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Analysis: HILIC UNSPECIFIED ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1-methylnicotinamide+1-Methyl nicotinamideME540628-C02918--
2,3-bisphospho-D-glycerate2,3-Diphosphoglyceric acidME540630-C01159-C03339--
2-aminobutanoate2-Aminobutyric acidME540632-C02261--
2-hydroxybutanoic acid2-Hydroxybutyric acidME540635-C05984--
2-HG2-Hydroxyglutaric acidME540634-C02630--
a-KG2-Oxoglutaric acidME540674-C00026--
DOPAC3,4-Dihydroxybenzeneacetic acidME540724-C01161--
3,4-dihydroxyphenylpropanoate3,4-Dihydroxyhydrocinnamic acidME540641-C10447--
3,4-dihydroxymandelic acid3,4-Dihydroxymandelic acidME540640-C05580--
DOPAL3,4-DihydroxyphenylacetaldehydeME540725-C04043--
DOPEG3,4-DihydroxyphenylglycolME540728-C05576--
3-aminoisobutanoate3-Aminoisobutanoic acidME540642-C05145--
3-hydroxybutanoic acid3-Hydroxybutyric acidME540643-C01089--
3-methoxytyramine3-MethoxytyramineME540646-C05587--
2-oxobutanoic acid3-Methyl pyruvic acidME540638-C00109--
1,3-bisphospho-D-glycerate3-Phospho-D-glyceroyl dihydrogen phosphateME540627-C00236--
dihydroorotate4,5-Dihydroorotic acidME540721-C00337--
4-hydroxybutanoic acid4-Hydroxybutyric acidME540650-C00989--
(S)-4-hydroxymandelonitrile +4-HydroxymandelonitrileME540626-C03742--
4-hydroxyphenylacetic acid4-Hydroxyphenylacetic acidME540651-C00642--
4-hydroxyphenylpyruvic acid -4-Hydroxyphenylpyruvic acidME540652-C01179--
5-aminolevulinate5-Amino-levulinic acidME540656-C00430--
5-methylcytosine5-MethylcytosineME540657-C02376--
5-methyl-THF5-Methyl-THFME540658-C00440--
5'-methylthioadenosine5'-MethylthioadenosineME540659-C00170--
6-aminocaproic acid6-Aminocaproic acidME540660-C02378--
6-phosphogluconic acid6-Phosphogluconic acidME540662-C00345--
6-phosphoglucono-D-lactone6-Phosphonoglucono-D-lactoneME540663-C01236--
acetoacetic acidAcetoacetic acidME540664-C00164--
acetylcholine+AcetylcholineME540665-C01996--
adenineAdenineME540667-C00147--
adenosineAdenosineME540668-C00212--
adenylosuccinateAdenylsuccinic acidME540669-C03794--
ADPADPME540670-C00008--
ADP-D-glucoseADP-glucoseME540671-C00498--
agmatineAgmatineME540672-C00179--
guanidineAgmatineME540765-C17349--
AICA ribonucleotideAICARME540673-C04677--
alanineAlanineME540675-C00041-C00133--
allantoinAllantoinME540676-C01551--
2-aminoisobutanoateAminoisobutyric acidME540633-C03665--
anandamideArachidonoyl-EAME540678-C11695--
arginineArginineME540679-C02385 --
L-arginino-succinateArgininosuccinic acidME540786-C03406--
asparagineAsparagineME540680-C16438--
aspartic acidAspartic acidME540681-C16433--
b-alaninebeta-AlanineME540683-C00099--
betaineBetaineME540684-C00719--
N-carbamoyl-L-aspartateCarbamoylaspartateME540813-C00438--
carbamoyl phosphateCarbamoylphosphateME540685-C00169--
carnitine+CarnitineME540686-C00487--
CDPCDPME540687-C00112--
CDP-cholineCDP-cholineME540688-C00307--
choline+CholineME540689-C00114--
phosphorylcholine+Choline phosphateME540831-C00588--
4-hydroxyprolinecis-4-HydroxyprolineME540653-C01157--
aconitic acidcis-Aconitic acidME540666-C00417-C02341--
citraconic acidCitraconic acidME540690-C02226--
citramalic acidCitramalic acidME540691-C00815--
citrullineCitrullineME540693-C00327--
CMPCMPME540694-C00055--
creatineCreatineME540695-C00300--
CreatinineCreatinineME540696-C00791--
CTPCTPME540697-C00063--
cystathionineCystathionineME540698-C00542--
L-cysteic acidCysteic acidME540787-C00506--
cysteineCysteineME540699-C00736-C00097--
cysteine-S-sulfateCysteine-S-sulfateME540700-C05824--
cystineCystineME540701-C01420--
cytidineCytidineME540702-C00475--
cytosineCytosineME540703-C00380--
dADPdADPME540704-C00206--
dAMPdAMPME540705-C00360--
D-arabinono-1,4-lactoneD-Arabinono-1,4-lactoneME540706-C00652--
dATPdATPME540707-C00131--
dCDPdCDPME540708-C00705--
dCMPdCMPME540709-C00239--
dCTPdCTPME540710-C00458--
deoxyguanosineDeoxyguanosineME540712-C00330--
deoxyinosineDeoxyinosineME540713-C05512--
deoxyuridineDeoxyuridineME540714-C00526--
dGDPdGDPME540719-C00361--
dimethylglycineDimethylglycineME540722-C01026--
DL-DOPADOPAME540723-C00355--
dopamine quinoneDopamine quinoneME540727-C17755--
D-sedoheptulose-7-phosphateD-Sedoheptulose 7-phosphateME540731-C05382--
dTMPdTMPME540732-C00364--
dTTPdTTPME540733-C00459--
dUMPdUMPME540734-C00365--
dUTPdUTPME540735-C00460--
epinephrineEpinephrineME540736-C00788--
D-erythrose-4-phosphateErythrose 4-phosphateME540715-C00279--
FADFADME540740-C00016--
FMNFMNME540741-C00061--
folic acidFolic acidME540742-C00504--
F1PFructose 1-phosphateME540738-C01094--
fumaric acidFumaric acidME540744-C00122--
D-galactonic acidGalactonic acidME540716-C00880--
GABAgamma-Aminobutyric acidME540746-C00334--
y-glutamylcysteinegamma-GlutamylcysteineME540869-C00669--
GDPGDPME540751-C00035--
GDP-L-fucoseGDP-L-fucoseME540752-C00325--
D-gluconic acid -Gluconic acidME540720-C00257--
glucono-lactoneGluconolactoneME540753-C00198--
G6PGlucose 6-phosphateME540745-C00092--
glutaminic acidGlutamic acidME540755-C00302--
glutamineGlutamineME540754-C00303--
glutathioneGlutathioneME540756-C00051--
glyceraldehydeGlyceraldehydeME540758-C02426--
glyceric acidGlyceric acidME540759-C00258--
glycineGlycineME540761-C00037--
glycylglycineGly-GlyME540762-C02037--
GMPGMPME540763-C00144--
GTPGTPME540764-C00044--
guanidinoacetateGuanidoacetic acidME540766-C00581--
guanineGuanineME540767-C00242--
guanosineGuanosineME540768-C00387--
histamineHistamineME540770-C00388--
histidineHistidineME540771-C00768--
homocysteineHomocysteineME540772-C05330--
homovanillic acidHomovanillic acidME540774-C05582--
hydroxyphenyllactic acidHydroxyphenyllactic acidME540775-C03672--
3-hydroxypropanoic acidHydroxypropionic acidME540645-C01013--
hypoxanthineHypoxanthineME540776-C00262--
IDPIDPME540778-C00104--
imidazole-4-acetateImidazoleacetic acidME540779-C02835--
IDAIminodiacetateME540777-C19911--
IMPIMPME540780-C00130--
inosineInosineME540781-C00294--
itaconic acidItaconic acidME540783-C00490--
2-keto-isovaleric acidKetoisovaleric acidME540636-C00141--
kynurenineKynurenineME540784-C01718--
lactic acidLactic acidME540785-C01432--
dehydroascorbic acidL-Dehydroascorbic acidME540711-C05422--
levulinic acidLevulinic acidME540789-n/a--
gulonic-lactoneL-GulonolactoneME540769-C01040--
lysineLysineME540791-C00047/C00739--
maleic acidMaleic acidME540792-C01384--
malic acidMalic acidME540793-C00711--
mesaconic acidMesaconic acidME540794-C01732--
methionineMethionineME540795-C00073--
methyl acetoacetateMethylacetoacetic acidME540796-n/a--
methylmalonic acidMethylmalonic acidME540798-C02170--
mevalonic acidMevalonic acidME540799-C00418--
N-acetylaspartic acidN-Acetylaspartic acidME540802-C01042--
N-acetylaspartylglutamic acidN-Acetyl-Asp-GluME540803-C12270--
N-acetyl-b-alanineN-Acetyl-beta-alanineME540804-C01073--
N-acetyl-L-glutamic acidN-Acetyl-mannosamineME540808-C00624--
NAD+NAD+ME540809-C00003--
NADHNADHME540810-C00004--
NADP+NADP+ME540811-C00006--
NADPHNADPHME540812-C00005--
nicotinamideNiacinamideME540814-C00153--
nicotinamide riboside+Nicotinamide ribosideME540815-C03150--
NMNNicotinamide ribotideME540818-C00455--
nicotinic acidNicotinic acidME540816-C00253--
N-methyltryptamineN-MethyltryptamineME540817-C06213--
N,N-dimethylanilineN,N-DimethylanilineME540800-C02846--
norepinephrineNorepinephrineME540819-C00547--
octopamineOctopamineME540820-C04227--
ornithineOrnithineME540821-C01602--
orotic acidOrotic acidME540822-C00295--
orotidylic acidOrotidylic acidME540823-C01103--
oxalacetic acidOxaloacetic acidME540824-C00036--
glutathione disulfideOxidized glutathioneME540757-C00127--
pantothenic acidPantothenic acidME540825-C00864--
phenylalaninePhenylalanineME540827-C02057--
phenethylaminePhenylethylamineME540826-C05332--
phosphocreatinePhosphocreatineME540829-C02305--
phosphoenolpyruvatePhosphoenolpyruvic acidME540830-C00074--
2/3-phosphoglyceratePhosphoglyceric acidME540631-C00631 / C00197--
3-phosphohydroxypyruvic acidPhosphohydroxypyruvic acidME540647-C03232--
PRPPPhosphoribosyl pyrophosphateME540834-C00119--
3-phospho-serinePhosphoserineME540648-C01005--
picolinic acidPicolinic acidME540832-C10164--
prolineProlineME540833-C16435--
pseudouridinePseudouridineME540835-C02067--
putrescinePutrescineME540836-C00134--
pyridoxinePyridoxineME540837-C00314--
methylglyoxalPyruvaldehydeME540797-C00546--
pyruvic acidPyruvic acidME540838-C00022--
4-phosphopantothenate(R)-4'-Phosphopantothenic acidME540654-C03492--
S-adenosyl-L-homocysteineS-AdenosylhomocysteineME540839-C00021--
S-adenosylmethioninamine+S-AdenosylmethioninamineME540841-C01137--
S-adenosyl-L-methionine+S-AdenosylmethionineME540840-C00019--
serineSerineME540842-C00716--
serotoninSerotoninME540843-C00780--
spermidineSpermidineME540844-C00315--
spermineSpermineME540845-C00750--
succinic acidSuccinic acidME540846-C00042--
succinic semialdehydeSuccinic acid semialdehydeME540847-C00232--
L-NMMATarginineME540790-C03884--
taurineTaurineME540848-C00245--
thiamine+ThiamineME540849-C00378--
thymidineThymidineME540850-C00214--
thymineThymineME540851-C00178--
tryptamineTryptamineME540852-C00398--
tryptophanTryptophanME540853-C00806--
tyramineTyramineME540854-C00483--
tyrosineTyrosineME540855-C01536--
UDPUDPME540856-C00015--
UDP-D-glucoseUDP-glucoseME540857-C00029--
UMPUMPME540859-C00105--
uracilUracilME540860-C00106--
ureaUreaME540861-C00086--
3-ureidopropionic acidUreidopropionic acidME540649-C02642--
uric acidUric acidME540862-C00366--
uridineUridineME540863-C00299--
UTPUTPME540864-C00075--
valineValineME540865-C16436--
xanthineXanthineME540866-C00385--
xanthosineXanthosineME540867-C01762--
XMPXMPME540868-C00655--
2-(Formamido)-N1-(5-phospho-D-ribosyl)acetamidine-ME540629-C04640--
2-ketovaleric acid-ME540637-C06255--
3- / 7-methylguanine-ME540639-C02230 / C02242--
3-hydroxyphenylacetic acid / vanillin-ME540644-C05593 / C00755--
5,6-dihydroxyindole-ME540655-C05578--
6-O-methylguanine-ME540661-n/a--
AMP / dGMP-ME540677-C00020 / C00362--
ATP / dGTP-ME540682-C00002 / C00286--
citrate / citrate(iso)-ME540692-C00158 / C00311--
D-galactosamine/glucosamine-1-phosphate-ME540717-C03783 / C00352--
D-galactosamine/glucosamine-6-phosphate-ME540718-C06377 / C06156--
dopamine / octopamine-ME540726-C03758 / C04227--
DOPET-ME540729-n/a--
D-ribose-1/5-phosphate / D-ribulose 5-phosphate-ME540730-C00620 / C00117 / C00199--
F-1,6/2,6-DP-ME540737-C00354 / C00665--
F6P / G1P-ME540739-C00085 / C00103--
fructose / mannose-ME540743-C00095 / C00159--
galactosamine / glucosamine-ME540747-C02262 / C00329--
galactose / glucose-ME540748-C00124 / C00267--
GalNAC/GlcNAC/ManNAC-ME540749-C01074 / C00140 / C00645--
GAP / DHAP-ME540750-C00118 / C00111--
glycerol 2/3-phosphate-ME540760-C02979 / C00093--
homoserine / theronine-ME540773-C00263 / C00188--
isonictinic acid-ME540782-C6H5NO2--
leucine / leucine(iso)-ME540788-C16439 / C16434--
N1/N8-acetylspermidine-ME540801-C00612 / C01029--
N-acetyl-DL-alanine-ME540805-n/a--
N-acetyl-dopamine-ME540806-n/a--
N-acetylglucosamine 1/6-phosphate-ME540807-C04501 / C00357--
phenylephrine / synephrine-ME540828-C07441 / C04548--
UDP-N-acetyl-galactosamine/UDP-N-acetyl-glucosamin...-ME540858-C00203 / C00043--


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