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Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
2-MethylbutyroylcarnitineCAR 4:0;2MeME703171----
CystamineCystamineME703197----
Dimethylguanidino valeric acid-ME703201----
N-acetylglutamineN-AcetylglutamineME703214----
Glutamic acidGlutamic acidME703202-C00025--
GlycineGlycineME703204-C00037--
AlanineAlanineME703181-C00041--
LysineLysineME703212-C00047--
Aspartic acidAspartic acidME703186-C00049--
ArginineArginineME703184-C00062--
GlutamineGlutamineME703203-C00064--
SerineSerineME703221-C00065--
MethionineMethionineME703213-C00073--
OrnithineOrnithineME703216-C00077--
TryptophanTryptophanME703229-C00078--
PhenylalaninePhenylalanineME703217-C00079--
TyrosineTyrosineME703230-C00082--
beta-Alaninebeta-AlanineME703188-C00099--
CholineCholineME703193-C00114--
LeucineLeucineME703211-C00123--
HistidineHistidineME703206-C00135--
ProlineProlineME703218-C00148--
AsparagineAsparagineME703185-C00152--
HomocysteineHomocysteineME703207-C00155--
Acetoacetic acidAcetoacetic acidME703176-C00164--
Acetoacetic AcidAcetoacetic acidME703177-C00164--
ValineValineME703232-C00183--
ThreonineThreonineME703225-C00188--
AdenosineAdenosineME703180-C00212--
TaurineTaurineME703224-C00245--
HomoserineHomoserineME703208-C00263--
UridineUridineME703231-C00299--
CreatineCreatineME703195-C00300--
PyridoxinePyridoxineME703220-C00314--
CarnitineCarnitineME703191-C00318--
CitrullineCitrullineME703194-C00327--
CytosineCytosineME703200-C00380--
CarnosineCarnosineME703192-C00386--
HistamineHistamineME703205-C00388--
IsoleucineIsoleucineME703209-C00407--
5-Aminolevulinic Acid5-Amino-levulinic acidME703173-C00430--
CytidineCytidineME703199-C00475--
2'-deoxyadenosineDeoxyadenosineME703169-C00559--
Cyclic AMP3',5' cyclic AMPME703196-C00575--
3-Methyl-2-oxovaleric acid3-Methyl-2-oxovaleric acidME703172-C00671--
BetaineBetaineME703189-C00719--
SpermineSpermineME703223-C00750--
SerotoninSerotoninME703222-C00780--
2'-deoxycytidineDeoxycytidineME703170-C00881--
Aminoadipic AcidAminoadipic acidME703182-C00956--
Trimethylamine N-oxideTrimethylamine N-oxideME703228-C01104--
trans-hydroxyproline-ME703227-C01157--
AnserineAnserineME703183-C01262--
CysteamineCysteamineME703198-C01678--
Kynurenic acidKynurenic acidME703210-C01717--
ThyroxineThyroxineME703226-C01829--
AcetylcholineAcetylcholineME703179-C01996--
AcetylcarnitineCAR 2:0ME703178-C02571--
ButyrylcarnitineCAR 4:0ME703190-C02862--
Asymmetric dimethylarginineDimethylarginineME703187-C03626--
NG-monomethyl-L-arginineTarginineME703215-C03884--
1-methylhistamine1-MethylhistamineME703168-C05127--
5-hydroxyindoleacetic acid5-Hydroxyindoleacetic acidME703174-C05635--
5-Hydroxyindoleacetic acid5-Hydroxyindoleacetic acidME703175-C05635--
PurinePurineME703219-C15587--


Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
2-hydroxy-2-methylbutyrate2-Hydroxy-2-methyl-butyric acidME703233----
Hydroxyisocaproate2-Hydroxyisocaproic acidME703255----
N-Acetyl-L-AlanineN-AcetylalanineME703263----
Adenosine triphosphateATPME703239-C00002--
Adenosine diphosphateADPME703238-C00008--
Uridine 5'-diphosphateUDPME703276-C00015--
S-adenosyl-L-homocysteineS-AdenosylhomocysteineME703270-C00021--
Acetyl-coAAcetyl-CoAME703237-C00024--
GlucoseGlucoseME703248-C00031--
OxaloacetateOxaloacetic acidME703266-C00036--
SuccinateSuccinic acidME703271-C00042--
GlutathioneGlutathioneME703250-C00051--
Thiamine PyrophosphateThiamine diphosphateME703273-C00068--
Fructose 6-phosphateFructose 6-phosphateME703247-C00085--
Glucose 6-phosphateGlucose 6-phosphateME703249-C00092--
UracilUracilME703275-C00106--
Glyceraldehyde 3-phosphateGlyceraldehyde 3-phosphateME703252-C00118--
BiotinBiotinME703241-C00120--
3-methyl-2-oxobutyrateKetoisovaleric acidME703235-C00141--
NiacinamideNiacinamideME703265-C00153--
LactateLactic acidME703259-C00186--
ThymidineThymidineME703274-C00214--
Erythrose 4-phosphateErythrose 4-phosphateME703245-C00279--
InosineInosineME703256-C00294--
IsocitrateIsocitric acidME703257-C00311--
KynurenineKynurenineME703258-C00328--
MalonateMalonic acidME703260-C00383--
MevalonateMevalonic acidME703262-C00418--
N-Carbamoyl-L-aspartateCarbamoylaspartateME703264-C00438--
p-aminobenzoatep-Aminobenzoic acidME703267-C00568--
GuanidoacetateGuanidoacetic acidME703253-C00581--
3-phosphoglycerate3-Phosphoglyceric acidME703236-C00597--
Phenyllactic acidPhenyllactic acidME703268-C01479--
XanthosineXanthosineME703277-C01762--
PyroglutamatePyroglutamic acidME703269-C01879--
GlyceraldehydeGlyceraldehydeME703251-C02154--
CitraconateCitraconic acidME703243-C02226--
XanthurenateXanthurenic acidME703278-C02470--
2-hydroxyglutarate2-Hydroxyglutaric acidME703234-C02630--
Malonyl-coenzyme AMalonyl-CoAME703261-C03188--
ArginosuccinateArgininosuccinic acidME703240-C03406--
DeoxycholateDeoxycholic acidME703244-C04483--
Fructose 1,6-bisphosphateFructose 1,6-bisphosphateME703246-C05378--
TaurodeoxycholateTaurodeoxycholic acidME703272-C05463--
HomocysteateHomocysteic acidME703254-C16511--
Cholesterol sulfateCholesterol sulfateME703242-C18043--


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