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Analysis: GC UNSPECIFIED ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
parabanic acid NISTParabanic acidME39743167126C00802464991100
gamma-aminobutyric acidgamma-Aminobutyric acidME397501119C00334364801102
pyrophosphatePyrophosphateME3974211023C00013327517110
adipic acidAdipic acidME397541196C06104474435111
creatinineCreatinineME397519588C00791502599115
alanineAlanineME3975405950C00041243971116
arachidic acidArachidic acidME39753610467C06425856421117
cis-gondoic acidcis-Gondoic acidME3975235282768C16526847372117
heptadecanoic acidMargaric acidME39748610465-751309117
lauric acidLauric acidME3974683893C02679547906117
nonadecanoic acidNonadecylic acidME39744312591C16535822782117
pelargonic acidPelargonic acidME3974308158C01601399229117
pentadecanoic acidPentadecylic acidME39742913849C16537674647117
stearic acidStearic acidME3974095281C01530787622117
methionine sulfoxideMethionine sulfoxideME397451158980C02989637588128
1-monooleinMG 18:1(9Z)/0:0/0:0ME3975585283468-952623129
1-monopalmitinMG 16:0/0:0/0:0ME39755714900C01885901749129
2-monooleinMG 0:0/18:1(9Z)/0:0ME3975535319879-941794129
beta-sitosterolSitosterolME397529222284C017531128225129
cholesterolCholesterolME3975255997C001871078536129
N-methylalanineN-MethylalanineME397445-C02721285825130
lignoceric acidLignoceric acidME39746511197C08320978597132
butyrolactam NIST2-PyrrolidinoneME39752812025-277199142
ornithineOrnithineME3974396262C00077619548142
prolineProlineME397423145742C00148364716142
valineValineME3973896287C00183313502144
hydroxylamineHydroxylamineME397479787C00192255241146
linoleic acidLinoleic acidME3974645280450C01595777414150
maleimideMaleimideME39745910935C07272245118154
glutamineGlutamineME3974965961C00064600315156
lysineLysineME3974625962C00047663483156
oxoprolineOxoprolineME3974367405C01879485935156
pipecolinic acidPipecolic acidME3974246931662-404121156
citrullineCitrullineME3975219750C00327621404157
isoleucineIsoleucineME3974736306C00407359251158
leucineLeucineME3974676106C00123345168158
N-acetylaspartic acidN-Acetylaspartic acidME39744665065C01042548028158
trans-4-hydroxy-L-prolinetrans-4-HydroxyprolineME3973985810C01157457910158
cellobioseCellobioseME3975266255C01971943858160
fucoseFucoseME397505439650C02095578299160
hexuronic acidHexuronic acidME397482152867-667373160
inosine-5'-monophosphateIMPME3974768582C001301018687169
thymidineThymidineME3974015789C00214349402170
dehydroascorbic acidL-Dehydroascorbic acidME397515440667C05422632888173
xylulose NISTXyluloseME397384439205C00312553450173
5-methoxytryptamine5-MethoxytryptamineME3975471833C05659864466174
ethanolamineEthanolamineME397509700C00189344719174
putrescinePutrescineME3974221049C00138588119174
pyruvic acidPyruvic acidME3974201060C00022211003174
methionineMethionineME3974526137C00073483560176
glycolic acidGlycolic acidME397488757C00160227215177
benzoic acidBenzoic acidME397532243C00180339067179
nicotinamideNiacinamideME397444936C00153469827179
octanol NISTn-OctanolME397441957C00756247010187
asparagineAsparagineME3975346267C00152553078188
glyceric acidGlyceric acidME397493439194C00258377495189
ureaUreaME397392--329351189
oxalic acidOxalic acidME397438971C00209260513190
oxamic acidOxamic acidME397437974C01444338255190
3-hydroxybutyric acid3-Hydroxybutyric acidME39755192135C01089278632191
lactic acidLactic acidME397471612C01432217657191
lactoseLactoseME397469440995C00243935640191
N-acetyl-D-galactosamineN-Acetyl-D-galactosamineME397448--723255202
tryptophanTryptophanME3973976305C00078780482202
1-monostearinMG 18:0/0:0/0:0ME39755624699D01947959214203
glycerol-3-galactosideGalactosylglycerolME39749116048618C05401800205204
levoglucosanGlucosanME3974662724705-569637204
maltoseMaltoseME397457439186C00208954710204
glycerolGlycerolME397492753C00116344466205
hexadecylglycerol NISTMG O-16:0ME397485--867593205
mannoseMannoseME39745418950C00159645856205
glutathioneGlutathioneME397494124886C00051761296213
dihydrocholesterolDihydrocholesterolME39751466066C129781082070215
lithocholic acidLithocholic acidME3974639903C039901104161215
1,5-anhydroglucitol1,5-AnhydrosorbitolME39755564960C07326633969217
arabitolArabitolME39753794154C01904570685217
erythronic acidErythronic acidME3975112781043-512029217
glucose-1-phosphateGlucose 1-phosphateME39749965533C00103594647217
hexitolSorbitolME397484453C00392704741217
lyxoseLyxoseME397461439240C00476541086217
riboseRiboseME3974175779C00121553135217
sorbitolSorbitolME3974115780C00794667922217
UDP-glucuronic acidUDP-glucuronic acidME39739517473C00167587601217
uridineUridineME3973906029C00299861508217
xylitolXylitolME3973866912C00379567437217
xylonolactone NISTD-Xylono-1,5-lactoneME397385439692C02266535176217
3-(1-pyrazolyl)-L-alanine3-(Pyrazol-1-yl)-L-alanineME397552151491-499548218
aminomalonateAminomalonic acidME397538100714C00872455754218
homoserineHomoserineME39748112647C00263443878218
phenylalaninePhenylalanineME3974286140C00079537804218
serineSerineME3974135951C00065395020218
threonineThreonineME3974026288C00188409568218
tyrosineTyrosineME3973966057C00082671252218
cysteineCysteineME3975185862C00097500158220
4-hydroxybenzoate4-Hydroxybenzoic acidME397548135C00156537925223
UDP GlcNAcUDP-N-acetylglucosamineME397394445675C00043627437226
3-phosphoglycerate3-Phosphoglyceric acidME397550724C00597610734227
sulfuric acidTG 16:0_18:1_18:1ME3974061118C00059282411227
aconitic acidcis-Aconitic acidME397545643757C00417586815229
capric acidCapric acidME3975272969C01571451790229
inosineInosineME3974776021C00294897184230
3,6-anhydro-D-galactose3,6-Anhydro-galactoseME39754916069996C06474588886231
aspartic acidAspartic acidME3975335960C00049480387232
lactamideLactamideME39747294220-265698232
malic acidMalic acidME397458525C00711463180233
5'-deoxy-5'-methylthioadenosine5'-MethylthioadenosineME397546439176C00170967036236
adenosineAdenosineME39754360961C00212918039236
tocopherol alpha-alpha-TocopherolME397399638015C003761067809237
dehydroabietic acidDehydroabietic acidME39751694391C12078850374239
hydroquinoneHydroquinoneME397480785C00530422583239
2,5-dihydroxypyrazine NIST2,5-DihydroxypyrazineME39756023368901-397526241
methanolphosphateMethanolphosphateME39745313130-289520241
uracilUracilME3973931174C00106385735241
beta-glycerolphosphatesn-Glycero-2-phosphateME3975302526C02979574470243
cytidine-5-monophosphateCMPME397517--700635243
dodecanolDodecanolME3975128193C02277507619243
fumaric acidFumaric acidME397504444972C00122390016245
maleic acidMaleic acidME397460444266C01384363611245
glutamic acidGlutamic acidME39749733032C00025529100246
2-hydroxyglutaric acid2-Hydroxyglutaric acidME39755443C02630506306247
erythronic acid lactoneErythrono-1,4-lactoneME3975105325915C02341407495247
succinic acidSuccinic acidME3974081110C00042370737247
beta-alaninebeta-AlanineME397531239C00099435564248
glycineGlycineME397489750C00037368707248
thymineThymineME3974001135C00178420133255
allantoic acidAllantoic acidME397539203C00499723539259
pinitolPinitolME397425164619C03844622466260
glutaric acidGlutaric acidME397495743C00489421260261
adenineAdenineME397544190C00147646534264
hypoxanthineHypoxanthineME397478790C00262619128265
salicylic acidSalicylic acidME397414338C00805480699267
sucroseSucroseME3974075988C00089912704271
citric acidCitric acidME397522311C00158617342273
myristic acidMyristic acidME39744911005C06424634414285
pantothenic acidPantothenic acidME3974326613C12276690887291
ribonic acidRibonic acidME3974185460677C01685599680292
threonic acidThreonic acidME3974035460407C01620497572292
terephthalic acidTerephthalic acidME3974047489C06337612262295
1-hexadecanolCetyl alcoholME3975592682C00823679596299
phosphoethanolaminePhosphoethanolamineME3974261015C00346604335299
myo-inositolMyo-inositolME397450892C00137730022305
fructoseFructoseME397508439709C02336641863307
p-hydroxylphenyllactic acid4-Hydroxyphenyllactic acidME3974359378C03672654036308
palmitoleic acidPalmitoleic acidME397433445638C08362706508311
palmitic acidPalmitic acidME397434985C00249713809313
phosphatePhosphoric acidME3974271004C00009345365314
adenosine-5-monophosphateAMPME3975426083C000201041375315
fructose-6-phosphateFructose 6-phosphateME397506440641C05345804279315
inositol-4-monophosphateInositol 4-phosphateME397475440043C03546846510315
ribose-5-phosphateRibose 5-phosphateME397416439167C00117733959315
conduritol-beta-epoxideConduritol epoxideME3975209989541-675635318
galactoseGalactoseME397503439357C00984648756319
glucoseGlucoseME39750064689C00221659798319
mannitolMannitolME3974556251C00392663215319
n-acetyl-d-hexosamineN-AcetylhexosamineME39744724139C03878746341319
sophoroseSophoroseME397412441432C08250972799319
guanosineGuanosineME3974876802C00387954962324
xanthosineXanthosineME39738764959C01762926133325
taurineTaurineME3974051123C00245556690326
octadecanolStearyl alcoholME3974428221-755409327
isohexonic acid-ME397474604-698302333
oleic acidOleic acidME397440445639C00712779120339
xanthineXanthineME3973881188C00385701688353
glycerol-alpha-phosphatesn-Glycero-3-phosphateME397490754C03189590747357
ribulose-5-phosphateRibulose 5-phosphateME397415439184C00199735908357
lactitolLactitolME397470157355C13542959541361
maltotrioseMaltotrioseME397456439586C018351176044361
raffinoseRaffinoseME397419439242C004921120886361
isogondoic acidcis-Gondoic acidME3975245282768C16526851223367
fructose-1-phosphateFructose 1-phosphateME397507439394C01094803180387
galactose-6-phosphateGalactose 6-phosphateME397502439404C01113828102387
glucose-6-phosphateGlucose 6-phosphateME3974985958C00092818275387
hexose-6-phosphateHexose 6-phosphateME397483208C02965806282387
uric acidUric acidME3973911175C00366730691441
arachidonic acidArachidonic acidME397535444899C0021983433991
docosahexaenoic acidDocosahexaenoic acidME397513--90281991
squaleneSqualeneME397410638072C0075197623795


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