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Analysis: CE UNSPECIFIED ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
AdenineAdenineME270758-C00147--
AdenosineAdenosineME270759-C00212--
AlanineAlanineME270760-C00041,C00133,C01401--
ArginineArginineME270761-C00062,C00792--
Argininosuccinic acidArgininosuccinic acidME270762-C03406--
AsparagineAsparagineME270763-C00152,C01905,C16438--
Aspartic acidAspartic acidME270764-C00049,C00402,C16433--
Beta-Alaninebeta-AlanineME270765-C00099--
BetaineBetaineME270766-C00719--
Betaine aldehydeBetaine aldehydeME270767-C00576--
CarnitineCarnitineME270768-C00318,C00487,C15025--
CarnosineCarnosineME270769-C00386--
CholineCholineME270770-C00114--
cis-3-hydroxyprolinecis-3-HydroxyprolineME270771-C01015,C01157--
CitrullineCitrullineME270772-C00327--
CreatineCreatineME270773-C00300--
CreatinineCreatinineME270774-C00791--
CystathionineCystathionineME270775-C00542,C02291--
CysteineCysteineME270776-C00097,C00736,C00793--
Gamma-Aminobutyric acidgamma-Aminobutyric acidME270777-C00334--
Glutamic acidGlutamic acidME270778-C00025,C00217,C00302--
GlutamineGlutamineME270779-C00064,C00303,C00819--
GlutathioneGlutathioneME270780-C00051--
GlycineGlycineME270781-C00037--
GuanosineGuanosineME270782-C00387--
HistidineHistidineME270783-C00135,C00768,C06419--
HomocysteineHomocysteineME270784-C00155,C05330--
HomoserineHomoserineME270785-C00263--
InosineInosineME270786-C00294--
IsoleucineIsoleucineME270787-C00407,C06418,C16434--
LeucineLeucineME270788-C00123,C01570,C16439--
LysineLysineME270789-C00047,C00739,C16440--
MethionineMethionineME270790-C00073,C00855,C01733--
OrnithineOrnithineME270791-C00077,C00515,C01602--
Oxidized glutathioneOxidized glutathioneME270792-C00127--
PhenylalaninePhenylalanineME270793-C00079,C02057,C02265--
ProlineProlineME270794-C00148,C00763,C16435--
PutrescinePutrescineME270795-C00134--
S-AdenosylhomocysteineS-AdenosylhomocysteineME270796-C00021--
S-AdenosylmethionineS-AdenosylmethionineME270797-C00019--
SarcosineSarcosineME270798-C00213--
SerineSerineME270799-C00065,C00716,C00740--
SpermidineSpermidineME270800-C00315--
SpermineSpermineME270801-C00750--
ThreonineThreonineME270802-C00188,C00820--
TryptophanTryptophanME270803-C00078,C00525,C00806--
TyrosineTyrosineME270804-C00082,C01536,C06420--
ValineValineME270805-C00183,C06417,C16436--


Analysis: CE UNSPECIFIED ION MODE/Triple quadrupole

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
2,3-Diphosphoglyceric acid2,3-Diphosphoglyceric acidME270806-C01159--
2-hydroxyglutaric acid2-Hydroxyglutaric acidME270807-C02630,C01087,C03196--
2-Phosphoglyceric acid2-Phosphoglyceric acidME270808-C00631--
3',5' cyclic AMP3',5' cyclic AMPME270809-C00575--
3',5' cyclic GMP3',5' cyclic GMPME270810-C00942--
3-hydroxy-3-methylglutaryl-CoA3-Hydroxy-3-methylglutaryl-CoAME270811-C00356--
3-Phosphoglyceric acid3-Phosphoglyceric acidME270812-C00197--
6-Phosphogluconic acid6-Phosphogluconic acidME270813-C00345--
Acetyl-CoAAcetyl-CoAME270814-C00024--
Adenylsuccinic acidAdenylsuccinic acidME270815-C03794--
ADPADPME270816-C00008--
ADP-riboseADP-riboseME270817-C00301--
AMPAMPME270818-C00020--
ATPATPME270819-C00002--
Cis-Aconitic acidcis-Aconitic acidME270820-C00417--
Citric acidCitric acidME270821-C00158--
Coenzyme ACoenzyme AME270822-C00010--
Dihydroxyacetone phosphateDihydroxyacetone phosphateME270823-C00111--
Folic acidFolic acidME270824-C00504--
Fructose-1,6-biphosphateFructose 1,6-bisphosphateME270825-C00354--
Fructose-1-phosphateFructose 1-phosphateME270826-C01094,C02976--
Fructose-6-phosphateFructose 6-phosphateME270827-C05345,C00085--
Fumaric acidFumaric acidME270828-C00122--
Galactose-1-phosphateGalactose 1-phosphateME270829-C00446--
GDPGDPME270830-C00035--
Glucose-1-phosphateGlucose 1-phosphateME270831-C00103--
Glucose-6-phosphateGlucose 6-phosphateME270832-C00668,C01172,C00092--
Glyceraldehyde-3-phosphateGlyceraldehyde 3-phosphateME270833-C00118,C00661--
Glycerol 3-phosphatesn-Glycero-3-phosphateME270834-C00093--
GMPGMPME270835-C00144--
GTPGTPME270836-C00044--
IMPIMPME270837-C00130--
Ketoisovaleric acidKetoisovaleric acidME270838-C00141--
Lactic acidLactic acidME270839-C00186,C00256,C01432--
Malic acidMalic acidME270840-C00149,C00497,C00711--
Malonyl-CoAMalonyl-CoAME270841-C00083--
Mevalonic acidMevalonic acidME270842-C00418,C02104--
N-acetylglutamic acidN-Acetylglutamic acidME270843-C00624--
NAD+NAD+ME270844-C00003--
NADHNADHME270845-C00004--
NADP+NADP+ME270846-C00006--
NADPHNADPHME270847-C00005--
N-carbamoylaspartic acidN-Carbamoylaspartic acidME270848-C00438--
Oxoglutaric acidOxoglutaric acidME270849-C00026--
PhosphocreatinePhosphocreatineME270850-C02305--
Phosphoenolpyruvic acidPhosphoenolpyruvic acidME270851-C00074--
Phosphoribosyl pyrophosphatePhosphoribosyl pyrophosphateME270852-C00119--
Pyruvic acidPyruvic acidME270853-C00022--
Ribose-1-phosphateRibose 1-phosphateME270854-C00620--
Ribose-5-phosphateRibose 5-phosphateME270855-C00117--
Ribulose-5-phosphateRibulose 5-phosphateME270856-C00199,C01101--
Sedoheptulose 7-phosphateSedoheptulose 7-phosphateME270857-C05382--
Succinic acidSuccinic acidME270858-C00042--
UDP-glucoseUDP-glucoseME270859-C00029--
XMPXMPME270860-C00655--
Xylulose-5-phosphateXylulose 5-phosphateME270861-C00231,C03291--


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