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Analysis: UPLC UNSPECIFIED 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 acidME322576----
10-nodecenoate (19:1n9)-ME322577-C00174--
1-(1-enyl-oleoyl)-GPE (P-18:1)*LPE P-18:1 or LPE O-18:2ME322489----
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20...PC P-16:0/20:4 or PC O-16:1/20:4ME322490----
1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20...PE P-16:0/20:4 or PE O-16:1/20:4ME322491----
1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2)...PC P-16:0/18:2 or PC O-16:1/18:2ME322492----
1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)...PE P-16:0/18:2 or PE O-16:1/18:2ME322493----
1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1)*PC P-16:0/18:1 or PC O-16:1/18:1ME322494----
1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)*PE P-16:0/18:1 or PE O-16:1/18:1ME322495----
1-(1-enyl-palmitoyl)-2-palmitoleoyl-GPC (P-16:0/16...PC P-16:0/16:1 or PC O-16:1/16:1ME322496----
1-(1-enyl-palmitoyl)-2-palmitoyl-GPC (P-16:0/16:0)...PC P-16:0/16:0 or PC O-16:1/16:0ME322497----
1-(1-enyl-palmitoyl)-GPE (P-16:0)*LPE P-16:0 or LPE O-16:1ME322498----
1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:...PE P-18:0/20:4 or PE O-18:1/20:4ME322499-C00350--
1-(1-enyl-stearoyl)-2-linoleoyl-GPE (P-18:0/18:2)*PE P-18:0/18:2 or PE O-18:1/18:2ME322500----
1-(1-enyl-stearoyl)-2-oleoyl-GPE (P-18:0/18:1)PE P-18:0/18:1 or PE O-18:1/18:1ME322501----
1-(1-enyl-stearoyl)-GPE (P-18:0)*LPE P-18:0 or LPE O-18:1ME322502----
12,13-DiHOME12,13-DiHOMEME322578-C14829--
1,2-dilinoleoyl-GPC (18:2/18:2)PC 18:2/18:2ME322483-C00157--
1,2-dioleoyl-GPC (18:1/18:1)*PC 18:1/18:1ME322484----
1,2-dioleoyl-GPE (18:1/18:1)PE 18:1/18:1ME322485-C00350--
1,2-dioleoyl-GPG (18:1/18:1)PG 18:1/18:1ME322486----
1,2-dipalmitoyl-GPC (16:0/16:0)PC 16:0/16:0ME322487-C00157--
12-hydroxyoleateRicinelaidic acidME322579-C08365--
13-HODE + 9-HODEHODEME322580----
1,5-anhydroglucitol (1,5-AG)1,5-AnhydrosorbitolME322488-C07326--
15-methylpalmitate15-Methylpalmitic acidME322581----
16-hydroxypalmitateJuniperic acidME322582----
17-methylstearateXi-17-Methyloctadecanoic acidME322583----
1-arachidonoyl-GPC (20:4n6)*LPC 20:4/0:0ME322503----
1-arachidonoyl-GPE (20:4n6)*LPE 20:4/0:0ME322504----
1-arachidonoyl-GPI (20:4)*LPI 20:4/0:0ME322505----
1-arachidonylglycerol (20:4)MG 20:4ME322506----
1-dihomo-linolenylglycerol (20:3)MG 20:3/0:0/0:0ME322507----
1-dihomo-linoleoylglycerol (20:2)MG 20:2ME322508----
1-docosahexaenoylglycerol (22:6)MG 22:6ME322509----
1-linolenoylglycerol (18:3)MG 18:3ME322510----
1-linoleoyl-2-arachidonoyl-GPC (18:2/20:4n6)*PC 18:2/20:4ME322511----
1-linoleoylglycerol (18:2)MG 18:2ME322516----
1-linoleoyl-GPC (18:2)LPC 18:2/0:0ME322512----
1-linoleoyl-GPE (18:2)*LPE 18:2/0:0ME322513----
1-linoleoyl-GPI (18:2)*LPI 18:2/0:0ME322514----
1-linoleoyl-GPS (18:2)*LPS 18:2ME322515----
1-methylguanidineMethylguanidineME322517-C02294--
1-methylhistamine1-MethylhistamineME322518-C05127--
1-methylhistidine1-MethylhistidineME322519-C01152--
1-methylimidazoleacetateMethylimidazoleacetic acidME322520-C05828--
1-methylnicotimide1-Methyl nicotinamideME322521-C02918--
1-methylxanthine1-MethylxanthineME322522----
1-myristoylglycerol (14:0)MG 16:3ME322523-C01885--
1-oleoyl-2-linoleoyl-glycerol (18:1/18:2)DG 18:1_18:2ME322524----
1-oleoyl-2-linoleoyl-GPC (18:1/18:2)*PC 18:1_18:2ME322525----
1-oleoyl-2-linoleoyl-GPE (18:1/18:2)*PE 18:1/18:2ME322526-C00350--
1-oleoyl-3-linoleoyl-glycerol (18:1/18:2)DG 18:1_18:2ME322527----
1-oleoylglycerol (18:1)MG 18:1/0:0/0:0ME322532----
1-oleoyl-GPC (18:1)LPC 18:1/0:0ME322528-C04230--
1-oleoyl-GPE (18:1)LPE 18:1/0:0ME322529----
1-oleoyl-GPG (18:1)*LPG 18:1/0:0ME322530----
1-oleoyl-GPS (18:1)LPS 18:1/0:0ME322531----
1-palmitoleoyl-2-linoleoyl-GPC (16:1/18:2)*PC 16:1/18:2ME322533----
1-palmitoleoyl-2-oleoyl-glycerol (16:1/18:1)*DG 16:1_18:1ME322534-C00165--
1-palmitoleoyl-3-oleoyl-glycerol (16:1/18:1)*DG 16:1_18:1ME322535----
1-palmitoleoylglycerol (16:1)*MG 16:1ME322537----
1-palmitoleoyl-GPC (16:1)*LPC 16:1/0:0ME322536-C04230--
1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4)PC 16:0_20:4ME322538-C00157--
1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4)*PE 16:0/20:4ME322539-C00350--
1-palmitoyl-2-arachidonoyl-GPI (16:0/20:4)*PI 16:0/20:4ME322540----
1-palmitoyl-2-linolenoyl-GPC (16:0/18:3)*PC 16:0_18:3ME322541----
1-palmitoyl-2-linoleoyl-glycerol (16:0/18:2)*DG 16:0_18:2ME322542-C00165--
1-palmitoyl-2-linoleoyl-GPC (16:0/18:2)PC 16:0/18:2ME322543-C00157--
1-palmitoyl-2-linoleoyl-GPE (16:0/18:2)PE 16:0/18:2ME322544-C00350--
1-palmitoyl-2-linoleoyl-GPG (16:0/18:2)PG 16:0/18:2ME322545----
1-palmitoyl-2-linoleoyl-GPI (16:0/18:2)PI 16:0/18:2ME322546----
1-palmitoyl-2-oleoyl-GPC (16:0/18:1)PC 16:0/18:1ME322547----
1-palmitoyl-2-oleoyl-GPE (16:0/18:1)PE 16:0/18:1ME322548-C00350--
1-palmitoyl-2-oleoyl-GPG (16:0/18:1)PG 16:0/18:1ME322549----
1-palmitoyl-2-oleoyl-GPS (16:0/18:1)PS 16:0/18:1ME322550----
1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)*PC 16:0/16:1ME322551----
1-palmitoyl-2-stearoyl-GPC (16:0/18:0)PC 16:0/18:0ME322552----
1-palmitoyl-3-linoleoyl-glycerol (16:0/18:2)*DG 16:0_18:2ME322553----
1-palmitoylglycerol (16:0)MG 16:0/0:0/0:0ME322559----
1-palmitoyl-GPC (16:0)LPC 16:0/0:0ME322554----
1-palmitoyl-GPE (16:0)LPE 16:0/0:0ME322555----
1-palmitoyl-GPG (16:0)*LPG 16:0/0:0ME322556----
1-palmitoyl-GPI (16:0)*LPI 16:0/0:0ME322557----
1-palmitoyl-GPS (16:0)*LPS 16:0/0:0ME322558----
1-stearoyl-2-arachidonoyl-GPC (18:0/20:4)PC 18:0/20:4ME322560-C00157--
1-stearoyl-2-arachidonoyl-GPE (18:0/20:4)PE 18:0/20:4ME322561-C00350--
1-stearoyl-2-arachidonoyl-GPI (18:0/20:4)PI 18:0/20:4ME322562----
1-stearoyl-2-arachidonoyl-GPS (18:0/20:4)PS 18:0/20:4ME322563----
1-stearoyl-2-linoleoyl-GPC (18:0/18:2)*PC 18:0/18:2ME322564----
1-stearoyl-2-linoleoyl-GPE (18:0/18:2)*PE 18:0/18:2ME322565-C00350--
1-stearoyl-2-linoleoyl-GPI (18:0/18:2)PI 18:0/18:2ME322566----
1-stearoyl-2-linoleoyl-GPS (18:0/18:2)PS 18:0/18:2ME322567----
1-stearoyl-2-oleoyl-GPC (18:0/18:1)PC 18:0/18:1ME322568----
1-stearoyl-2-oleoyl-GPE (18:0/18:1)PE 18:0/18:1ME322569----
1-stearoyl-2-oleoyl-GPS (18:0/18:1)PS 18:0/18:1ME322570----
1-stearoyl-GPC (18:0)LPC 18:0/0:0ME322571-C04230--
1-stearoyl-GPE (18:0)LPE 18:0/0:0ME322572----
1-stearoyl-GPG (18:0)LPG 18:0/0:0ME322573----
1-stearoyl-GPI (18:0)LPI 18:0/0:0ME322574----
1-stearoyl-GPS (18:0)*LPS 18:0/0:0ME322575----
21-hydroxypregnenolone disulfate21-HydroxypregnenoloneME322614-C05485--
2-aminoadipatealpha-Aminoadipic acidME322589-C00956--
2-aminobutyrate2-Aminobutyric acidME322590-C02261--
2-aminoheptanoate2-Aminoheptanoic acidME322591----
2-arachidonoylglycerol (20:4)MG 20:4ME322592-C13856--
2'-deoxyadenosine 3'-monophosphate2'-Deoxy-3'-AMPME322584----
2'-deoxyadenosine 5'-monophosphatedAMPME322585-C00360--
2'-deoxyguanosineDeoxyguanosineME322586-C00330--
2'-deoxyinosineDeoxyinosineME322587-C05512--
2'-deoxyuridineDeoxyuridineME322588-C00526--
2-hydroxyadipate2-Hydroxyadipic acidME322593-C02360--
2-hydroxybutyrate/2-hydroxyisobutyrate2-Hydroxybutyric acid/2-Hydroxyisobutyric acidME322594----
2-hydroxyglutarate2-Hydroxyglutaric acidME322595----
2-hydroxyhippurate (salicylurate)Salicyluric acidME322596-C07588--
2-hydroxypalmitate2-Hydroxypalmitic acidME322597----
2-hydroxystearate2-Hydroxystearic acidME322598----
2-linoleoylglycerol (18:2)MG 18:2ME322599----
2-methylbutyrylcarnitine (C5)CAR 4:0;2MeME322600----
2-methylbutyrylglycine2-MethylbutyrylglycineME322601----
2-methylcitrate/homocitrateHomocitric acidME322602----
2-methylmalonyl carnitineCAR DC3:0;2MeME322603----
2-myristoylglycerol (14:0)MG 0:0/14:0/0:0ME322604----
2-oleoylglycerol (18:1)MG 0:0/18:1(9Z)/0:0ME322605----
2-palmitoleoylglycerol (16:1)*MG 16:1ME322607----
2-palmitoleoyl-GPC (16:1)*LPC 0:0/16:1ME322606----
2-palmitoylglycerol (16:0)MG 0:0/16:0/0:0ME322609----
2-palmitoyl-GPC (16:0)*LPC 0:0/16:0ME322608----
2-phenylglycine2-PhenylglycineME322610----
2-phosphoglycerate2-Phosphoglyceric acidME322611----
2-piperidinone2-PiperidinoneME322612----
2-stearoyl-GPE (18:0)*LPE 0:0/18:0ME322613----
3-(4-hydroxyphenyl)lactateHydroxyphenyllactic acidME322616-C03672--
3-aminoisobutyrate3-Aminoisobutanoic acidME322619-C05145--
3-(cystein-S-yl)acetaminophen*3-(Cystein-S-yl)acetaminophenME322617----
3'-dephosphocoenzyme A3'-Dephospho-CoAME322615-C00882--
3-hydroxy-3-methylglutarate3-Hydroxymethylglutaric acidME322620-C03761--
3-hydroxybutyrate (BHBA)3-Hydroxybutyric acidME322621-C01089--
3-hydroxybutyrylcarnitine (1)CAR 4:0;3OHME322622----
3-hydroxybutyrylcarnitine (2)CAR 4:0;3OHME322623----
3-hydroxyisobutyrate3-Hydroxyisobutyric acidME322624-C06001--
3-hydroxylaurate3-Hydroxydodecanoic acidME322625----
3-hydroxyoctanoate3-Hydroxyoctanoic acidME322626----
3-methoxytyramine sulfate3-Methoxytyramine sulfateME322627----
3-methoxytyrosine3-MethoxytyrosineME322628----
3-methyl-2-oxobutyrateKetoisovaleric acidME322629-C00141--
3-methyl-2-oxovalerate3-Methyl-2-oxovaleric acidME322630-C00671--
3-methyladipoylcarnitine-ME322631----
3-methylglutarylcarnitine (2)CAR DC5:0;3MeME322632----
3-methylhistidine3-MethylhistidineME322633-C01152--
3-(N-acetyl-L-cystein-S-yl) acetaminophen3-(N-Acetyl-L-cystein-S-yl) acetaminophenME322618----
3-phosphoglycerate3-Phosphoglyceric acidME322634-C00597--
3-ureidopropioteUreidopropionic acidME322635-C02642--
4-acetamidobutanoate4-Acetamidobutanoic acidME322636-C02946--
4-acetamidophenolAcetaminophenME322637----
4-acetaminophen sulfateParacetamol sulfateME322638----
4-androsten-3beta,17beta-diol disulfate (1)4-Androsten-3beta,17beta-diol disulfateME322639-C04295--
4-androsten-3beta,17beta-diol disulfate (2)4-Androsten-3beta,17beta-diol disulfateME322640-C04295--
4-androsten-3beta,17beta-diol monosulfate (1)-ME322641----
4-cholesten-3-oneCholestenoneME322642-C00599--
4-guanidinobutanoate4-Guanidinobutanoic acidME322643-C01035--
4-hydroxybenzoate4-Hydroxybenzoic acidME322644-C00156--
4-hydroxybutyrate (GHB)4-Hydroxybutyric acidME322645-C00989--
4-hydroxyglutamateErythro-4-hydroxy-glutamic acidME322646-C03079--
4-hydroxyhippurate4-Hydroxyhippuric acidME322647----
4-hydroxyphenylpyruvate4-Hydroxyphenylpyruvic acidME322648-C01179--
4-imidazoleacetateImidazoleacetic acidME322649-C02835--
4-methyl-2-oxopentanoateKetoleucineME322650-C00233--
5,6-DiHETrE5,6-DiHETrEME322651-C14772--
5alpha-pregn-3beta,20alpha-diol disulfate-ME322662----
5-dodecenoate (12:1n7)5-Dodecenoic acidME322652----
5-HETE5-HETEME322653-C04805--
5-hydroxylysine5-HydroxylysineME322654-C16741--
5-KETE5-Oxo-ETEME322655-C14732--
5-methylcytidine5-MethylcytidineME322656----
5-methylcytosine5-MethylcytosineME322657-C02376--
5-methyltetrahydrofolate (5MeTHF)5-Methyl-THFME322658-C00440--
5-methylthioadenosine (MTA)5'-MethylthioadenosineME322659-C00170--
5-methyluridine (ribothymidine)RibothymidineME322660----
5-oxoprolinePyroglutamic acidME322661-C01879--
6-oxopiperidine-2-carboxylic acid6-oxopiperidine-2-carboxylic acidME322663----
6-phosphoglucote6-Phosphogluconic acidME322664-C00345--
7-hydroxycholesterol (alpha or beta)7beta-HydroxycholesterolME322665----
7-methylguanine7-MethylguanineME322666-C02242--
8,9-DiHETrE8,9-DiHETrEME322667-C14773--
8-hydroxyoctanoate8-Hydroxyoctanoic acidME322668----
9,10-DiHOME9,10-DiHOMEME322669-C14828--
acetylcarnitineCAR 2:0ME322670-C02571--
acetylphosphateAcetylphosphateME322671-C00227--
aconitate [cis or trans]cis-Aconitic acidME322672-C00417--
adenineAdenineME322673-C00147--
adenosineAdenosineME322674-C00212--
adenosine 2'-monophosphate (2'-AMP)Adenosine 2'-phosphateME322675-C00946--
adenosine 3',5'-cyclic monophosphate (cAMP)3',5' cyclic AMPME322676-C00575--
adenosine 3',5'-diphosphateAdenosine 3',5'-diphosphateME322677-C00054--
adenosine 3'-monophosphate (3'-AMP)3'-AMPME322678-C01367--
adenosine 5'-diphosphate (ADP)ADPME322679-C00008--
adenosine 5'-diphosphoribose (ADP-ribose)ADP-riboseME322680-C00301--
adenosine 5'-monophosphate (AMP)AMPME322681-C00020--
adenylosucciteAdenylsuccinic acidME322682-C03794--
adipateAdipic acidME322683-C06104--
adipoylcarnitineCAR DC6:0ME322684----
adrete (22:4n6)Adrenic acidME322685-C16527--
alanineAlanineME322686-C00041--
alanylleucineAla-LeuME322687----
allantoinAllantoinME322688-C01551--
alpha-hydroxyisovalerate2-Hydroxy-3-methylbutyric acidME322689----
alpha-hydroxyisovaleroyl carnitine*CAR 5:0;OHME322690----
alpha-ketoglutarate2-Oxoglutaric acidME322691-C00026--
alpha-tocopherolalpha-TocopherolME322692-C02477--
andro steroid monosulfate (1)*5alpha-Androstane-3alpha-ol-17-one sulfateME322693-C04555--
anserineAnserineME322694-C01262--
anthranilate2-Aminobenzoic acidME322695-C00108--
arabitol/xylitolArabitolME322696----
arabote/xylote-ME322697----
arachidate (20:0)Arachidic acidME322698-C06425--
arachidonoyl ethanolamideArachidonoyl-EAME322700-C11695--
arachidote (20:4n6)Arachidonic acidME322699-C00219--
arginineArginineME322701-C00062--
argininosucciteArgininosuccinic acidME322702-C03406--
ascorbate (Vitamin C)Vitamin CME322703-C00072--
asparagineAsparagineME322704-C00152--
aspartateAspartic acidME322705-C00049--
azelate (nonedioate)Azelaic acidME322706-C08261--
azeloylcarnitine-ME322707----
behenoyl sphingomyelin (d18:1/22:0)*SM 18:1;O2/22:0ME322708----
benzoylcarnitine*BenzoylcarnitineME322709----
benzyl alcohol glucuronide-ME322710----
beta-alaninebeta-AlanineME322711-C00099--
beta-guanidinopropanoate3-Guanidinopropanoic acidME322712-C03065--
beta-hydroxyisovalerate3-Hydroxyisovaleric acidME322713----
beta-hydroxyisovaleroylcarnitineCAR 4:0;OH,MeME322714----
betaineBetaineME322715-C00719--
betaine aldehydeBetaine aldehydeME322716-C00576--
bilirubin (Z,Z)BilirubinME322717-C00486--
biliverdinBiliverdinME322718-C00500--
biopterinBiopterinME322719-C06313--
butyrylcarnitineCAR 4:0ME322720-C02862--
butyrylglycineN-ButyrylglycineME322721----
cadaverineCadaverineME322723-C01672--
caffeineCaffeineME322724-C07481--
caprate (10:0)Capric acidME322725-C01571--
carboxyethyl-GABAN-Carboxyethyl-gamma-aminobutyric acidME322726----
carnitineCarnitineME322727-C00318--
carnosineCarnosineME322728-C00386--
catechol sulfateCatechol sulfateME322729-C00090--
C-glycosyltryptophanC-GlycosyltryptophanME322722----
chenodeoxycholateChenodeoxycholic acidME322730-C02528--
cholateCholic acidME322731-C00695--
cholesterolCholesterolME322732-C00187--
cholineCholineME322733-C00114--
choline phosphateCholine phosphateME322734-C00588--
cis-urocate-ME322735----
citrateCitric acidME322736-C00158--
citrullineCitrullineME322737-C00327--
creatineCreatineME322738-C00300--
creatinineCreatinineME322739-C00791--
cystathionineCystathionineME322740-C02291--
cysteamineCysteamineME322741-C01678--
cysteineCysteineME322742-C00097--
cysteine-glutathione disulfideS-Glutathionyl-cysteineME322745----
cysteine s-sulfateCysteine-S-sulfateME322743-C05824--
cysteine sulfinic acid3-Sulfino-alanineME322744-C00606--
cysteinylglycineCys-GlyME322746-C01419--
cystineCystineME322747-C00491--
cytidineCytidineME322748-C00475--
cytidine 3'-monophosphate (3'-CMP)3'-CMPME322749----
cytidine 5'-diphosphocholineCDP-cholineME322750-C00307--
cytidine-5'-diphosphoethanolamineCDP-EthanolamineME322752-C00570--
cytidine 5'-monophosphate (5'-CMP)CMPME322751-C00055--
cytosineCytosineME322753-C00380--
decanoylcarnitineCAR 10:0ME322754----
dehydroascorbateDehydroascorbic acidME322755----
dehydroisoandrosterone sulfate (DHEA-S)Dehydroepiandrosterone sulfateME322756-C04555--
deoxycarnitine3-DehydroxycarnitineME322757-C01181--
diglycerolDiglycerolME322758----
dihomo-linoleate (20:2n6)11Z,14Z-Eicosadienoic acidME322759-C16525--
dihomo-linolete (20:3n3 or n6)Dihomo-gamma-linolenic acidME322760-C03242--
dihydrobiopterin4a-Carbinolamine tetrahydrobiopterinME322761-C00268--
dihydroxyacetone phosphate (DHAP)Dihydroxyacetone phosphateME322762-C00111--
dimethylarginine (SDMA + ADMA)DimethylarginineME322763-C03626--
dimethylglycineDimethylglycineME322764-C01026--
docosadienoate (22:2n6)13Z,16Z-Docosadienoic acidME322765----
docosahexaenoate (DHA; 22:6n3)DHAME322766-C06429--
docosapentaenoate (n3 DPA; 22:5n3)DPAME322767-C16513--
docosapentaenoate (n6 DPA; 22:5n6)Docosapentaenoic acid (22n-6)ME322768-C16513--
docosatrienoate (22:3n3)13,16,19-Docosatrienoic acidME322769----
dodecanedioateDodecanedioic acidME322770-C02678--
dopamine sulfate (2)-ME322771----
eicosapentaenoate (EPA; 20:5n3)EPAME322772-C06428--
eicosenoate (20:1)cis-Gondoic acidME322773-C16526--
ergothioneineErgothioneineME322774-C05570--
erucate (22:1n9)cis-Erucic acidME322775-C08316--
erythrote*-ME322776----
ethanolamineEthanolamineME322777-C00189--
ethylmalote-ME322778----
flavin adenine dinucleotide (FAD)FADME322779-C00016--
flavin mononucleotide (FMN)FMNME322780-C00061--
formiminoglutamateFormiminoglutamic acidME322781-C00439--
fructoseFructoseME322782----
fructose-6-phosphateFructose 6-phosphateME322783-C00085--
fumarateFumaric acidME322784-C00122--
furosemideFurosemideME322785-C07017--
galactose 1-phosphateGalactose 1-phosphateME322787-C00446--
galactoteGalactonic acidME322786-C00880--
gamma-aminobutyrate (GABA)gamma-Aminobutyric acidME322788-C00334--
gamma-carboxyglutamategamma-Carboxy-glutamic acidME322789----
gamma-glutamyl-2-aminobutyrategamma-Glutamyl-2-aminobutanoateME322790----
gamma-glutamylalaninegamma-GlutamylalanineME322792-C03740--
gamma-glutamylcysteinegamma-GlutamylcysteineME322793-C00669--
gamma-glutamyl-epsilon-lysineEpsilon-(gamma-Glutamyl)-lysineME322791----
gamma-glutamylglutamategamma-Glutamylglutamic acidME322794-C05282--
gamma-glutamylglutaminegamma-GlutamylglutamineME322795-C05283--
gamma-glutamylglycinegamma-GlutamylglycineME322796----
gamma-glutamylhistidinegamma-GlutamylhistidineME322797----
gamma-glutamylisoleucine*gamma-GlutamylisoleucineME322798----
gamma-glutamylleucinegamma-GlutamylleucineME322799----
gamma-glutamylmethioninegamma-GlutamylmethionineME322800----
gamma-glutamylphenylalaninegamma-GlutamylphenylalanineME322801----
gamma-glutamylthreonine*gamma-GlutamylthreonineME322802----
gamma-glutamyltyrosinegamma-GlutamyltyrosineME322803----
gamma-glutamylvalinegamma-GlutamylvalineME322804----
gamma-tocopherol/beta-tocopherolbeta-tocopherolME322805----
glucarate (saccharate)Glucaric acidME322806-C00818--
glucosamine-6-phosphateGlucosamine 6-phosphateME322808-C00352--
glucoseGlucoseME322809-C00031--
glucose 6-phosphateGlucose 6-phosphateME322810-C00092--
glucoteGluconic acidME322807-C00257--
glucuroteGlucuronic acidME322811-C00191--
glucurote 1-phosphate*-ME322812----
glutamateGlutamic acidME322813-C00025--
glutamate, gamma-methyl esterGlutamic acid, gamma-methyl esterME322814----
glutamineGlutamineME322815-C00064--
glutarate (pentanedioate)Glutaric acidME322816-C00489--
glutarylcarnitine (C5)CAR 5:0ME322817----
glutathione, oxidized (GSSG)Oxidized glutathioneME322818-C00127--
glutathione, reduced (GSH)GlutathioneME322819-C00051--
glycerateGlyceric acidME322820-C00258--
glycerolGlycerolME322821-C00116--
glycerol 3-phosphatesn-Glycero-3-phosphateME322822-C00093--
glycerophosphoethanolaminesn-Glycero-3-phosphoethanolamineME322823-C01233--
glycerophosphoglycerolsn-Glycero-3-phosphoglycerolME322824----
glycerophosphoinositol*sn-Glycero-3-phosphoinositolME322825----
glycerophosphorylcholine (GPC)sn-Glycero-3-phosphocholineME322826-C00670--
glycineGlycineME322827-C00037--
glycochenodeoxycholateGlycochenodeoxycholic acidME322828-C05466--
glycochenodeoxycholate sulfate-ME322829----
glycocholateGlycocholic acidME322830-C01921--
glycocholete sulfate*-ME322831----
glycodeoxycholateGlycodeoxycholic acidME322832-C05464--
glycodeoxycholate sulfateGlycodeoxycholate sulfateME322833----
glycohyocholateGlycohyocholic acidME322834----
glycolithocholate sulfate*Sulfoglycolithocholic acidME322835-C11301--
glycosyl-N-palmitoyl-sphingosineHexCer 18:1;O2/16:0ME322836----
glycosyl-N-stearoyl-sphingosineHexCer 18:1;O2/18:0ME322837----
glycoursodeoxycholateGlycoursodeoxycholic acidME322838----
glycylisoleucineGly-IleME322839----
glycylleucineGly-LeuME322840-C02155--
glycylvalineGly-ValME322841----
guanidinoacetateGuanidoacetic acidME322842-C00581--
guanidinosucciteGuanidinosuccinic acidME322843-C03139--
guanineGuanineME322844-C00242--
guanosineGuanosineME322845-C00387--
guanosine 2'-monophosphate (2'-GMP)*-ME322846----
guanosine 3'-monophosphate (3'-GMP)Guanosine 3'-monophosphateME322847----
gulonic acid*Gulonic acidME322848----
hemeHemeME322849-C00032--
hexadecanedioateHexadecanedioic acidME322850-C19615--
hexanoylcarnitineCAR 6:0ME322851----
hippurateHippuric acidME322852-C01586--
histamineHistamineME322853-C00388--
histidineHistidineME322854-C00135--
histidylalanineHis-AlaME322855----
homoarginineHomoarginineME322856-C01924--
homocitrullineHomocitrullineME322857-C02427--
homocysteineHomocysteineME322858-C00155--
homovanillate (HVA)Homovanillic acidME322859-C05582--
homovanillate sulfateHomovanillic acidME322860----
hydantoin-5-propionic acidHydantoin-5-propionic acidME322861-C05565--
hypotaurineHypotaurineME322862-C00519--
hypoxanthineHypoxanthineME322863-C00262--
imidazole lactateImidazolelactic acidME322864-C05568--
imidazole propiote-ME322865----
indole-3-carboxylic acidIndole-3-carboxylic acidME322866-C19837--
indoleacetateIndoleacetic acidME322867-C00954--
indolelactateIndolelactic acidME322868-C02043--
inosineInosineME322869-C00294--
inosine 5'-monophosphate (IMP)IMPME322870-C00130--
inositol 1-phosphate (I1P)Inositol 3-phosphateME322871-C04006--
Isobar: fructose 1,6-diphosphate, glucose 1,6-diph...-ME322872----
isobutyrylcarnitineCAR 3:0;2MeME322873----
isocitrateIsocitric acidME322874-C00311--
isoleucineIsoleucineME322875-C00407--
isoleucylglycineIle-GlyME322876----
isovalerylcarnitineCAR 4:0;3MeME322877----
kynurenineKynurenineME322879-C00328--
kynureteKynurenic acidME322878-C01717--
lactateLactic acidME322881-C00186--
lactobiote-ME322882----
lactoseLactoseME322883-C00243--
lactosyl-N-palmitoyl-sphingosineLacCer 18:1;O2/16:0ME322884----
lanthionineLanthionineME322885----
laurate (12:0)Lauric acidME322886-C02679--
laurylcarnitineCAR 12:0ME322887----
leucineLeucineME322888-C00123--
leucylglutamine*Leu-GlnME322889----
leucylglycineLeu-GlyME322890----
lidocaineLidocaineME322891-C07073--
linoleamide (18:2n6)LinoleamideME322892----
linoleate (18:2n6)Linoleic acidME322893-C01595--
linoleoylcarnitine*CAR 18:2ME322895----
linolete [alpha or gamma; (18:3n3 or 6)]Octadecatrienoic acidME322894-C06426--
L-urobilinL-UrobilinME322880-C05793--
lysineLysineME322896-C00047--
lysylleucineLys-LeuME322897----
malateMalic acidME322898-C00149--
maleateMaleic acidME322899-C01384--
malonylcarnitineCAR DC3:0ME322901----
maloteMalonic acidME322900-C00383--
maltopentaoseMaltopentaoseME322902----
maltoseMaltoseME322903-C00208--
maltotetraoseMaltotetraoseME322904-C02052--
maltotrioseMaltotrioseME322905-C01835--
mannitol/sorbitolSorbitolME322906-C00794--
mannoseMannoseME322907-C00159--
margarate (17:0)Margaric acidME322908----
mead acid (20:3n9)ETrE(5Z,8Z,11Z)ME322909----
methionineMethionineME322910-C00073--
methionine sulfoneMethionine sulfoneME322911----
methionine sulfoxideMethionine sulfoxideME322912-C02989--
methyl glucopyranoside (alpha + beta)Methyl glucoseME322913----
methylmalote (MMA)Methylmalonic acidME322914-C02170--
methylphosphateMethanolphosphateME322915----
methylsuccite-ME322916-C08645--
myo-inositolMyo-inositolME322917-C00137--
myo-inositol diphosphate (1,4 or 1,3)-ME322918----
myristate (14:0)Myristic acidME322919-C06424--
myristoleate (14:1n5)Myristoleic acidME322920-C08322--
myristoylcarnitineCAR 14:0ME322921----
N(1)-acetylspermineN1-AcetylspermineME322922-C02567--
N1-Methyl-2-pyridone-5-carboxamideN1-Methyl-2-pyridone-5-carboxamideME322964-C05842--
N1-methyladenosine1-MethyladenosineME322965-C02494--
N1-methylguanosine1-MethylguanosineME322966-C04545--
N1,N12-diacetylspermineN1,N12-DiacetylspermineME322963-C03413--
N2-methylguanosine2-MethylguanosineME322969----
N2,N2-dimethylguanosineN2,N2-DimethylguanosineME322967----
N2,N5-diacetylornithineN2,N5-DiacetylornithineME322968----
N6-acetyllysineN6-AcetyllysineME322971-C02727--
N6-carbamoylthreonyladenosineN6-Carbamoyl-L-threonyladenosineME322972----
N6-carboxyethyllysineN(6)-(2-Carboxyethyl)-lysineME322973----
N6-carboxymethyllysineN(6)-Carboxymethyl-lysineME322974----
N6-methyladenosineN6-MethyladenosineME322975----
N6,N6,N6-trimethyllysineN-6-TrimethyllysineME322970-C03793--
N6-succinyladenosineSuccinyladenosineME322976----
N-acetyl-1-methylhistidine*N-Acetyl-3-methylhistidineME322923----
N-acetyl-3-methylhistidine*N-Acetyl-3-methylhistidineME322924----
N-acetylalanineN-AcetylalanineME322928----
N-acetylarginineN-AcetylarginineME322929----
N-acetylasparagineN-AcetylasparagineME322930----
N-acetylaspartate (A)N-Acetylaspartic acidME322931-C01042--
N-acetyl-aspartyl-glutamate (AG)N-Acetyl-Asp-GluME322925-C12270--
N-acetyl-cadaverineN-AcetylcadaverineME322926----
N-acetylcitrullineN-AcetylcitrullineME322932-C15532--
N-acetylcysteineN-AcetylcysteineME322933-C06809--
N-Acetyl-D-mannosamine 6-phosphate-ME322927-C04257--
N-acetylglucosamine 6-phosphateN-Acetyl-glucosamine 6-phosphateME322934-C00357--
N-acetylglucosaminylasparagineAspartylglycosamineME322935-C04540--
N-acetylglutamateN-Acetylglutamic acidME322936-C00624--
N-acetylglutamineN-AcetylglutamineME322937----
N-acetylglycineN-AcetylglycineME322938----
N-acetylhistidineN-AcetylhistidineME322939-C02997--
N-acetylkynurenine (2)N-AcetylkynurenineME322940----
N-acetylleucineN-AcetylleucineME322941-C02710--
N-acetylmannosamineN-Acetyl-mannosamineME322942-C00140--
N-acetylmethionineN-AcetylmethionineME322943-C02712--
N-acetylmethionine sulfoxideN-Acetylmethionine sulfoxideME322944----
N-acetylneuramite-ME322945----
N-acetylphenylalanineN-AcetylphenylalanineME322946-C03519--
N-acetylputrescineN-AcetylputrescineME322947-C02714--
N-acetylserineN-AcetylserineME322948----
N-acetyltaurineN-AcetyltaurineME322949----
N-acetylthreonineN-AcetylthreonineME322950----
N-acetyltryptophanN-Acetyl-tryptophanME322951----
N-acetyltyrosineN-AcetyltyrosineME322952-C01657--
N-acetylvalineN-AcetylvalineME322953----
N-alpha-acetylornithineN-AcetylornithineME322954-C00437--
neopterinNeopterinME322977-C05926--
N-ethylglycinexylidideMonoethylglycinexylidideME322955----
N-formylmethionineN-FormylmethionineME322956-C03145--
N-formylphenylalanineN-FormylphenylalanineME322957----
nicotimideNiacinamideME322978-C00153--
nicotimide adenine dinucleotide (D+)NADME322979-C00003--
nicotimide ribonucleotide (NMN)Nicotinamide ribotideME322980-C00455--
nicotimide ribosideNicotinamide ribosideME322981-C03150--
nicotiteNicotinic acidME322982-C00253--
nicotite ribonucleosideD-RibosylnicotinateME322983-C05841--
N-methylpipecolateN-methyl pipecolic acidME322958----
N-methylprolineN-Methyl-prolineME322959----
N-monomethylarginineTarginineME322960-C03884--
nodecanoate (19:0)Nonadecylic acidME322984-C16535--
N-palmitoyl-sphinganine (d18:0/16:0)Cer 18:0;O2/16:0ME322961----
N-palmitoyl-sphingosine (d18:1/16:0)Cer 18:1;O2/16:0ME322962-C00195--
octanoylcarnitineCAR 8:0ME322986-C02838--
oleamideOleamideME322987-C19670--
oleate/vaccete (18:1)-ME322988----
oleoylcarnitineCAR 18:1ME322990----
oleoyl ethanolamideOleoyl-EAME322989----
ophthalmateOphthalmic acidME322991----
ornithineOrnithineME322992-C00077--
orotateOrotic acidME322993-C00295--
orotidineOrotidineME322994-C01103--
O-sulfo-L-tyrosineSulfotyrosineME322985----
oxalate (ethanedioate)Oxalic acidME322995-C00209--
oxypurinolOxypurinolME322996-C07599--
palmitate (16:0)Palmitic acidME322999-C00249--
palmitoleate (16:1n7)Palmitoleic acidME323000-C08362--
palmitoylcarnitineCAR 16:0ME323004-C02990--
palmitoylcholinePalmitoylcholineME323005----
palmitoyl dihydrosphingomyelin (d18:0/16:0)*SM 18:0;O2/16:0ME323001----
palmitoyl ethanolamidePalmitoyl-EAME323002-C16512--
palmitoyl sphingomyelin (d18:1/16:0)SM 18:1;O2/16:0ME323003----
pantothetePantothenic acidME323006-C00864--
p-cresol-glucuronide*P-Cresol glucuronideME322998----
p-cresol sulfatep-Cresol sulfateME322997----
pelargote (9:0)Pelargonic acidME323007-C01601--
penicillin GPenicillin GME323008-C05551--
phenol sulfatePhenyl hydrogen sulfateME323009----
phenylacetylglutamateN-Phenylacetylglutamic acidME323010----
phenylacetylglutaminealpha-N-PhenylacetylglutamineME323011-C04148--
phenylacetylglycinePhenylacetylglycineME323012-C05598--
phenylalaninePhenylalanineME323013-C00079--
phenylalanylalaninePhe-AlaME323014----
phenylalanylglycinePhe-GlyME323015----
phenyllactate (PLA)Phenyllactic acidME323016-C01479--
phosphatePhosphoric acidME323017-C00009--
phosphoenolpyruvate (PEP)Phosphoenolpyruvic acidME323018-C00074--
phosphoethanolaminePhosphoethanolamineME323019-C00346--
phosphopantetheinePantetheine 4'-phosphateME323020-C01134--
phytosphingosinePhytosphingosineME323021-C12144--
picolitePicolinic acidME323022-C10164--
pimelate (heptanedioate)Pimelic acidME323023-C02656--
pipecolatePipecolic acidME323024-C00408--
piperinePiperineME323025-C03882--
pregnen-diol disulfate*-ME323027----
pregnenolone sulfatePregnenolone sulfateME323028----
pregn steroid monosulfate*Pregnenolone sulfateME323026----
pro-hydroxy-proPro-hydroxyProME323029----
prolineProlineME323030-C00148--
prolylglutaminePro-GlnME323031----
prolylglycinePro-GlyME323032----
propionylcarnitineCAR 3:0ME323033-C03017--
pseudoephedrinePseudoephedrineME323034-C02765--
pseudouridinePseudouridineME323035-C02067--
pterinPterinME323036-C00715--
putrescinePutrescineME323037-C00134--
pyridoxalPyridoxalME323038-C00250--
pyridoxal phosphatePyridoxal 5'-phosphateME323039-C00018--
pyridoxaminePyridoxamineME323040-C00534--
pyridoxamine phosphatePyridoxamine 5'-phosphateME323041-C00647--
pyridoxate4-Pyridoxic acidME323042-C00847--
pyridoxine (Vitamin B6)PyridoxineME323043-C00314--
pyroglutamine*PyroglutamineME323044----
pyruvatePyruvic acidME323045-C00022--
quinoliteQuinolinic acidME323046-C03722--
raffinoseRaffinoseME323047-C00492--
retilRetinalME323048-C00376--
retinol (Vitamin A)RetinolME323049-C00473--
ribitolRibitolME323050-C00379--
riboflavin (Vitamin B2)RiboflavinME323051-C00255--
riboseRiboseME323053-C00121--
riboteRibonic acidME323052-C01685--
ribulose/xyluloseXyluloseME323054----
S-1-pyrroline-5-carboxylate1-Pyrroline-5-carboxylic acidME323055-C04322--
saccharopineSaccharopineME323061-C00449--
S-adenosylhomocysteine (SAH)S-AdenosylhomocysteineME323056-C00021--
S-adenosylmethionine (SAM)S-AdenosylmethionineME323057-C00019--
salicylateSalicylic acidME323062-C00805--
salicyluric glucuronide*Salicyluric glucuronideME323063----
sarcosine (N-Methylglycine)SarcosineME323064-C00213--
S-carboxymethyl-L-cysteineS-Carboxymethyl-cysteineME323058----
sebacate (decanedioate)Sebacic acidME323065-C08277--
sedoheptulose-7-phosphateSedoheptulose 7-phosphateME323066----
serineSerineME323067-C00065--
S-methylcysteineMethylcysteineME323059----
S-methylglutathioneS-MethylglutathioneME323060----
solanidineSolanidineME323068-C06543--
spermidineSpermidineME323069-C00315--
spermineSpermineME323070-C00750--
sphinganineSphinganineME323071-C00836--
sphingomyelin (d18:1/14:0, d16:1/16:0)*SM 32:1;O2ME323072----
sphingomyelin (d18:1/15:0, d16:1/17:0)*SM 33:1;O2ME323073----
sphingomyelin (d18:1/17:0, d17:1/18:0, d19:1/16:0)SM 35:1;O2ME323074----
sphingomyelin (d18:1/18:1, d18:2/18:0)SM 36:2;O2ME323075-C00550--
sphingomyelin (d18:1/20:0, d16:1/22:0)*SM 38:1;O2ME323076----
sphingomyelin (d18:1/20:1, d18:2/20:0)*SM 38:2;O2ME323077----
sphingomyelin (d18:1/21:0, d17:1/22:0, d16:1/23:0)...SM 39:1;O2ME323078----
sphingomyelin (d18:1/22:1, d18:2/22:0, d16:1/24:1)...SM 40:2;O2ME323079----
sphingomyelin (d18:1/24:1, d18:2/24:0)*SM 42:2;O2ME323080----
sphingomyelin (d18:2/16:0, d18:1/16:1)*SM 34:2;O2ME323081----
sphingomyelin (d18:2/23:0, d18:1/23:1, d17:1/24:1)...SM 41:2;O2ME323082----
sphingomyelin (d18:2/24:1, d18:1/24:2)*SM 42:3;O2ME323083----
sphingosineSphingosineME323084-C00319--
stachydrineStachydrineME323085-C10172--
stearate (18:0)Stearic acidME323086-C01530--
stearidote (18:4n3)Stearidonic acidME323087-C16300--
stearoylcarnitineCAR 18:0ME323090----
stearoyl ethanolamideStearoyl-EAME323088----
stearoyl sphingomyelin (d18:1/18:0)SM 18:1;O2/18:0ME323089-C00550--
suberate (octanedioate)Suberic acidME323091-C08278--
suberoyl carnitineCAR DC8:0ME323092----
succinimideSuccinimideME323094-C07273--
succinylcarnitineCAR DC4:0ME323095----
succiteSuccinic acidME323093-C00042--
sucroseSucroseME323096-C00089--
sulfate*SulfateME323097-C00059--
tartrote (hydroxymalote)Hydroxypropanedioic acidME323098-C02287--
taurineTaurineME323099-C00245--
taurochenodeoxycholateTaurochenodeoxycholic acidME323100-C05465--
taurocholateTaurocholic acidME323101-C05122--
taurocholete sulfate-ME323102----
taurodeoxycholateTaurodeoxycholic acidME323103-C05463--
taurolithocholateTaurolithocholic acidME323104-C02592--
taurolithocholate 3-sulfateTaurolithocholic acid sulfateME323105-C03642--
tauroursodeoxycholateTauroursodeoxycholic acidME323106----
tetradecanedioateTetradecanedioic acidME323107-C11002--
tetrahydrocortisolTetrahydrocortisolME323108-C05472--
theobromineTheobromineME323109-C07480--
theophyllineTheophyllineME323110-C07130--
thiamin (Vitamin B1)ThiamineME323111-C00378--
threonineThreonineME323113-C00188--
threonylphenylalanineThr-PheME323114----
threoteThreonic acidME323112-C01620--
thymineThymineME323115-C00178--
tiglylcarnitineCAR 4:1;2MeME323116----
trans-4-hydroxyprolinetrans-4-HydroxyprolineME323117-C01157--
trans-urocateUrocanic acidME323118-C00785--
tricarballylate1,2,3-Propanetricarboxylic acidME323119-C19806--
tricosanoyl sphingomyelin (d18:1/23:0)*SM 18:1;O2/23:0ME323120----
trigonelline (N'-methylnicotite)TrigonellineME323121-C01004--
trimethylamine N-oxideTrimethylamine N-oxideME323122-C01104--
tryptophanTryptophanME323123-C00078--
tryptophan betaineLenticinME323124----
tryptophylglycineTrp-GlyME323125----
tyrosineTyrosineME323126-C00082--
tyrosylglycineTyr-GlyME323127----
UDP-acetylglucosamine/galactosamine-ME323128----
UDP-galactoseUDP-galactoseME323129-C00052--
UDP-glucoseUDP-glucoseME323130-C00029--
UDP-glucuroteUDP-glucuronic acidME323131-C00167--
undecanedioateUndecanedioic acidME323132----
uracilUracilME323133-C00106--
urateUric acidME323134-C00366--
ureaUreaME323135-C00086--
uridineUridineME323136-C00299--
uridine 2'-monophosphate (2'-UMP)*UDP-N-acetylglucosamineME323137----
uridine 3'-monophosphate (3'-UMP)3'-UMPME323138----
uridine 5'-monophosphate (UMP)UMPME323139-C00105--
valerylglycineValerylglycineME323140----
valineValineME323141-C00183--
valylglutamineVal-GlnME323142----
valylglycineVal-GlyME323143----
valylleucineVal-LeuME323144----
vanillylmandelate (VMA)Vanillylmandelic acidME323145-C05584--
vecuroniumVecuroniumME323146----
venlafaxineVenlafaxineME323147-C07187--
xanthineXanthineME323148-C00385--
xanthosineXanthosineME323149-C01762--


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