Return to study ST002032 main page

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
L-alanineAlanineME471283-C00041--
L-arginineArginineME471284-C00062--
L-asparagineAsparagineME471285-C00152--
L-aspartateAspartic acidME471286-C00049--
L-glutamateGlutamic acidME471287-C00025--
L-glutamineGlutamineME471288-C00064--
L-histidineHistidineME471289-C00135--
L-leucine/isoleucineLeucine/IsoleucineME471290-C00123--
L-lysineLysineME471291-C00047--
L-methionineMethionineME471292-C00073--
L-phenylalaninePhenylalanineME471293-C00079--
L-prolineProlineME471294-C00148--
L-serineSerineME471295-C00065--
L-threonineThreonineME471296-C00188--
L-tryptophanTryptophanME471297-C00078--
L-tyrosineTyrosineME471298-C00082--
L-valineValineME471299-C00183--
L-cystineCystineME471300-C00491--
CytosineCytosineME471301-C00380--
IDPIDPME471302-C00104--
AllantoateAllantoic acidME471303-C00499--
5-Hydroxyisourate5-Hydroxyisouric acidME471304-C11821--
2',3'-Cyclic CMP2',3' cyclic CMPME471305-C02354--
5-6-DihydrothymineDihydrothymineME471306-C00906--
PyridoxalPyridoxalME471307-C00250--
Pyridoxamine 5'-phosphatePyridoxamine 5'-phosphateME471308-C00647--
NicotinamideNiacinamideME471309-C00153--
PhosphatePhosphoric acidME471310-C00009--
GlutathioneGlutathioneME471311-C00051--
Glutathione disulfideOxidized glutathioneME471312-C00127--
5-OxoprolinePyroglutamic acidME471313-C01879--
S-Glutathionyl-L-cysteineS-Glutathionyl-cysteineME471314-C05526--
DimethylglycineDimethylglycineME471315-C01026--
PhosphoserinePhosphoserineME471316-C02532--
OrnithineOrnithineME471317-C01602--
L-CitrullineCitrullineME471318-C00327--
SpermidineSpermidineME471319-C00315--
5-Guanidino-2-oxopentanoate2-OxoarginineME471320-C03771--
CreatineCreatineME471321-C00300--
CreatinineCreatinineME471322-C00791--
N-AcetylornithineN-AcetylornithineME471323-C00437--
GuanidinoacetateGuanidoacetic acidME471324-C00581--
trans-4-Hydroxy-L-prolinetrans-4-HydroxyprolineME471325-C01157--
PantothenolPantothenolME471326-C00864--
5-6-DihydrouracilDihydrouracilME471327-C00429--
TaurineTaurineME471328-C00245--
L-Methionine S-oxideMethionine sulfoxideME471329-C02989--
IndoleIndoleME471330-C00463--
Indole-3-acetaldehydeIndoleacetaldehydeME471331-C00637--
Indole-3-acetateIndoleacetic acidME471332-C00954--
IndoxylIndoxylME471333-C05658--
kynurenineKynurenineME471334-C00328--
Anthranilate2-Aminobenzoic acidME471335-C00108--
SerotoninSerotoninME471336-C00780--
EctoineEctoineME471337-C06231--
N-Methylethanolamine phosphateN-Methylethanolamine phosphateME471338-C01210--
SphingosineSphingosineME471339-C00319--
Sphingosine 1-phosphateSphingosine 1-phosphateME471340-C06124--
AcetylcholineAcetylcholineME471341-C01996--
L-CarnitineCarnitineME471342-C00318--
acetyl-carnitine (acyl-C2)CAR 2:0ME471343-C02571--
propionyl-carnitine (acyl-C3)CAR 3:0ME471344-C03017--
butanoyl-l-carnitine (acyl-C4)CAR 4:0ME471345-C02862--
acyl-C4-OH (Hydroxybutyrylcarnitine)CAR 4:0;OHME471346-HMDB13127--
acyl-C5:1 (Tiglylcarnitine)CAR 5:1ME471347-HMDB02366--
acyl-C5-OH (hydroxyisovalerylcarnitine)-ME471348-ac107--
hexanoyl-L-carnitine (acyl-C6)CAR 6:0ME471349-HMDB00756--
L-octanoylcarnitine (acyl-C8)CAR 8:0ME471350-C02838--
O-Decenoyl-L-carnitine (acyl-C10:1)-ME471351-CID57357170--
O-dodecanoyl-carnitine (acyl-C12)CAR 12:0ME471352-HMDB02250--
O-dodecenoyl-carnitine (acyl-C12:1)CAR 12:1ME471353-HMDB13326--
O-tetradecanoyl-L-carnitine (acyl-C14)CAR 14:0ME471354-HMDB05066--
Tetradecenoyl Carnitine (acyl-C14:1)CAR 14:1ME471355-HMDB13329--
L-Palmitoylcarnitine (acyl-C16)CAR 16:0ME471356-C02990--
Hexadecenoyl-carnitine (acyl-C16:1)CAR 16:1ME471357-HMDB06317--
O-octadecenoyl-L-carnitine (acyl-C18:1)CAR 18:1ME471358-HMDB06351--
acyl-C18:2 (Linoleoyl-CoA)Linoleoyl-CoAME471359-HMDB01064--
acyl-C18:2-OHCAR 18:2;OHME471360-ac123--
acyl-C20:4CAR 20:4ME471361-ac125--


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
dAMPdAMPME471362-C00360--
AdenineAdenineME471363-C00147--
CMPCMPME471364-C00055--
ThymidineThymidineME471365-C00214--
ThymineThymineME471366-C00178--
InosineInosineME471367-C00294--
XanthineXanthineME471368-C00385--
(S)(+)-AllantoinAllantoinME471369-C02350--
UrateUric acidME471370-C00366--
3',5'-Cyclic IMP3',5' cyclic IMPME471371-C00943--
DiphosphatePyrophosphateME471372-C00013--
D-GlucoseGlucoseME471373-C00031--
D-Glucose 6/1-phosphateHexose 6-phosphateME471374-C02965--
D-Glyceraldehyde 3-phosphate/Glycerone phosphateGlyceraldehyde 3-phosphateME471375-C00118--
1/2-3-Bisphosphoglycerate3-Phospho-D-glyceroyl dihydrogen phosphateME471376-C00236--
2/3-Phospho-D-glycerate2-Phosphoglyceric acidME471377-C00631--
PhosphoenolpyruvatePhosphoenolpyruvic acidME471378-C00074--
PyruvatePyruvic acidME471379-C00022--
LactateLactic acidME471380-C01432--
Mannitol/SorbitolSorbitolME471381-C00392/C00794--
D-RiboseRiboseME471382-C00121--
D-RhamnoseRhamnoseME471383-C01684--
D-ArabitolArabitolME471384-C01904--
CitrateCitric acidME471385-C00158--
2-Oxoglutarate2-Oxoglutaric acidME471386-C00026--
2-Oxoglutaramate2-Keto-glutaramic acidME471387-C00940--
SuccinateSuccinic acidME471388-C00042--
FumarateFumaric acidME471389-C00122--
MalateMalic acidME471390-C00149--
2-Hydroxyglutarate/Citramalate2-Hydroxyglutaric acidME471391-C02630--
Sedoheptulose 1/7-phosphate-ME471392-C06222--
alpha-D-Ribose 1-phosphateRibose 1-phosphateME471393-C00620--
AscorbateVitamin CME471394-C00072--
DehydroascorbateL-Dehydroascorbic acidME471395-C05422--
gamma-L-Glutamyl-D-alaninegamma-L-Glutamyl-D-alanineME471396-C03738--
(5-L-Glutamyl)-L-glutaminegamma-GlutamylglutamineME471397-C05283--
5-L-Glutamyl-taurine5-L-Glutamyl-taurineME471398-C05844--
TetrahydrofolateTHFME471399-C00101--
N-AcetylneuraminateN-Acetylneuraminic acidME471400-C00270--
N-Glycoloyl-neuraminateN-Glycoloylneuraminic acidME471401-C03410--
alpha-D-Glucosamine 1-phosphateGlucosamine 1-phosphateME471402-C06156--
1-4-beta-D-Xylan-ME471403-C02352--
CMP-N-acetylneuraminateCMP-N-acetylneuraminic acidME471404-C00128--
PhosphocreatinePhosphocreatineME471405-C02305--
4-Acetamidobutanoate4-Acetamidobutanoic acidME471406-C02946--
N-Succinyl-L-glutamate 5-semialdehyde-ME471407-C05932--
Thiosulfate-ME471408-C00320--
3-Sulfocatechol3-SulfocatecholME471409-C06336--
L-CysteateCysteic acidME471410-C00506--
5-Hydroxyindoleacetate5-Hydroxyindoleacetic acidME471411-C05635--
IndolepyruvateIndolepyruvateME471412-C00331--
6-Hydroxykynurenic acid6-Hydroxykynurenic acidME471413-C08480--
8-Methoxykynurenate-ME471414-C05830--
3D-(3-5/4)-Trihydroxycyclohexane-1-2-dione-ME471415-C04287--
Glycerol 3-phosphatesn-Glycero-3-phosphateME471416-C00093--
Ethanolamine phosphatePhosphoethanolamineME471417-C00346--
Sphinganine 1-phosphateSphinganine 1-phosphateME471418-C01120--
Hexanoic acid (caproate)Caproic acidME471419-C01585--
Heptanoic acidHeptylic acidME471420-C17714--
Octanoic acid (caprylic acid)Caprylic acidME471421-C06423--
Nonanoic acid (pelargonic acid)Pelargonic acidME471422-C01601--
Decanoic acid (capric acid)Capric acidME471423-C01571--
Dodecanoic acid (lauric acid)Lauric acidME471424-C02679--
Tetradecanoic acid (myristic acid)Myristic acidME471425-C06424--
Hexadecanoic acid (palmitic acid)Palmitic acidME471426-C00249--
Octadecanoic acid (stearic acid)Stearic acidME471427-C01530--
Tetradecenoic acid (myristoleic acid)Myristoleic acidME471428-C08322--
Hexadecenoic acid (Palmitoleic acid)Palmitoleic acidME471429-C08362--
Octadecenoic acid (Oleic acid)Oleic acidME471430-C00712--
Linoleic acid ((9Z,12Z)-Octadecadienoic acid)Linoleic acidME471431-C01595--
a-Linolenic acid (Octadecatrienoic acid)Octadecatrienoic acidME471432-C06427--
Arachidonic acid (Eicosatetraenoic acid)Eicosatetraenoic acidME471433-C00219--
Stearidonic acid ((6Z,9Z,12Z,15Z)-Octadecatetraeno...Stearidonic acidME471434-C16300--
Docosahexaenoic acidDocosahexaenoic acidME471435-C06429--
Dodecanedioic acidDodecanedioic acidME471436-C02678--
Adrenic acid (7,10,13,16-Docosatetraenoic acid)Adrenic acidME471437-C16527--
Eicosapentaenoic acidEicosapentaenoic acidME471438-C06428--
Dihomo-gamma-linolenic acid ((8Z-11Z-14Z)-Icosatri...Dihomo-gamma-linolenic acidME471439-C03242--
Docosapentaenoic acid ((7Z-10Z-13Z-16Z-19Z)-Docosa...DPAME471440-C16513--
Undecanoic acidUndecylic acidME471441-C17715--
BilirubinBilirubinME471442-C00486--


  logo