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Analysis: GC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,2-anhydro-myo-inositol NIST1,2-Anhydro-myo-inositolME136232119054-651472318
1-hexadecanolCetyl alcoholME1362312682C00823679596299
1-methylinosine NIST1-MethylinosineME13623065095-1026110259
1-monooleinMG 18:1(9Z)/0:0/0:0ME1362295283468-952623129
1-monopalmitinMG 16:0/0:0/0:0ME13622814900C01885901749129
1-monostearinMG 18:0/0:0/0:0ME13622724699D01947959214203
2,5-dihydroxypyrazine NIST2,5-DihydroxypyrazineME13623323368901-397526241
2-hydroxyglutaric acid2-Hydroxyglutaric acidME13622643C02630506306247
2-hydroxypyrazinyl-2-propenoic acid ethyl ester NI...-ME136225--493127121
2-monooleinMG 0:0/18:1(9Z)/0:0ME1362245319879-941794129
2-monopalmitinMG 0:0/16:0/0:0ME136223123409-890356129
3 hydroxy-3-methylglutaric acid3-Hydroxymethylglutaric acidME1362221662C03761519310247
3-phenyllactic acidPhenyllactic acidME136221--516011193
3-phosphoglycerate3-Phosphoglyceric acidME136220724C00597610734227
5-aminovaleric acid5-Aminopentanoic acidME136219138C00431536657174
5-deoxy-5-methylthioadenosine5'-MethylthioadenosineME136218439176C00170967036236
5-methoxytryptamine5-MethoxytryptamineME1362171833C05659864466174
aconitic acidcis-Aconitic acidME136216643757C00417586815229
adenineAdenineME136215190C00147646534264
adenosineAdenosineME13621460961C00212918039236
adenosine-5-monophosphateAMPME1362136083C000201041375315
adipic acidAdipic acidME136212196C06104474435111
alanineAlanineME1362115950C00041243971116
alpha-aminoadipic acidalpha-Aminoadipic acidME136210--573295260
alpha-ketoglutarate2-Oxoglutaric acidME13620951C00026507392198
aminomalonateAminomalonic acidME136208100714C00872455754218
arabitolArabitolME13620794154C01904570685217
arachidic acidArachidic acidME13620610467C06425856421117
asparagineAsparagineME1362056267C00152553078188
aspartic acidAspartic acidME1362045960C00049433075160
behenic acidBehenic acidME1362038215C08281920648117
benzoic acidBenzoic acidME136202243C00180339214179
beta-alaninebeta-AlanineME136201239C00099435564248
beta-glycerolphosphatesn-Glycero-2-phosphateME1362002526C02979574470243
bisphosphoglycerol NIST-ME136199102018-764660299
capric acidCapric acidME1361982969C01571452386229
cerotinic aciCerotic acidME13619710469-1033286145
cholesterolCholesterolME1361965997C001871078536129
cis-gondoic acidcis-Gondoic acidME1361955282768C16526847372367
citric acidCitric acidME136194311C00158617342273
creatinineCreatinineME136193588C00791502599115
cysteineCysteineME1361925862C00097500158220
cysteine-glycineCys-GlyME136191439498C01419715335220
cystineCystineME136190595C01420804619218
cytidineCytidineME136189--934269223
cytidine-5-monophosphateCMPME136188--700635243
dehydroabietic acidDehydroabietic acidME13618794391C12078850374239
D-erythro-sphingosineSphingosineME136186--859500204
dihydrocholesterolDihydrocholesterolME13618566066C129781082070215
dihydroxyacetoneDihydroxyacetoneME136184670C0018433212089
docosahexaenoic acidDocosahexaenoic acidME136183--90281991
dodecanolDodecanolME1361828193C02277507619243
erythritolErythritolME136181222285C00503471922217
erythroseErythroseME136180439574C01796443306205
ethanolamineEthanolamineME136179700C00189343800174
fructoseFructoseME136178439709C02336641863307
fructose-1-phosphateFructose 1-phosphateME136177439394C01094803180387
fructose-6-phosphateFructose 6-phosphateME136176440641C05345804279315
fucoseFucoseME136175439650C02095578299160
fumaric acidFumaric acidME136174444972C00122390016245
galactinolGalactinolME13617311727586C012351017580204
glucoheptuloseGlucoheptuloseME1361725459879C02076828606217
glucoseGlucoseME13617164689C00221659798319
glucose-1-phosphateGlucose 1-phosphateME13617065533C00103597071217
glucose-6-phosphateGlucose 6-phosphateME136169439427C01172810287387
glutamic acidGlutamic acidME13616833032C00025489240174
glutamineGlutamineME1361675961C00064600315156
glutaric acidGlutaric acidME136166743C00489421260261
glutathioneGlutathioneME136165124886C00051761296213
glyceric acidGlyceric acidME136164439194C00258377495189
glycerol-3-galactosideGalactosylglycerolME13616316048618C05401805227204
glycerol-alpha-phosphatesn-Glycero-3-phosphateME136162754C03189590747357
glycineGlycineME136161750C00037368707248
glycocyamineGuanidoacetic acidME136160763C00581510732171
glycolic acidGlycolic acidME136159757C00160227636177
glycyl tyrosineGly-TyrME13615892829-922071174
guanineGuanineME136157764C00242744307352
guanosineGuanosineME1361566802C00387954962324
heptadecanoic acidMargaric acidME13615510465-751309117
hexitolSorbitolME136154453C00392704741217
hexoseHexoseME136153206C00738642640319
hexose-6-phosphateHexose 6-phosphateME136152208C02965806282387
hexuronic acidHexuronic acidME136151152867-667373160
histidineHistidineME1361506274C00135663790154
homoserineHomoserineME13614912647C00263443878218
hydroquinoneHydroquinoneME136148785C00530422583239
hydroxylamineHydroxylamineME136147787C00192253158146
hypoxanthineHypoxanthineME136146790C00262619128265
indole-3-lactateIndolelactic acidME13614592904C02043764586202
inosineInosineME1361446021C00294897184230
inosine-5-monophosphateIMPME1361438582C001301018687169
inositol-4-monophosphateInositol 4-phosphateME136142440043C03546845976315
isohexonic acid-ME136141604-698302333
isoleucineIsoleucineME1361406306C00407359251158
isothreonic acidD-Threonic acidME136139151152C00639489385292
lactic acidLactic acidME136138612C01432217657191
lactitolLactitolME136137157355C13542959541361
lactoseLactoseME136136440995C00243935640191
lactuloseLactuloseME13613511333C07064929908204
lauric acidLauric acidME1361343893C02679547906117
leucineLeucineME1361336106C00123345168158
levoglucosanGlucosanME1361322724705-569637204
lignoceric acidLignoceric acidME13613111197C08320978597132
lysineLysineME1361305962C00047663483156
lyxitolL-ArabitolME136129439255C00532573587217
maleimideMaleimideME13612810935C07272245118154
malic acidMalic acidME136127525C00711463180233
mannitolMannitolME1361266251C00392663215319
mannose-6-phosphate NISTMannose 6-phosphateME13612565127C00275822643387
methanolphosphateMethanolphosphateME13612413130-289520241
methionineMethionineME1361236137C00073483560176
methionine sulfoxideMethionine sulfoxideME136122158980C02989637588128
monomyristinMG 14:0ME13612179050-838305343
myo-inositolMyo-inositolME136120892C00137730022305
myristic acidMyristic acidME13611911005C06424634414285
N-acetylaspartic acidN-Acetylaspartic acidME13611865065C01042548028158
N-acetyl-D-galactosamineN-Acetyl-D-galactosamineME136117--723255202
n-acetyl-d-hexosamineN-AcetylhexosamineME13611624139C03878746341319
N-acetylglutamateN-Acetylglutamic acidME13611570914C00624604748216
N-acetylmannosamineN-Acetyl-mannosamineME136114439281C00645735323319
nicotinamideNiacinamideME136113936C00153471602179
N-methylalanineN-MethylalanineME136112-C02721285825130
octadecanolStearyl alcoholME1361118221-755409327
oleic acidOleic acidME136110445639C00712779120339
O-phosphoserineDL-O-PhosphoserineME13610957689797C01005624355356
ornithineOrnithineME1361086262C00077527113142
orotic acidOrotic acidME136107967C00295586317254
oxalic acidOxalic acidME136106971C00209260513190
oxoprolineOxoprolineME1361057405C01879485935156
palatinitol1,2,3-ButanetriolME136104--996670204
palmitic acidPalmitic acidME136103985C00249713809313
palmitoleic acidPalmitoleic acidME136102445638C08362704511311
pantothenic acidPantothenic acidME1361016613C12276690887291
pelargonic acidPelargonic acidME1361008158C01601399229117
pentadecanoic acidPentadecylic acidME13609913849C16537674647117
pentitolArabitolME136098827D00061563801307
phenylalaninePhenylalanineME1360976140C00079537804218
phosphatePhosphoric acidME1360961004C00009348274314
phosphoenolpyruvatePhosphoenolpyruvic acidME136095--518184211
phosphoethanolaminePhosphoethanolamineME1360941015C00346603912299
p-hydroxylphenyllactic acid4-Hydroxyphenyllactic acidME1360939378C03672654036308
pipecolinic acidPipecolic acidME1360926931662-404121156
prolineProlineME136091145742C00148364716142
putrescinePutrescineME1360901049C00138588119174
pyridoxal-5-phosphatePyridoxal 5'-phosphateME1360891051C00018825754219
pyrophosphatePyrophosphateME1360881023C00013327517110
pyruvic acidPyruvic acidME1360871060C00022211668174
ribitolRibitolME136086827C00474575497217
riboseRiboseME1360855779C00121553135217
ribose-5-phosphateRibose 5-phosphateME136084439167C00117731096315
ribulose-5-phosphateRibulose 5-phosphateME136083439184C00199735908357
saccharopineSaccharopineME136082160556C00449865907156
serineSerineME1360815951C00065395020218
sorbitolSorbitolME1360805780C00794667922217
spermidineSpermidineME1360791102C00315792924144
spermineSpermineME136078--92970286
stearic acidStearic acidME1360775281C01530787622117
sucroseSucroseME1360765988C00089912704271
taurineTaurineME1360751123C00245556690326
terephthalic acidTerephthalic acidME1360747489C06337612262295
threonic acidThreonic acidME1360735460407C01620497572292
threonineThreonineME1360726288C00188409568218
thymineThymineME1360711135C00178420133255
tocopherol alpha-alpha-TocopherolME136070638015C003761067809237
trans-4-hydroxy-L-prolinetrans-4-HydroxyprolineME136069--459475158
trehaloseTrehaloseME136068--948197191
tryptophanTryptophanME1360676305C00078780482202
tyrosineTyrosineME1360666057C00082671252218
UDP GlcNAcUDP-N-acetylglucosamineME136064445675C00043627437226
UDP-glucuronic acidUDP-glucuronic acidME13606517473C00167587601217
uracilUracilME1360631174C00106385735241
ureaUreaME1360621176C00086338716189
uridine-5-monophosphateUMPME1360616030-980179169
valineValineME1360606287C00183313502144
xanthineXanthineME1360591188C00385701688353
xanthosineXanthosineME13605864959C01762926133325
xylitolXylitolME1360576912C00379567437217
xylonolactone NISTD-Xylono-1,5-lactoneME136056439692C02266535176217
xyloseXyloseME136055--544100103
xylulose NISTXyluloseME136054439205C00312553450173


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