_18:2ME276606----
1-palmitoyl-2-linoleoyl-GPC (16:0/18:2)PC 16:0/18:2ME2766075287971---
1-palmitoyl-2-linoleoyl-GPE (16:0/18:2)PE 16:0/18:2ME2766089546747---
1-palmitoyl-2-linoleoyl-GPI (16:0/18:2)PI 16:0/18:2ME276609----
1-palmitoyl-2-oleoyl-GPC (16:0/18:1)PC 16:0/18:1ME2766106436017---
1-palmitoyl-2-oleoyl-GPE (16:0/18:1)PE 16:0/18:1ME2766115283496---
1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)PC 16:0/16:1ME276612----
1-palmitoyl-2-stearoyl-GPC (16:0/18:0)PC 16:0/18:0ME276613----
1-palmitoyl-digalactosylglycerol (16:0)-ME276614----
1-palmitoyl-galactosylglycerol (16:0)1-Palmitoyl-galactosylglycerolME27661510413348---
1-palmitoylglycerol (16:0)MG 16:0/0:0/0:0ME27661614900---
1-palmitoyl-GPA (16:0)LPA 16:0/0:0ME2766176419701C04036--
1-palmitoyl-GPC (16:0)LPC 16:0/0:0ME27661886554---
1-palmitoyl-GPE (16:0)LPE 16:0/0:0ME2766199547069---
1-palmitoyl-GPG (16:0)LPG 16:0/0:0ME2766203300276---
1-palmitoyl-GPI (16:0)LPI 16:0/0:0ME276621----
1-pentadecanoylglycerol (15:0)MG 15:0ME276622190750---
1-ribosyl-imidazoleacetateImidazoleacetic acid ribosideME2766235117448C05131--
1-stearoyl-2-arachidonoyl-GPC (18:0/20:4)PC 18:0/20:4ME27662416219824---
1-stearoyl-2-arachidonoyl-GPE (18:0/20:4)PE 18:0/20:4ME2766255289133---
1-stearoyl-2-arachidonoyl-GPI (18:0/20:4)PI 18:0/20:4ME276626----
1-stearoyl-2-docosahexaenoyl-GPC (18:0/22:6)PC 18:0/22:6ME276627----
1-stearoyl-2-docosahexaenoyl-GPE (18:0/22:6)PE 18:0/22:6ME2766289546798---
1-stearoyl-2-oleoyl-GPC (18:0/18:1)PC 18:0/18:1ME276629----
1-stearoyl-GPC (18:0)LPC 18:0/0:0ME276630497299---
1-stearoyl-GPE (18:0)LPE 18:0/0:0ME2766319547068---
1-stearoyl-GPG (18:0)LPG 18:0/0:0ME276632----
1-stearoyl-GPI (18:0)LPI 18:0/0:0ME276633----
1-stearoyl-GPS (18:0)LPS 18:0/0:0ME2766349547101---
2,3-dihydroxyisovalerate2,3-Dihydroxyisovaleric acidME276635677C04039--
2,4,6-trihydroxybenzoate2,4,6-Trihydroxybenzoic acidME27663666520---
2,8-quinolinediolQuinoline-2,8-diolME27663797250C06342--
2,8-quinolinediol sulfate-ME276638----
2-acetamidophenol sulfate2-Acetamidophenol sulfateME276639181671---
2-aminoadipatealpha-Aminoadipic acidME276640469C00956--
2-amino-p-cresol sulfate-ME276641----
2-aminophenol sulfate2-Aminophenyl sulfateME276642181670---
2'-deoxyadenosineDeoxyadenosineME27664313730C00559--
2'-deoxycytidineDeoxycytidineME27664413711C00881--
2'-deoxyguanosineDeoxyguanosineME276645187790C00330--
2'-deoxyinosineDeoxyinosineME27664665058C05512--
2'-deoxyuridineDeoxyuridineME27664713712C00526--
2-docosahexaenoylglycerol (22:6)MG 22:6ME276648----
2-eicosapentaenoylglycerol (20:5)MG 0:0/20:5/0:0ME27664911660820---
2-hydroxy-3-methylvalerate2-Hydroxy-3-methyl-pentanoic acidME276650164623---
2-hydroxyadipate2-Hydroxyadipic acidME276651193530C02360--
2-hydroxyarachidate2-Hydroxyeicosanoic acidME2766525225199---
2-hydroxybehenate2-Hydroxy behenic acidME276653193484---
2-hydroxybutyrate/2-hydroxyisobutyrate2-Hydroxybutyric acid/2-Hydroxyisobutyric acidME276654----
2-hydroxydecanoate2-Hydroxycapric acidME27665521488---
2-hydroxyglutarate2-Hydroxyglutaric acidME27665643C02630--
2-hydroxyheptanoate2-Hydroxy enanthoic acidME2766572750949---
2-hydroxyhippurate (salicylurate)Salicyluric acidME27665810253C07588--
2-hydroxylignocerateCerebronic acidME276659102430C17873--
2-hydroxypalmitate2-Hydroxypalmitic acidME27666092836---
2-hydroxyphenylacetate2-Hydroxyphenylacetic acidME27666111970C05852--
2-hydroxyquinoline2-HydroxyquinolineME2766626038C06415--
2-hydroxystearate2-Hydroxystearic acidME27666369417C03045--
2-isopropylmalate2-Isopropylmalic acidME27666477C02504--
2-keto-3-deoxy-gluconate2-Dehydro-3-deoxy-D-gluconic acidME276665161227C00204--
2-linoleoylglycerol (18:2)MG 18:2ME2766665365676---
2-methylbutyrylcarnitine (C5)CAR 4:0;2MeME2766676426901---
2-methylbutyrylglycine (C5)2-MethylbutyrylglycineME276668193872---
2-methylcitrate/homocitrateHomocitric acidME276669----
2-myristoylglycerol (14:0)MG 0:0/14:0/0:0ME276670137938---
2-oleoylglycerol (18:1)MG 0:0/18:1(9Z)/0:0ME2766715319879---
2'-O-methylcytidine2'-O-MethylcytidineME276672150971---
2'-O-methyluridine2'-O-MethyluridineME276673102212---
2-oxindole-3-acetate2-Oxindole-3-acetateME2766743080590---
2-oxoadipateOxoadipic acidME27667571C00322--
2-oxoarginine2-OxoarginineME276676558C03771--
2-palmitoleoylglycerol (16:1)MG 16:1ME276677----
2-palmitoyl-galactosylglycerol (16:0)-ME276678----
2-palmitoylglycerol (16:0)MG 0:0/16:0/0:0ME276679123409---
2-palmitoyl-GPC (16:0)LPC 0:0/16:0ME27668015061532---
2-stearoyl-GPE (18:0)LPE 0:0/18:0ME276681----
3-(3-hydroxyphenyl)propionate3-(3-Hydroxyphenyl)propanoic acidME27668291C11457--
3-(3-hydroxyphenyl)propionate sulfate3-(3-Sulfooxyphenyl)propanoic acidME276683187488---
3-(4-hydroxyphenyl)lactate (HPLA)4-Hydroxyphenyllactic acidME2766849378C03672--
3-(4-hydroxyphenyl)propionateDesaminotyrosineME27668510394C01744--
3,4-methylene heptanoylglycine-ME276686----
(3'-5')-adenylyluridineApUME276515112074---
(3'-5')-cytidylyladenosineCpAME27651691519---
(3'-5')-cytidylylcytidineCpCME27651794237---
(3'-5')-cytidylylguanosineCpGME27651865101---
(3'-5')-cytidylyluridineCpUME276519----
3,5-dihydroxybenzoic acid3,5-Dihydroxybenzoic acidME2766877424---
(3'-5')-guanylylcytidineGpCME276520107595---
(3'-5')-guanylyluridineGpUME276521----
(3'-5')-uridylylcytidineUpCME276522----
(3'-5')-uridylylguanosineUpGME276523107394---
(3'-5')-uridylyluridineUpUME276524102258---
3-acetylphenol sulfate3-Acetylphenol sulfateME276688----
3-aminoisobutyrate3-Aminoisobutanoic acidME27668964956C05145--
3'-AMP3'-AMPME27675941211C01367--
3b-hydroxy-5-cholenoic acid3beta-Hydroxy-5-cholenoic acidME27669092997---
3-dehydrocholate3-Dehydrocholic acidME276691159655---
3-dehydroshikimate3-DehydroshikimateME27669280C02637--
3-deoxyoctulosonate-ME2766934636210---
3-hydroxy-3-methylglutarate3-Hydroxymethylglutaric acidME2766941662C03761--
3-hydroxyadipate3-Hydroxy-adipic acidME276695151913---
3-hydroxyarachidate3-Hydroxyeicosanoic acidME2766965282918---
3-hydroxybehenate3-Hydroxy behenic acidME2766975282921---
3-hydroxybutyrate (BHBA)3-Hydroxybutyric acidME276698441C01089--
3-hydroxybutyrylcarnitine (2)CAR 4:0;3OHME276699----
3-hydroxyhexanoate3S-Hydroxyhexanoic acidME276700151492---
3-hydroxypalmitate3-Hydroxyhexadecanoic acidME276701301590---
3-hydroxyphenylacetate3-Hydroxyphenylacetic acidME27670212122C05593--
3-hydroxypyridine sulfate3-Hydroxypyridine sulfateME276703----
3-hydroxysebacate3-Hydroxysebacic acidME2767043017884---
3-hydroxysuberate3-Hydroxysuberic acidME27670522328017---
3-indoxyl sulfateIndoxyl sulfateME27670610258---
3-ketosphinganine3-KetosphinganineME276707631C02934--
3-methyl-2-oxobutyrateKetoisovaleric acidME27670849C00141--
3-methyl-2-oxovalerate3-Methyl-2-oxovaleric acidME27670947C00671--
3-methyladipate3-Methyladipic acidME27671012292---
3-methylglutaconate3E-Methylglutaconic acidME2767111551553---
3-phenylpropionate (hydrocinnamate)Hydrocinnamic acidME276712107C05629--
3-sulfo-L-alanineCysteic acidME27671372886C00506--
3-ureidoisobutyrateUreidoisobutyric acidME276714160663C05100--
3-ureidopropionateUreidopropionic acidME276715111C02642--
4-acetamidobutanoate4-Acetamidobutanoic acidME27671618189C02946--
4-acetylphenyl sulfate4-Acetylphenyl sulfateME2767174684006---
4-cholesten-3-oneCholestenoneME27671891477C00599--
4-ethylphenyl sulfate4-EthylphenolME276719-C13637--
4-guanidinobutanoate4-Guanidinobutanoic acidME276720500C01035--
4-hydroxycinnamatecis-p-Coumaric acidME276721637542C00811--
4-hydroxycinnamate sulfate4-Hydroxycinnamate sulfateME2767226070438---
4-hydroxyhippurate4-Hydroxyhippuric acidME276723151012---
4-hydroxymandelate4-Hydroxymandelic acidME276724328C03198--
4-hydroxyphenylacetate4-Hydroxyphenyl acetateME276725127C00642--
4-hydroxyphenylpyruvate4-Hydroxyphenylpyruvic acidME276726979C01179--
4-imidazoleacetateImidazoleacetic acidME27672796215C02835--
4-methyl-2-oxopentanoateKetoleucineME27672870C00233--
4-methylcatechol sulfate-ME276729----
4-methylthio-2-oxobutanoate2-Oxo-4-methylthiobutanoic acidME276730473C01180--
4-vinylphenol sulfate4-HydroxystyreneME2767316426766C05627--
5-(2-Hydroxyethyl)-4-methylthiazole5-(2-Hydroxyethyl)-4-methylthiazoleME2767321136C04294--
5,6-dihydrouridine5,6-DihydrouridineME27673394312---
5-aminovalerate5-Aminopentanoic acidME276734138C00431--
5-dodecenoylcarnitine (C12:1)CAR 12:1(5)ME276735----
5-hydroxyhexanoate5-Hydroxycaproic acidME276736170748---
5-hydroxyindoleacetate5-Hydroxyindoleacetic acidME2767371826C05635--
5-hydroxylysine5-HydroxylysineME2767381029C16741--
5-methyl-2'-deoxycytidine5-Methyl-2'-deoxycytidineME276739440055C03592--
5-methylcytidine5-MethylcytidineME27674092918---
5-methylcytosine5-MethylcytosineME27674165040C02376--
5-methylthioadenosine (MTA)5'-MethylthioadenosineME276742439176C00170--
5-methyluridine (ribothymidine)RibothymidineME276743445408---
5-oxoprolinePyroglutamic acidME2767447405C01879--
6-beta-hydroxylithocholateMurideoxycholic acidME2767455283821C15515--
6-hydroxynicotinate6-Hydroxynicotinic acidME27674672924C01020--
6-oxolithocholate6-Ketolithocholic acidME276747164960---
6-oxopiperidine-2-carboxylate6-oxopiperidine-2-carboxylic acidME2767483014237---
7-HOCA7alpha-Hydroxy-3-oxo-4-cholestenoic acidME2767493081085C17337--
7-hydroxycholesterol (alpha or beta)7beta-HydroxycholesterolME276750107722---
7-ketodeoxycholate7-Ketodeoxycholic acidME276751188292---
7-ketolithocholate7-Ketolithocholic acidME276752444262---
7-methylguanine7-MethylguanineME27675311361C02242--
9,10-DiHOME9,10-DiHOMEME2767549966640C14828--
acetylcarnitine (C2)CAR 2:0ME2767551C02571--
aconitate [cis or trans]cis-Aconitic acidME276756----
adenineAdenineME276757190C00147--
adenosineAdenosineME27675860961C00212--
adenosine-2',3'-cyclic monophosphate2',3' cyclic AMPME2767612024C02353--
adipateAdipic acidME276762196C06104--
adipoylcarnitine (C6-DC)CAR DC5:0ME27676371296139---
adrenate (22:4n6)Adrenic acidME2767645497181C16527--
afromosinAfrormosinME2767655281704C10199--
agmatineAgmatineME276766199C00179--
alanineAlanineME2767675950C00041--
alanylleucineAla-LeuME276768259583---
allantoic acidAllantoic acidME276769203C00499--
allantoinAllantoinME276770204C02350--
allo-threonineAllothreonineME27677199289C05519--
alpha-hydroxyisocaproate2-Hydroxyisocaproic acidME27677283697C03264--
alpha-hydroxyisovalerate2-Hydroxy-3-methylbutyric acidME27677399823---
alpha-ketoglutaramate2-Keto-glutaramic acidME276774----
alpha-ketoglutarate2-Oxoglutaric acidME27677551C00026--
alpha-muricholatealpha-Muricholic acidME2767763083761C17647--
alpha-tocopherolalpha-TocopherolME27677714985C02477--
alpha-tocopherol acetateTocopherol acetateME2767782117C13202--
alpha-tocotrienolalpha-TocotrienolME2767795282347C14153--
AMPAMPME2767606083C00020--
anserineAnserineME276780112072C01262--
anthranilate2-Aminobenzoic acidME276781227C00108--
apigeninApigeninME2767825280443C01477--
apigenin 7-O(6-malonyl-beta-D-glucoside)Apigenin 7-O-(6-malonyl-beta-D-glucoside)ME2767835281602C10020--
arabinoseArabinoseME27678466308C00216--
arabitol/xylitolArabitolME2767856912C01904--
arabonate/xylonateArabinonic acid/Xylonic acidME276786----
arachidate (20:0)Arachidic acidME27678710467C06425--
arachidonate (20:4n6)Arachidonic acidME276788444899C00219--
arachidonoylcarnitine (C20:4)CAR 20:4ME276790----
arachidonoyl ethanolamideArachidonoyl-EAME2767895281969C11695--
arachidoylcarnitine (C20)CAR 20:0ME276791----
argininateArgininic acidME276792160437---
arginineArginineME276793232C00062--
asparagineAsparagineME2767946267C00152--
aspartateAspartic acidME2767955960C00049--
azelate (nonanedioate; C9)Azelaic acidME2767962266C08261--
behenoyl ethanolamide (22:0)Behenoyl-EAME2767973023585---
benzoateBenzoic acidME276798243C00180--
beta-alaninebeta-AlanineME276799239C00099--
beta-citrylglutamateBeta-Citryl-glutamic acidME27680072715786C20775--
beta-cryptoxanthinCryptoxanthinME2768016384256---
beta-guanidinopropanoate3-Guanidinopropanoic acidME27680267701C03065--
beta-hydroxyisovalerate3-Hydroxyisovaleric acidME27680369362---
betaineBetaineME276804247C00719--
beta-muricholatebeta-Muricholic acidME2768055283853C17726--
beta-sitosterolSitosterolME276806222284C01753--
betonicineBetonicineME276807164642C08269--
bilirubinBilirubinME2768095280352C00486--
bilirubin (E,E)BilirubinME2768085315454---
biliverdinBiliverdinME2768105353439C00500--
biopterinBiopterinME276811445040C06313--
biotinBiotinME276812171548C00120--
butyrylglycine (C4)N-ButyrylglycineME27681388412---
caffeic acid sulfate-ME276814----
campesterolCampesterolME276815173183C01789--
caproate (6:0)Caproic acidME2768168892C01585--
caprylate (8:0)Caprylic acidME276817379C06423--
carboxyethyl-GABAN-Carboxyethyl-gamma-aminobutyric acidME2768182572---
carnitineCarnitineME27681910917C00318--
carotene diol (1)Carotene diolME276820----
carotene diol (2)Carotene diolME276821----
carotene diol (3)Carotene diolME276822----
catechol sulfateCatechol sulfateME2768233083879---
ceramide (d18:1/14:0, d16:1/16:0)Cer 36:1;O2ME276824----
ceramide (d18:1/17:0, d17:1/18:0)Cer 35:1;O2ME276825----
ceramide (d18:1/20:0, d16:1/22:0, d20:1/18:0)Cer 38:1;O2ME276826----
ceramide (d18:2/24:1, d18:1/24:2)Cer 42:3;O2ME276827----
chiro-inositol1D-chiro-InositolME276828-C19891--
cholateCholic acidME276829221493C00695--
cholesterolCholesterolME27683011025495C00187--
cholineCholineME276831305C00114--
chrysoeriolChrysoeriolME2768335280666C04293--
citrateCitric acidME276834311C00158--
citrullineCitrullineME2768359750C00327--
CMPCMPME2768466131C00055--
creatineCreatineME276836586C00300--
creatinineCreatinineME276837588C00791--
cystathionineCystathionineME276838439258C02291--
cysteineCysteineME2768395862C00097--
cysteine s-sulfateCysteine-S-sulfateME276840115015C05824--
cysteine sulfinic acid3-Sulfino-alanineME276841109C00606--
cysteinylglycineCys-GlyME276842439498C01419--
cystineCystineME27684367678C00491--
cytidineCytidineME2768446175C00475--
cytidine 2' or 3'-monophosphate (2' or 3'-CMP)-ME276845----
cytosineCytosineME276847597C00380--
daidzeinDaidzeinME2768485281708C10208--
daidzein 7-O-glucuronideDaidzein 7-O-glucuronideME27684911316354---
daidzein sulfate (1)-ME276850----
daidzein sulfate (2)-ME276851----
daidzinDaidzinME276852107971C10216--
decanoylcarnitine (C10)CAR 10:0ME27685310245190---
dehydrolithocholateDehydrolithocholic acidME276854159623---
delta-tocopheroldelta-TocopherolME27685592094C14151--
deoxycarnitine3-DehydroxycarnitineME276856134C01181--
deoxycholateDeoxycholic acidME276857222528C04483--
diacetylchitobioseN,N'-DiacetylchitobioseME276858439544C01674--
diacetylspermidine-ME276859----
diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1])DG 34:3ME276860----
diaminopimelate2,6-Diaminopimelic acidME276861439283C00666--
digalactosylglycerolGalactosylglycerolME276862----
dihomolinoleate (20:2n6)11Z,14Z-Eicosadienoic acidME2768636439848C16525--
dihomolinolenate (20:3n3 or 3n6)Eicosatrienoic acidME2768645280581C03242--
dihomo-linolenoylcarnitine (C20:3n3 or 6)CAR 20:3ME276865----
dihomo-linoleoylcarnitine (C20:2)CAR 20:2ME276866----
dihydrobiopterin4a-Carbinolamine tetrahydrobiopterinME2768671879C00268--
dihydrocaffeate3,4-Dihydroxyhydrocinnamic acidME276868348154C10447--
dihydroferulateDihydroferulic acidME27686914340---
dihydroorotate4,5-Dihydroorotic acidME276870648C00337--
dimethylarginine (ADMA + SDMA)DimethylarginineME276871123831C03626--
dimethylglycineDimethylglycineME276872673C01026--
diosmetinDiosmetinME2768735281612C10038--
docosadienoate (22:2n6)13Z,16Z-Docosadienoic acidME2768745282807C16533--
docosadioate (C22-DC)Docosanedioic acidME276875244872C19625--
docosahexaenoate (DHA; 22:6n3)LPC 22:6ME276876445580C06429--
docosahexaenoylcarnitine (C22:6)CAR 22:6ME276877----
docosapentaenoate (DPA; 22:5n3)DPAME2768786441454C16513--
docosapentaenoate (n6 DPA; 22:5n6)Docosapentaenoic acid (22n-6)ME2768796441454C16513--
docosatrienoate (22:3n6)Docosatrienoic acidME276880----
dodecanedioate (C12)Dodecanedioic acidME27688112736C02678--
dodecenedioate (C12:1-DC)Traumatic acidME276882----
D-urobilinD-UrobilinME2768836276321C05795--
ectoineEctoineME276884126041C06231--
eicosanoylsphingosine (d20:1)C20 SphingosineME276885----
eicosapentaenoate (EPA; 20:5n3)Eicosapentaenoic acidME276886446284C06428--
eicosenoate (20:1n9 or 1n11)cis-Gondoic acidME2768875282768C16526--
eicosenoylcarnitine (C20:1)CAR 20:1ME276888----
enterodiolEnterodiolME276889123725---
enterolactoneEnterolactoneME27689010685477---
equolEquolME27689191469C14131--
equol sulfate-ME276892----
ergosterolErgosterolME276893444679C01694--
ergothioneineErgothioneineME2768943032311C05570--
erucate (22:1n9)cis-Erucic acidME2768955281116C08316--
erythritolErythritolME276896222285C00503--
erythronateErythronic acidME2768972781043---
erythroseErythroseME27689894176C01796--
ethyl glucuronideEthyl glucuronideME276899152226---
ethylmalonateEthylmalonic acidME27690011756---
ferulatetrans-Ferulic acidME276901445858C01494--
ferulic acid 4-sulfateFerulic acid 4-sulfateME2769026305574---
feruloylputrescineSubaphyllineME2769035281796C10497--
ferulylglycine (1)-ME276904----
ferulylglycine (2)-ME276905----
formiminoglutamateFormiminoglutamic acidME276906439233C00439--
formononetinFormononetinME2769075280378C00858--
fructoseFructoseME2769085984C00095--
fucitolFucitolME2769093429---
fucoseFucoseME27691019466C01018--
fumarateFumaric acidME276911444972C00122--
galactinolGalactinolME276912439451C01235--
galactonateGalactonic acidME276913128869C00880--
galactosylglycerolGalactosylglycerolME27691416048618C05401--
gamma-glutamyl-alpha-lysinegamma-GlutamyllysineME27691565254---
gamma-glutamyl-epsilon-lysineEpsilon-(gamma-Glutamyl)-lysineME2769167015685---
gamma-glutamylglutaminegamma-GlutamylglutamineME276917150914C05283--
gamma-glutamylglycinegamma-GlutamylglycineME276918165527---
gamma-glutamylhistidinegamma-GlutamylhistidineME2769197017195---
gamma-glutamylisoleucinegamma-GlutamylisoleucineME27692014253342---
gamma-glutamylleucinegamma-GlutamylleucineME276921151023---
gamma-glutamylmethioninegamma-GlutamylmethionineME2769227009567---
gamma-glutamylphenylalaninegamma-GlutamylphenylalanineME276923111299---
gamma-glutamylthreoninegamma-GlutamylthreonineME27692476078708---
gamma-glutamyltryptophangamma-GlutamyltryptophanME2769253989307---
gamma-glutamyltyrosinegamma-GlutamyltyrosineME27692694340---
gamma-tocopherol/beta-tocopherolbeta-tocopherolME276927----
gamma-tocotrienolgamma-TocotrienolME2769285282349C14155--
genisteinGenisteinME2769295280961C06563--
genistein sulfate-ME276930----
gentisateGentisic acidME2769313469C00628--
gluconateGluconic acidME27693210690C00257--
glucoseGlucoseME27693379025C00031--
glucuronateGlucuronic acidME276934444791C00191--
glutamateGlutamic acidME276935611C00025--
glutamate, gamma-methyl esterGlutamic acid, gamma-methyl esterME27693668662---
glutamineGlutamineME2769375961C00064--
glutaminylleucineGln-LeuME276938----
glutarate (C5-DC)Glutaric acidME276939743C00489--
glutaroylcarnitine (C5)CAR DC5:0ME27694071464488---
glycerateGlyceric acidME276941752C00258--
glycerolGlycerolME276942753C00116--
glycerol 3-phosphatesn-Glycero-3-phosphateME276943754C00093--
glycerophosphoethanolaminesn-Glycero-3-phosphoethanolamineME276944123874C01233--
glycerophosphoglycerolsn-Glycero-3-phosphoglycerolME276945439964C03274--
glycerophosphoinositolsn-Glycero-3-phosphoinositolME276946167572---
glycerophosphorylcholine (GPC)sn-Glycero-3-phosphocholineME27694771920C00670--
glycerophosphoserinesn-Glycero-3-phosphoserineME2769483081457---
glycineGlycineME276949750C00037--
glyciteinGlyciteinME2769505317750C14536--
glyco-beta-muricholateGlyco-beta-muricholic acidME276951----
glycocholateGlycocholic acidME27695210140C01921--
glycosyl-N-palmitoyl-sphingosine (d18:1/16:0)HexCer 18:1;O2/16:0ME276953----
glycylisoleucineGly-IleME27695488079---
glycylleucineGly-LeuME27695592843C02155--
glycylvalineGly-ValME27695697417---
guanidinoacetateGuanidoacetic acidME276957763C00581--
guanineGuanineME276958764C00242--
guanosineGuanosineME2769596802C00387--
guanosine-2',3'-cyclic monophosphate2',3' cyclic GMPME27696092823C06194--
gulonateGulonic acidME2769619794176C00257--
heneicosapentaenoate (21:5n3)Heneicosapentaenoic acidME27696211998573---
heptadecasphingosine (d17:1)C17 SphingosineME2769635283557---
heptanoate (7:0)Heptylic acidME2769648094C17714--
hexadecadienoate (16:2n6)Hexadecadienoic acidME276965----
hexadecanedioate (C16)Hexadecanedioic acidME27696610459C19615--
hexadecasphinganine (d16:0)C16 SphinganineME276967656816C13915--
hexadecasphingosine (d16:1)C16 SphingosineME276968----
hexadecatrienoate (16:3n3)7,10,13-Hexadecatrienoic acidME2769695312428---
hexadecenedioate (C16:1-DC)-ME276970----
hexanoylcarnitine (C6)CAR 6:0ME2769716426853---
hexanoylglycine (C6)HexanoylglycineME27697299463---
hippurateHippuric acidME276973464C01586--
histamineHistamineME276974774C00388--
histidineHistidineME2769756274C00135--
histidine betaine (hercynine)HercynineME2769763083620---
histidylalanineHis-AlaME276977351667---
homocitrullineHomocitrullineME27697865072C02427--
homostachydrine(S)-HomostachydrineME276979441447C08283--
hydroxymethylpyrimidine4-Amino-5-hydroxymethyl-2-methylpyrimidineME276980777C01279--
hydroxyprolineHydroxyprolineME2772715810C01157--
hyocholateHyocholic acidME27698192805C17649--
hypotaurineHypotaurineME276982107812C00519--
hypoxanthineHypoxanthineME276983790C00262--
imidazole lactateImidazolelactic acidME276984440129C05568--
imidazole propionateImidazole propanoateME27698570630---
indoleIndoleME276986798C00463--
indole-3-carboxylateIndole-3-carboxylic acidME27698769867C19837--
indoleacetateIndoleacetic acidME276988802C00954--
indoleacetylglycineN-IndoleacetylglycineME276989446640---
indolelactateIndolelactic acidME27699092904C02043--
indolepropionate3-Indolepropionic acidME2769913744---
indolepropionylglycineIndolepropionylglycineME2769927677842---
indolin-2-oneIndolin-2-oneME276993321710C12312--
inosineInosineME2769946021C00294--
isobutyrylglycine (C4)IsobutyrylglycineME27699510855600---
isohyodeoxycholateIsohyodeoxycholic acidME2769965283822---
isoleucineIsoleucineME2769976306C00407--
isoleucylglycineIle-GlyME276998342532---
isovalerate (C5)Isovaleric acidME27699910430C08262--
isovalerylcarnitine (C5)CAR 4:0;3MeME2770006426851---
isovalerylglycineIsovalerylglycineME277001546304---
I-urobilinogenMesobilirubinogenME27700226818C05790--
kynurenateKynurenic acidME2770033845C01717--
lactateLactic acidME277004612C00186--
laurylcarnitine (C12)CAR 12:0ME27700510427569---
leucineLeucineME2770066106C00123--
leucylalanineLeu-AlaME277007259321---
leucylglutamineLeu-GlnME2770084305457---
leucylglycineLeu-GlyME27700979070---
lignoceroyl ethanolamide (24:0)-ME277010----
linoleate (18:2n6)Linoleic acidME2770115280450C01595--
linolenate (18:3n3 or 3n6)Octadecatrienoic acidME2770125280934C06426--
linolenoylcarnitine (C18:3)CAR 18:3ME277013----
linolenoyl-linolenoyl-glycerol (18:3/18:3) [1]DG 18:3_18:3ME277014----
linolenoyl-linolenoyl-glycerol (18:3/18:3) [2]DG 18:3_18:3ME277015----
linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]DG 18:2_20:4ME277017----
linoleoylcarnitine (C18:2)CAR 18:2ME2770186450015---
linoleoylcholinealpha-LinoleoylcholineME277019----
linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [1]DG 18:2_22:6ME277020----
linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [2]DG 18:2_22:6ME277021----
linoleoyl ethanolamideLinoleoyl-EAME2770165283446---
linoleoyl-linolenoyl-glycerol (18:2/18:3) [1]DG 18:2_18:3ME277022----
linoleoyl-linolenoyl-glycerol (18:2/18:3) [2]DG 18:2_18:3ME277023----
linoleoyl-linoleoyl-glycerol (18:2/18:2) [1]DG 18:2_18:2ME277024----
linoleoyl-linoleoyl-glycerol (18:2/18:2) [2]DG 18:2_18:2ME277025----
lithocholateLithocholic acidME2770269903C03990--
lysineLysineME2770275962C00047--
lysylleucineLys-LeuME2770284682588---
malateMalic acidME277029525C00149--
maleateMaleic acidME277030444266C01384--
malonateMalonic acidME277031867C00383--
malonylcarnitineCAR DC3:0ME27703222833583---
mannitol/sorbitolSorbitolME2770335780C00794--
mannoseMannoseME27703418950C00159--
margarate (17:0)Margaric acidME27703510465---
margaroylcarnitine (C17)CAR 17:0ME277037----
margaroyl ethanolamideMargaroyl-EAME277036----
mead acid (20:3n9)ETrE(5Z,8Z,11Z)ME2770385312531---
methionineMethionineME2770396137C00073--
methionine sulfoneMethionine sulfoneME27704069961---
methionine sulfoxideMethionine sulfoxideME277041158980C02989--
methylmalonate (MMA)Methylmalonic acidME277042487C02170--
methylphosphateMethanolphosphateME27704313130---
methylsuccinateMethylsuccinic acidME27704410349---
mevalonateMevalonic acidME277045439230C02104--
myo-inositolMyo-inositolME277046892C00137--
myristate (14:0)Myristic acidME27704711005C06424--
myristoleate (14:1n5)Myristoleic acidME2770485281119C08322--
myristoleoylcarnitine (C14:1)CAR 14:1ME27704990659872---
myristoylcarnitine (C14)CAR 14:0ME2770506426854---
myristoyl-linoleoyl-glycerol (14:0/18:2) [2]DG 14:0_18:2ME277051----
N1-Methyl-2-pyridone-5-carboxamideN1-Methyl-2-pyridone-5-carboxamideME27705669698C05842--
N1-Methyl-4-pyridone-3-carboxamideN1-Methyl-4-pyridone-3-carboxamideME277057440810C05843--
N1-methylinosine1-MethylinosineME27706065095---
N1,N12-diacetylspermineN1,N12-DiacetylspermineME277055132680C03413--
(N(1) + N(8))-acetylspermidineAsparagineME276525----
N2-acetyllysineN(2)-AcetyllysineME27706392907C12989--
N-(2-furoyl)glycine2-FuroylglycineME27705221863---
N-(2-hydroxypalmitoyl)-sphingosine (d18:1/16:0(2OH...-ME277053----
N2,N2-dimethylguanosineN2,N2-DimethylguanosineME27706192919---
N2,N6-diacetyllysineN,N'-Diacetyl-lysineME27706291827---
N6-acetyllysineN6-AcetyllysineME27706692832C02727--
N6-carbamoylthreonyladenosineN6-Carbamoyl-L-threonyladenosineME277067161466---
N6-carboxymethyllysineN(6)-Carboxymethyl-lysineME277068123800---
N6-formyllysine-ME27706970923---
N6-methyladenosineN6-MethyladenosineME2770701869---
N6,N6-dimethyladenosineN(6),N(6)-DimethyladenosineME277065348206---
N6,N6,N6-trimethyllysineN-6-TrimethyllysineME277064440120C03793--
N6-succinyladenosineSuccinyladenosineME277071165243---
N-acetyl-1-methylhistidineN-Acetyl-3-methylhistidineME277072193270---
N-acetyl-3-methylhistidineN-Acetyl-3-methylhistidineME277073193270---
N-acetylalanineN-AcetylalanineME27707488064C02847--
N-acetylarginineN-AcetylarginineME27707567427C02562--
N-acetylasparagineN-AcetylasparagineME27707699715---
N-acetylaspartate (NAA)N-Acetylaspartic acidME27707765065C01042--
N-acetyl-aspartyl-glutamate (NAAG)N-Acetyl-Asp-GluME2770785255C12270--
N-acetyl-beta-alanineN-Acetyl-beta-alanineME27707976406C01073--
N-acetyl-beta-glucosaminylamineN-Acetyl-beta-glucosaminylamineME277080439454C01239--
N-acetyl-cadaverineN-AcetylcadaverineME277081189087---
N-acetylcitrullineN-AcetylcitrullineME277082656979C15532--
N-acetylcysteineN-AcetylcysteineME27708312035C06809--
N-acetylglucosamine/N-acetylgalactosamineN-AcetylhexosamineME27708424139---
N-acetylglucosaminylasparagineAspartylglycosamineME277085123826C04540--
N-acetylglutamateN-Acetylglutamic acidME27708670914C00624--
N-acetylglutamineN-AcetylglutamineME277087182230C02716--
N-acetylglycineN-AcetylglycineME27708810972---
N-acetylhistamineN-AcetylhistamineME27708969602C05135--
N-acetylhistidineN-AcetylhistidineME27709075619C02997--
N-acetylisoleucineN-AcetylisoleucineME2770912802421---
N-acetyl-isoputreanineN-AcetylisoputreanineME277092----
N-acetylleucineN-AcetylleucineME27709370912C02710--
N-acetylmethionineN-AcetylmethionineME277094448580C02712--
N-acetylmethionine sulfoxideN-Acetylmethionine sulfoxideME277095193368---
N-acetylmuramateN-Acetylmuramic acidME2770965462244C02713--
N-acetylneuraminateN-Acetylneuraminic acidME277097439197C00270--
N-acetylphenylalanineN-AcetylphenylalanineME27709874839C03519--
N-acetylprolineN-Acetyl-prolineME277099322640---
N-acetylputrescineN-AcetylputrescineME277100122356C02714--
N-acetylpyrralineDehydroepiandrosteroneME277101----
N-acetylserineN-AcetylserineME27710265249---
N-acetylsphingosineCer 18:1;O2/2:0ME2771035497136C00195--
N-acetyltaurineN-AcetyltaurineME277104159864---
N-acetylthreonineN-AcetylthreonineME277105152204---
N-acetyltryptophanN-Acetyl-tryptophanME277106700653C03137--
N-acetyltyrosineN-AcetyltyrosineME27710768310---
N-acetylvalineN-AcetylvalineME27710866789---
N-alpha-acetylornithineN-AcetylornithineME277109439232C00437--
naringeninNaringeninME277110932C00509--
N-carbamoylaspartateN-Carbamoylaspartic acidME27711193072C00438--
N-delta-acetylornithineN(5)-Acetyl-ornithineME2771129920500---
N-formylanthranilic acidFormylanthranilic acidME277113101399C05653--
N-formylmethionineN-FormylmethionineME277114439750C03145--
N-formylphenylalanineN-FormylphenylalanineME277115759256---
nicotianamine(R,S,S)-NicotianamineME2771169882882C05324--
nicotinamideNiacinamideME277117936C00153--
nicotinamide N-oxideNicotinamide N-oxideME27711872661---
nicotinamide ribosideNicotinamide ribosideME277119439924C03150--
nicotinateNicotinic acidME277120938C00253--
nicotinate ribonucleosideD-RibosylnicotinateME277121161234C05841--
nicotinic acid mononucleotide (NaMN)Nicotinic acid mononucleotideME2771225288991C01185--
nisinate (24:6n3)THAME27712311792612---
N-linoleoylglycineN-linoleoylglycineME2771246433346---
N-linoleoyltaurineN-Linoleoyl taurineME277125----
N-methylalanineN-MethylalanineME2771265288725C02721--
N-methyl-GABA4-(Methylamino)butyric acidME27712770703C15987--
N-methylhydroxyprolineN-Methyl-4-hydroxyprolineME277128----
N-methylprolineN-Methyl-prolineME277129557---
N,N,N-trimethyl-5-aminovalerateN,N,N-trimethyl-5-aminovalerateME277054----
N-oleoylserineNASer 18:1(9Z)ME277130----
N-oleoyl-sphingosine (d18:1/18:1)Cer 18:1;O2/18:1ME2771315283563---
N-oleoyltaurineN-Oleoyl taurineME2771326437033---
nonadecanoate (19:0)Nonadecylic acidME27713312591C16535--
N-palmitoylglycineN-Palmitoyl glycineME277134151008---
N-palmitoyl-sphingadienine (d18:2/16:0)Cer 18:2;O2/16:0ME277135----
N-palmitoyl-sphinganine (d18:0/16:0)Cer 18:0;O2/16:0ME2771365283572---
N-palmitoyl-sphingosine (d18:1/16:0)Cer 18:1;O2/16:0ME2771375283564---
N-stearoyl-sphinganine (d18:0/18:0)Cer 18:0;O2/18:0ME2771385283573---
N-stearoyl-sphingosine (d18:1/18:0)Cer 18:1;O2/18:0ME2771395283565---
N-stearoyltaurineN-Stearoyl taurineME277140168274---
octadecanedioylcarnitine (C18-DC)CAR DC18:0ME277141----
octadecenedioate (C18:1-DC)-ME277142----
octadecenedioylcarnitine (C18:1-DC)CAR DC18:1ME277143----
octanoylcarnitine (C8)CAR 8:0ME277144123701C02838--
oleanolateOleanolic acidME27714510494C17148--
oleate/vaccenate (18:1)Oleic acidME277146----
oleoyl-arachidonoyl-glycerol (18:1/20:4) [2]DG 18:1_20:4ME277148----
oleoylcarnitine (C18)CAR 18:1ME2771496441392---
oleoylcholineOleoylcholineME277150----
oleoyl ethanolamideOleoyl-EAME2771475283454---
oleoyl-linolenoyl-glycerol (18:1/18:3) [2]DG 18:1_18:3ME277151----
oleoyl-linoleoyl-glycerol (18:1/18:2) [1]DG 18:1_18:2ME277152----
oleoyl-linoleoyl-glycerol (18:1/18:2) [2]DG 18:1_18:2ME277153----
oleoyl-oleoyl-glycerol (18:1/18:1) [2]DG 18:1_18:1ME277154----
ornithineOrnithineME2771556262C00077--
orotateOrotic acidME277156967C00295--
orotidineOrotidineME27715792751---
O-sulfo-L-tyrosineSulfotyrosineME277158514186---
o-Tyrosineo-TyrosineME27715991482---
palmitate (16:0)Palmitic acidME277160985C00249--
palmitoleate (16:1n7)Palmitoleic acidME277161445638C08362--
palmitoleoylcarnitine (C16:1)CAR 16:1ME27716371464547---
palmitoleoyl ethanolamidePalmitoleoyl-EAME2771629835868---
palmitoleoyl-linoleoyl-glycerol (16:1/18:2) [1]DG 16:1_18:2ME277164----
palmitoylcarnitine (C16)CAR 16:0ME277167461C02990--
palmitoylcholinePalmitoylcholineME277168151731---
palmitoyl dihydrosphingomyelin (d18:0/16:0)SM 18:0;O2/16:0ME2771659939965---
palmitoyl-linolenoyl-glycerol (16:0/18:3) [2]DG 16:0_18:3ME277169----
palmitoyl-linoleoyl-glycerol (16:0/18:2) [1]DG 16:0_18:2ME2771709543695---
palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]DG 16:0_18:2ME277171----
palmitoyl sphingomyelin (d18:1/16:0)SM 18:1;O2/16:0ME2771669939941---
pantetheinePantetheineME277172439322C00831--
pantothenate (Vitamin B5)Pantothenic acidME2771736613C00864--
p-cresol sulfatep-Cresol sulfateME2771744615423---
pentadecanoate (15:0)Pentadecylic acidME27717513849C16537--
phenethylaminePhenylethylamineME2771761001C05332--
phenol sulfatePhenyl hydrogen sulfateME27717774426C02180--
phenylacetatePhenyl acetateME277178999C07086--
phenylacetylglutaminealpha-N-PhenylacetylglutamineME27717992258C04148--
phenylacetylglycinePhenylacetylglycineME27718068144C05598--
phenylalaninePhenylalanineME2771816140C00079--
phenylalanylalaninePhe-AlaME2771825488196---
phenylalanylglycinePhe-GlyME27718398207---
phenyllactate (PLA)Phenyllactic acidME2771843848C05607--
phenylpyruvatePhenylpyruvic acidME277185997C00166--
pheophorbide APheophorbide aME2771865323510C18021--
pheophytin APheophytin aME277187-C05797--
phosphatePhosphoric acidME2771881061C00009--
phosphocholineCholine phosphateME2768321014C00588--
phytosphingosinePhytosphingosineME277189122121C12144--
picolinatePicolinic acidME2771901018C10164--
pimelate (C7-DC)Pimelic acidME277191385C02656--
pinitolPinitolME277192164619C03844--
pipecolatePipecolic acidME277193849C00408--
prolineProlineME277195145742C00148--
prolylglycinePro-GlyME2771966426709---
prolylhydroxyprolinePro-hydroxyProME27719411673055---
propionylcarnitine (C3)CAR 3:0ME277197107738C03017--
protoporphyrin IXProtoporphyrinME2771984971C02191--
pseudouridinePseudouridineME27719915047C02067--
pyridoxalPyridoxalME2772001050C00250--
pyridoxaminePyridoxamineME2772011052C00534--
pyridoxate4-Pyridoxic acidME2772026723C00847--
pyridoxine (Vitamin B6)PyridoxineME2772031054C00314--
pyroglutaminePyroglutamineME277204134508---
pyrralinePyrralineME277205122228---
pyruvatePyruvic acidME2772061060C00022--
quinateQuinic acidME2772076508C00296--
quinolinateQuinolinic acidME2772081066C03722--
raffinoseRaffinoseME27720910542C00492--
retinol (Vitamin A)RetinolME277210445354C00473--
ribitolRibitolME2772116912C00474--
riboflavin (Vitamin B2)RiboflavinME277212493570C00255--
ribonate (ribonolactone)Ribonic acidME2772135460677C01685--
riboseRiboseME2772145779C00121--
ribulonate/xylulonate-ME277215----
ribulose/xyluloseXyluloseME2772165289590---
S-1-pyrroline-5-carboxylate1-Pyrroline-5-carboxylic acidME2772181196C04322--
S-(3-hydroxypropyl)mercapturic acid (HPMA)N-Acetyl-S-(3-hydroxypropyl)-cysteineME2772173371179---
salicylateSalicylic acidME277219338C00805--
sarcosineSarcosineME2772201088C00213--
sebacate (C10-DC)Sebacic acidME2772215192C08277--
sedoheptuloseGlucoheptuloseME2772225459879---
sedoheptulose-7-phosphateSedoheptulose 7-phosphateME277223616C05382--
serineSerineME2772245951C00065--
serotoninSerotoninME2772255202C00780--
sinapateSinapic acidME277226637775C00482--
soyasaponin ISoyasaponin IME277227122097C08983--
soyasaponin IISoyasaponin IIME277228171435C12081--
soyasaponin IIISoyasaponin IIIME277229----
spermidineSpermidineME2772301102C00315--
sphingadienineSphingadienineME2772316449795---
sphinganineSphinganineME2772323126C00836--
sphingomyelin (d17:1/16:0, d18:1/15:0, d16:1/17:0)SM 33:1;O2ME277233----
sphingomyelin (d18:1/14:0, d16:1/16:0)SM 32:1;O2ME27723411433862---
sphingomyelin (d18:1/24:1, d18:2/24:0)SM 42:2;O2ME277235----
sphingosineSphingosineME2772365353955C00319--
stachydrineStachydrineME277237115244C10172--
stachyoseStachyoseME277238439531C01613--
stearidonate (18:4n3)Stearidonic acidME2772395312508C16300--
stearoylcarnitine (C18)CAR 18:0ME2772406426855---
stearoyl-linoleoyl-glycerol (18:0/18:2) [2]DG 18:0_18:2ME277241----
stigmasterolStigmasterolME2772425280794C05442--
suberate (C8-DC)Suberic acidME27724310457C08278--
succinateSuccinic acidME2772441110C00042--
succinimideSuccinimideME27724511439C07273--
succinylcarnitine (C4)CAR DC4:0ME27724671464481---
sucroseSucroseME2772475988C00089--
sulfate-ME2772481118C00059--
syringic acidSyringic acidME27724910742C10833--
tartronate (hydroxymalonate)Hydroxypropanedioic acidME27725045C02287--
taurineTaurineME2772511123C00245--
tauro-beta-muricholateTauro-beta-muricholic acidME277252168408---
taurochenodeoxycholateTaurochenodeoxycholic acidME277253387316C05465--
taurochenodeoxycholic acid 7-sulfateTaurochenodeoxycholic acid 7-sulfateME277254----
taurocholateTaurocholic acidME2772556675C05122--
taurocholenate sulfateTaurocholenate sulfateME277256----
taurodeoxycholateTaurodeoxycholic acidME2772572733768C05463--
taurohyodeoxycholic acidTaurohyodeoxycholic acidME277258119046---
taurolithocholateTaurolithocholic acidME27725910595C02592--
tauroursodeoxycholateTauroursodeoxycholic acidME2772609848818---
tetradecanedioate (C14)Tetradecanedioic acidME27726113185---
thiamin monophosphateThiamine monophosphateME2772633382778C01081--
thiamin (Vitamin B1)ThiamineME2772621130C00378--
thioprolineThioprolineME27726493176---
threonateThreonic acidME277265151152C01620--
threonineThreonineME2772666288C00188--
threonylphenylalanineThr-PheME2772674099799---
thymidineThymidineME2772685789C00214--
thymineThymineME2772701135C00178--
TMPTMPME2772699700C00364--
trans-urocanateUrocanic acidME277272736715C00785--
tricarballylate1,2,3-Propanetricarboxylic acidME27727314925C19806--
trigonelline (N'-methylnicotinate)TrigonellineME2772745570C01004--
trimethylamine N-oxideTrimethylamine N-oxideME2772751145C01104--
tryptamineTryptamineME2772761150C00398--
tryptophanTryptophanME2772776305C00078--
tryptophylglycineTrp-GlyME277278263471---
tyramineTyramineME2772795610C00483--
tyrosineTyrosineME2772806057C00082--
tyrosolTyrosolME27728110393C06044--
tyrosylglycineTyr-GlyME277282259323---
UMPUMPME2772896030C00105--
undecanedioate (C11-DC)Undecanedioic acidME27728315816---
uracilUracilME2772841174C00106--
urateUric acidME2772851175C00366--
ureaUreaME2772861176C00086--
uridineUridineME2772876029C00299--
uridine-2',3'-cyclic monophosphate2',3' cyclic UMPME277290439715C02355--
uridine 3'-monophosphate (3'-UMP)3'-UMPME277288101543C01368--
ursocholateUrsocholic acidME277291----
valerate (5:0)Valeric acidME2772927991C00803--
valineValineME2772936287C00183--
valine betaine-ME277294----
valylglutamineVal-GlnME2772955253209---
valylglycineVal-GlyME277296136487---
valylleucineVal-LeuME277297352039---
vanillateVanillic acidME2772988468C06672--
vanillic alcohol sulfate-ME277299----
vanillin sulfate-ME277300----
xanthineXanthineME2773011188C00385--
xanthosineXanthosineME27730264959C01762--
xanthurenateXanthurenic acidME2773035699C02470--
xyloseXyloseME277304135191C00181--


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