Metabolomics Workbench : NIH Data Repository : Analyze Studies

Analysis: HILIC POSITIVE ION MODE

Metabolite Name	RefMet Name/Standardized Name*	WorkBench Metabolite_ID	PubChem Compound_ID	Kegg Id	Retention time/index	m/z ratio
1-Methyladenosine	1-Methyladenosine	ME811844	-	-	-	-
1-Methylnicotinamide	1-Methyl nicotinamide	ME811845	-	-	-	-
2DGP	-	ME812047	-	-	-	-
2-Hydroxycaproic acid	2-Hydroxyhexanoic acid	ME811846	-	-	-	-
2-Hydroxyvaleric acid	2-Hydroxyvaleric acid	ME811847	-	-	-	-
3-Hydroxymethylglutaric acid	3-Hydroxymethylglutaric acid	ME811848	-	-	-	-
3-Indolepropionic acid	3-Indolepropionic acid	ME811849	-	-	-	-
3-Methylhistidine	3-Methylhistidine	ME811850	-	-	-	-
3-Phosphoglyceric acid	3-Phosphoglyceric acid	ME811851	-	-	-	-
4-Acetamidobutanoic acid	4-Acetamidobutanoic acid	ME811852	-	-	-	-
4-Guanidinobutanoic acid	4-Guanidinobutanoic acid	ME811853	-	-	-	-
4-Hydroxyproline	cis-4-Hydroxyproline	ME811854	-	-	-	-
4-Pyridoxic acid	4-Pyridoxic acid	ME811855	-	-	-	-
4-Trimethylammoniobutanoic acid	3-Dehydroxycarnitine	ME811856	-	-	-	-
5-Thymidylic acid	dTMP	ME811857	-	-	-	-
6-Phosphogluconic acid	6-Phosphogluconic acid	ME811858	-	-	-	-
6-Phosphonoglucono-D-lactone	6-Phosphonoglucono-D-lactone	ME811859	-	-	-	-
Acetylcholine	Acetylcholine	ME811861	-	-	-	-
Acetyl-CoA	Acetyl-CoA	ME811860	-	-	-	-
Acetylcysteine	N-Acetylcysteine	ME811862	-	-	-	-
Adenine	Adenine	ME811863	-	-	-	-
Adenosine	Adenosine	ME811864	-	-	-	-
Adenosine monophosphate	AMP	ME811865	-	-	-	-
Adenosine triphosphate	ATP	ME811866	-	-	-	-
ADP	ADP	ME811867	-	-	-	-
ADP-glucose	ADP-glucose	ME811868	-	-	-	-
AICAR	AICAR	ME811869	-	-	-	-
Allantoin	Allantoin	ME811870	-	-	-	-
Aminoadipic acid	Aminoadipic acid	ME811871	-	-	-	-
Anserine	Anserine	ME811872	-	-	-	-
Argininosuccinic acid	Argininosuccinic acid	ME811873	-	-	-	-
Asymmetric dimethylarginine	Dimethylarginine	ME811874	-	-	-	-
Betaine	Betaine	ME811875	-	-	-	-
Butyrylcarnitine	CAR 4:0	ME811876	-	-	-	-
Caprylic acid	Caprylic acid	ME811877	-	-	-	-
Carnosine	Carnosine	ME811878	-	-	-	-
CDP	CDP	ME811879	-	-	-	-
CDP-Ethanolamine	CDP-Ethanolamine	ME811880	-	-	-	-
Choline	Choline	ME811881	-	-	-	-
cis-Aconitic acid	cis-Aconitic acid	ME811882	-	-	-	-
Citicoline	CDP-choline	ME811883	-	-	-	-
Citric acid	Citric acid	ME811884	-	-	-	-
Citrulline	Citrulline	ME811885	-	-	-	-
Coenzyme A	Coenzyme A	ME811886	-	-	-	-
Creatine	Creatine	ME811887	-	-	-	-
Creatinine	Creatinine	ME811888	-	-	-	-
Cyclic AMP	3',5' cyclic AMP	ME811889	-	-	-	-
Cytidine	Cytidine	ME811890	-	-	-	-
Cytidine monophosphate	CMP	ME811891	-	-	-	-
Cytidine triphosphate	CTP	ME811892	-	-	-	-
Cytosine	Cytosine	ME811893	-	-	-	-
D-2-Hydroxyglutaric acid	D-2-Hydroxyglutaric acid	ME811894	-	-	-	-
dCDP	dCDP	ME811905	-	-	-	-
dCMP	dCMP	ME811906	-	-	-	-
dCTP	dCTP	ME811907	-	-	-	-
Deoxyadenosine	Deoxyadenosine	ME811908	-	-	-	-
Deoxyadenosine monophosphate	dAMP	ME811909	-	-	-	-
Deoxyadenosine triphosphate	dATP	ME811910	-	-	-	-
Deoxycytidine	Deoxycytidine	ME811911	-	-	-	-
Deoxyinosine	Deoxyinosine	ME811912	-	-	-	-
Deoxyribose 5-phosphate	Deoxyribose 5-phosphate	ME811913	-	-	-	-
Deoxyuridine	Deoxyuridine	ME811914	-	-	-	-
D-Erythrose 4-phosphate	Erythrose 4-phosphate	ME811895	-	-	-	-
D-Fructose	Fructose	ME811896	-	-	-	-
D-Glucose	Glucose	ME811897	-	-	-	-
D-Glucuronic acid	Glucuronic acid	ME811898	-	-	-	-
D-Glyceraldehyde 3-phosphate	Glyceraldehyde 3-phosphate	ME811899	-	-	-	-
D-Ribose	Ribose	ME811900	-	-	-	-
D-Ribose 5-phosphate	Ribose 5-phosphate	ME811901	-	-	-	-
D-Ribulose	D-Ribulose	ME811902	-	-	-	-
D-Ribulose 5-phosphate	Ribulose 5-phosphate	ME811903	-	-	-	-
D-Sedoheptulose 7-phosphate	D-Sedoheptulose 7-phosphate	ME811904	-	-	-	-
FAD	FAD	ME811915	-	-	-	-
Flavin Mononucleotide	FMN	ME811916	-	-	-	-
"Fructose 1,6-bisphosphate"	Fructose 1,6-bisphosphate	ME811917	-	-	-	-
Fructose 6-phosphate	Fructose 6-phosphate	ME811918	-	-	-	-
Fumaric acid	Fumaric acid	ME811919	-	-	-	-
Galactonic acid	Galactonic acid	ME811920	-	-	-	-
GDP-glucose	GDP-glucose	ME811921	-	-	-	-
Gluconic acid	Gluconic acid	ME811922	-	-	-	-
Glucosamine	Glucosamine	ME811923	-	-	-	-
Glucosamine 6-phosphate	Glucosamine 6-phosphate	ME811924	-	-	-	-
Glucose 6-phosphate	Glucose 6-phosphate	ME811925	-	-	-	-
Glutathione	Glutathione	ME811926	-	-	-	-
Glycerol 3-phosphate	sn-Glycero-3-phosphate	ME811927	-	-	-	-
Glycerophosphocholine	sn-Glycero-3-phosphocholine	ME811928	-	-	-	-
Glycine	Glycine	ME811929	-	-	-	-
Guanidoacetic acid	Guanidoacetic acid	ME811930	-	-	-	-
Guanine	Guanine	ME811931	-	-	-	-
Guanosine	Guanosine	ME811932	-	-	-	-
Guanosine diphosphate	GDP	ME811933	-	-	-	-
Guanosine monophosphate	GMP	ME811934	-	-	-	-
Guanosine triphosphate	GTP	ME811935	-	-	-	-
Hexanoylcarnitine	CAR 6:0	ME811936	-	-	-	-
Hippuric acid	Hippuric acid	ME811937	-	-	-	-
Hypotaurine	Hypotaurine	ME811938	-	-	-	-
Hypoxanthine	Hypoxanthine	ME811939	-	-	-	-
IDP	IDP	ME811940	-	-	-	-
Imidazoleacetic acid	Imidazoleacetic acid	ME811941	-	-	-	-
Indoxyl sulfate	Indoxyl sulfate	ME811942	-	-	-	-
Inosine	Inosine	ME811943	-	-	-	-
Inosinic acid	IMP	ME811944	-	-	-	-
Isovalerylcarnitine	CAR 4:0;3Me	ME811945	-	-	-	-
Kynurenic acid	Kynurenic acid	ME811946	-	-	-	-
L-Acetylcarnitine	CAR 2:0	ME811947	-	-	-	-
L-Alanine	Alanine	ME811948	-	-	-	-
L-Arginine	Arginine	ME811949	-	-	-	-
L-Asparagine	Asparagine	ME811950	-	-	-	-
L-Aspartic acid	Aspartic acid	ME811951	-	-	-	-
L-Carnitine	Carnitine	ME811952	-	-	-	-
L-Cystathionine	Cystathionine	ME811953	-	-	-	-
L-Cysteine	Cysteine	ME811954	-	-	-	-
L-Cystine	Cystine	ME811955	-	-	-	-
L-Dihydroorotic acid	4,5-Dihydroorotic acid	ME811956	-	-	-	-
L-Glutamic acid	Glutamic acid	ME811957	-	-	-	-
L-Glutamine	Glutamine	ME811958	-	-	-	-
L-Glyceric acid	Glyceric acid	ME811959	-	-	-	-
L-Histidine	Histidine	ME811960	-	-	-	-
L-Homoserine	Homoserine	ME811961	-	-	-	-
L-Isoleucine	Isoleucine	ME811962	-	-	-	-
L-Kynurenine	Kynurenine	ME811963	-	-	-	-
L-Lactic acid	Lactic acid	ME811964	-	-	-	-
L-Leucine	Leucine	ME811965	-	-	-	-
L-Lysine	Lysine	ME811966	-	-	-	-
L-Methionine	Methionine	ME811967	-	-	-	-
L-Palmitoylcarnitine	CAR 16:0	ME811968	-	-	-	-
L-Phenylalanine	Phenylalanine	ME811969	-	-	-	-
L-Pipecolic acid	Pipecolic acid	ME811970	-	-	-	-
L-Proline	Proline	ME811971	-	-	-	-
L-Serine	Serine	ME811972	-	-	-	-
L-Threonine	Threonine	ME811973	-	-	-	-
L-Tryptophan	Tryptophan	ME811974	-	-	-	-
L-Tyrosine	Tyrosine	ME811975	-	-	-	-
L-Valine	Valine	ME811976	-	-	-	-
Malic acid	Malic acid	ME811977	-	-	-	-
Myoinositol	Myo-inositol	ME811978	-	-	-	-
N6-Acetyl-L-lysine	N6-Acetyllysine	ME811992	-	-	-	-
"N6,N6,N6-Trimethyl-L-lysine"	N-6-Trimethyllysine	ME811993	-	-	-	-
N-Acetylasparagine	N-Acetylasparagine	ME811984	-	-	-	-
N-Acetylaspartylglutamic acid	N-Acetyl-Asp-Glu	ME811985	-	-	-	-
N-Acetyl-D-glucosamine	N-Acetylglucosamine	ME811979	-	-	-	-
N-Acetyl-glucosamine 1-phosphate	N-Acetylglucosamine 1-phosphate	ME811980	-	-	-	-
N-Acetylglutamic acid	N-Acetylglutamic acid	ME811986	-	-	-	-
N-Acetylglutamine	N-Acetylglutamine	ME811987	-	-	-	-
N-Acetyl-L-alanine	N-Acetylalanine	ME811981	-	-	-	-
N-Acetyl-L-aspartic acid	N-Acetylaspartic acid	ME811982	-	-	-	-
N-Acetyl-L-methionine	N-Acetylmethionine	ME811983	-	-	-	-
N-Acetylornithine	N-Acetylornithine	ME811988	-	-	-	-
N-Acetylputrescine	N-Acetylputrescine	ME811989	-	-	-	-
N-acetyltryptophan	N-Acetyl-tryptophan	ME811990	-	-	-	-
NAD	NAD	ME811994	-	-	-	-
NADH	NADH	ME811995	-	-	-	-
NADP	NADP	ME811996	-	-	-	-
NADPH	NADPH	ME811997	-	-	-	-
N-Formyl-L-methionine	N-Formylmethionine	ME811991	-	-	-	-
Niacinamide	Niacinamide	ME811998	-	-	-	-
Nicotinamide riboside	Nicotinamide riboside	ME811999	-	-	-	-
Nicotinamide ribotide	Nicotinamide ribotide	ME812000	-	-	-	-
Nicotinic acid	Nicotinic acid	ME812001	-	-	-	-
Nicotinic acid adenine dinucleotide	Nicotinic acid adenine dinucleotide	ME812002	-	-	-	-
Nicotinic acid mononucleotide	Nicotinic acid mononucleotide	ME812003	-	-	-	-
O-Phosphoethanolamine	Phosphoethanolamine	ME812004	-	-	-	-
Ornithine	Ornithine	ME812005	-	-	-	-
Orotic acid	Orotic acid	ME812006	-	-	-	-
Oxalacetic acid	Oxaloacetic acid	ME812007	-	-	-	-
Oxidized glutathione	Oxidized glutathione	ME812008	-	-	-	-
Oxoglutaric acid	2-Oxoglutaric acid	ME812009	-	-	-	-
Palmitic acid	Palmitic acid	ME812010	-	-	-	-
Pantothenic acid	Pantothenic acid	ME812011	-	-	-	-
Phosphocreatine	Phosphocreatine	ME812012	-	-	-	-
Phosphoenolpyruvic acid	Phosphoenolpyruvic acid	ME812013	-	-	-	-
Phosphorylcholine	Choline phosphate	ME812014	-	-	-	-
Phosphoserine	Phosphoserine	ME812015	-	-	-	-
Propionylcarnitine	CAR 3:0	ME812016	-	-	-	-
Purine	Purine	ME812017	-	-	-	-
Pyridoxine	Pyridoxine	ME812018	-	-	-	-
Pyroglutamic acid	Pyroglutamic acid	ME812019	-	-	-	-
Pyruvic acid	Pyruvic acid	ME812020	-	-	-	-
Riboflavin	Riboflavin	ME812021	-	-	-	-
S-Adenosylhomocysteine	S-Adenosylhomocysteine	ME812022	-	-	-	-
S-Adenosylmethionine	S-Adenosylmethionine	ME812023	-	-	-	-
"Sedoheptulose 1,7-bisphosphate"	Sedoheptulose 1,7-bisphosphate	ME812024	-	-	-	-
Succinic acid	Succinic acid	ME812025	-	-	-	-
Succinyl-CoA	Succinyl-CoA	ME812026	-	-	-	-
Taurine	Taurine	ME812027	-	-	-	-
Thiamine	Thiamine	ME812028	-	-	-	-
Thiamine monophosphate	Thiamine monophosphate	ME812029	-	-	-	-
Thymidine	Thymidine	ME812030	-	-	-	-
Thymidine 5'-triphosphate	dTTP	ME812031	-	-	-	-
Thymine	Thymine	ME812032	-	-	-	-
Uracil	Uracil	ME812033	-	-	-	-
Ureidopropionic acid	Ureidopropionic acid	ME812034	-	-	-	-
Ureidosuccinic acid	N-Carbamoylaspartic acid	ME812035	-	-	-	-
Uric acid	Uric acid	ME812036	-	-	-	-
Uridine	Uridine	ME812037	-	-	-	-
Uridine 5'-diphosphate	UDP	ME812038	-	-	-	-
Uridine 5'-monophosphate	UMP	ME812039	-	-	-	-
Uridine diphosphate glucose	UDP-glucose	ME812041	-	-	-	-
Uridine diphosphate glucuronic acid	UDP-glucuronic acid	ME812042	-	-	-	-
Uridine diphosphate-N-acetylglucosamine	UDP-N-acetylglucosamine	ME812040	-	-	-	-
Uridine triphosphate	UTP	ME812043	-	-	-	-
Urocanic acid	Urocanic acid	ME812044	-	-	-	-
Xanthine	Xanthine	ME812045	-	-	-	-
Xanthosine	Xanthosine	ME812046	-	-	-	-

Analysis: HILIC NEGATIVE ION MODE

Metabolite Name	RefMet Name/Standardized Name*	WorkBench Metabolite_ID	PubChem Compound_ID	Kegg Id	Retention time/index	m/z ratio
1-Methyladenosine	1-Methyladenosine	ME812048	-	-	-	-
1-Methylnicotinamide	1-Methyl nicotinamide	ME812049	-	-	-	-
2DGP	-	ME812251	-	-	-	-
2-Hydroxycaproic acid	2-Hydroxyhexanoic acid	ME812050	-	-	-	-
2-Hydroxyvaleric acid	2-Hydroxyvaleric acid	ME812051	-	-	-	-
3-Hydroxymethylglutaric acid	3-Hydroxymethylglutaric acid	ME812052	-	-	-	-
3-Indolepropionic acid	3-Indolepropionic acid	ME812053	-	-	-	-
3-Methylhistidine	3-Methylhistidine	ME812054	-	-	-	-
3-Phosphoglyceric acid	3-Phosphoglyceric acid	ME812055	-	-	-	-
4-Acetamidobutanoic acid	4-Acetamidobutanoic acid	ME812056	-	-	-	-
4-Guanidinobutanoic acid	4-Guanidinobutanoic acid	ME812057	-	-	-	-
4-Hydroxyproline	cis-4-Hydroxyproline	ME812058	-	-	-	-
4-Pyridoxic acid	4-Pyridoxic acid	ME812059	-	-	-	-
4-Trimethylammoniobutanoic acid	3-Dehydroxycarnitine	ME812060	-	-	-	-
5-Thymidylic acid	dTMP	ME812061	-	-	-	-
6-Phosphogluconic acid	6-Phosphogluconic acid	ME812062	-	-	-	-
6-Phosphonoglucono-D-lactone	6-Phosphonoglucono-D-lactone	ME812063	-	-	-	-
Acetylcholine	Acetylcholine	ME812065	-	-	-	-
Acetyl-CoA	Acetyl-CoA	ME812064	-	-	-	-
Acetylcysteine	N-Acetylcysteine	ME812066	-	-	-	-
Adenine	Adenine	ME812067	-	-	-	-
Adenosine	Adenosine	ME812068	-	-	-	-
Adenosine monophosphate	AMP	ME812069	-	-	-	-
Adenosine triphosphate	ATP	ME812070	-	-	-	-
ADP	ADP	ME812071	-	-	-	-
ADP-glucose	ADP-glucose	ME812072	-	-	-	-
AICAR	AICAR	ME812073	-	-	-	-
Allantoin	Allantoin	ME812074	-	-	-	-
Aminoadipic acid	Aminoadipic acid	ME812075	-	-	-	-
Anserine	Anserine	ME812076	-	-	-	-
Argininosuccinic acid	Argininosuccinic acid	ME812077	-	-	-	-
Asymmetric dimethylarginine	Dimethylarginine	ME812078	-	-	-	-
Betaine	Betaine	ME812079	-	-	-	-
Butyrylcarnitine	CAR 4:0	ME812080	-	-	-	-
Caprylic acid	Caprylic acid	ME812081	-	-	-	-
Carnosine	Carnosine	ME812082	-	-	-	-
CDP	CDP	ME812083	-	-	-	-
CDP-Ethanolamine	CDP-Ethanolamine	ME812084	-	-	-	-
Choline	Choline	ME812085	-	-	-	-
cis-Aconitic acid	cis-Aconitic acid	ME812086	-	-	-	-
Citicoline	CDP-choline	ME812087	-	-	-	-
Citric acid	Citric acid	ME812088	-	-	-	-
Citrulline	Citrulline	ME812089	-	-	-	-
Coenzyme A	Coenzyme A	ME812090	-	-	-	-
Creatine	Creatine	ME812091	-	-	-	-
Creatinine	Creatinine	ME812092	-	-	-	-
Cyclic AMP	3',5' cyclic AMP	ME812093	-	-	-	-
Cytidine	Cytidine	ME812094	-	-	-	-
Cytidine monophosphate	CMP	ME812095	-	-	-	-
Cytidine triphosphate	CTP	ME812096	-	-	-	-
Cytosine	Cytosine	ME812097	-	-	-	-
D-2-Hydroxyglutaric acid	D-2-Hydroxyglutaric acid	ME812098	-	-	-	-
dCDP	dCDP	ME812109	-	-	-	-
dCMP	dCMP	ME812110	-	-	-	-
dCTP	dCTP	ME812111	-	-	-	-
Deoxyadenosine	Deoxyadenosine	ME812112	-	-	-	-
Deoxyadenosine monophosphate	dAMP	ME812113	-	-	-	-
Deoxyadenosine triphosphate	dATP	ME812114	-	-	-	-
Deoxycytidine	Deoxycytidine	ME812115	-	-	-	-
Deoxyinosine	Deoxyinosine	ME812116	-	-	-	-
Deoxyribose 5-phosphate	Deoxyribose 5-phosphate	ME812117	-	-	-	-
Deoxyuridine	Deoxyuridine	ME812118	-	-	-	-
D-Erythrose 4-phosphate	Erythrose 4-phosphate	ME812099	-	-	-	-
D-Fructose	Fructose	ME812100	-	-	-	-
D-Glucose	Glucose	ME812101	-	-	-	-
D-Glucuronic acid	Glucuronic acid	ME812102	-	-	-	-
D-Glyceraldehyde 3-phosphate	Glyceraldehyde 3-phosphate	ME812103	-	-	-	-
D-Ribose	Ribose	ME812104	-	-	-	-
D-Ribose 5-phosphate	Ribose 5-phosphate	ME812105	-	-	-	-
D-Ribulose	D-Ribulose	ME812106	-	-	-	-
D-Ribulose 5-phosphate	Ribulose 5-phosphate	ME812107	-	-	-	-
D-Sedoheptulose 7-phosphate	D-Sedoheptulose 7-phosphate	ME812108	-	-	-	-
FAD	FAD	ME812119	-	-	-	-
Flavin Mononucleotide	FMN	ME812120	-	-	-	-
"Fructose 1,6-bisphosphate"	Fructose 1,6-bisphosphate	ME812121	-	-	-	-
Fructose 6-phosphate	Fructose 6-phosphate	ME812122	-	-	-	-
Fumaric acid	Fumaric acid	ME812123	-	-	-	-
Galactonic acid	Galactonic acid	ME812124	-	-	-	-
GDP-glucose	GDP-glucose	ME812125	-	-	-	-
Gluconic acid	Gluconic acid	ME812126	-	-	-	-
Glucosamine	Glucosamine	ME812127	-	-	-	-
Glucosamine 6-phosphate	Glucosamine 6-phosphate	ME812128	-	-	-	-
Glucose 6-phosphate	Glucose 6-phosphate	ME812129	-	-	-	-
Glutathione	Glutathione	ME812130	-	-	-	-
Glycerol 3-phosphate	sn-Glycero-3-phosphate	ME812131	-	-	-	-
Glycerophosphocholine	sn-Glycero-3-phosphocholine	ME812132	-	-	-	-
Glycine	Glycine	ME812133	-	-	-	-
Guanidoacetic acid	Guanidoacetic acid	ME812134	-	-	-	-
Guanine	Guanine	ME812135	-	-	-	-
Guanosine	Guanosine	ME812136	-	-	-	-
Guanosine diphosphate	GDP	ME812137	-	-	-	-
Guanosine monophosphate	GMP	ME812138	-	-	-	-
Guanosine triphosphate	GTP	ME812139	-	-	-	-
Hexanoylcarnitine	CAR 6:0	ME812140	-	-	-	-
Hippuric acid	Hippuric acid	ME812141	-	-	-	-
Hypotaurine	Hypotaurine	ME812142	-	-	-	-
Hypoxanthine	Hypoxanthine	ME812143	-	-	-	-
IDP	IDP	ME812144	-	-	-	-
Imidazoleacetic acid	Imidazoleacetic acid	ME812145	-	-	-	-
Indoxyl sulfate	Indoxyl sulfate	ME812146	-	-	-	-
Inosine	Inosine	ME812147	-	-	-	-
Inosinic acid	IMP	ME812148	-	-	-	-
Isovalerylcarnitine	CAR 4:0;3Me	ME812149	-	-	-	-
Kynurenic acid	Kynurenic acid	ME812150	-	-	-	-
L-Acetylcarnitine	CAR 2:0	ME812151	-	-	-	-
L-Alanine	Alanine	ME812152	-	-	-	-
L-Arginine	Arginine	ME812153	-	-	-	-
L-Asparagine	Asparagine	ME812154	-	-	-	-
L-Aspartic acid	Aspartic acid	ME812155	-	-	-	-
L-Carnitine	Carnitine	ME812156	-	-	-	-
L-Cystathionine	Cystathionine	ME812157	-	-	-	-
L-Cysteine	Cysteine	ME812158	-	-	-	-
L-Cystine	Cystine	ME812159	-	-	-	-
L-Dihydroorotic acid	4,5-Dihydroorotic acid	ME812160	-	-	-	-
L-Glutamic acid	Glutamic acid	ME812161	-	-	-	-
L-Glutamine	Glutamine	ME812162	-	-	-	-
L-Glyceric acid	Glyceric acid	ME812163	-	-	-	-
L-Histidine	Histidine	ME812164	-	-	-	-
L-Homoserine	Homoserine	ME812165	-	-	-	-
L-Isoleucine	Isoleucine	ME812166	-	-	-	-
L-Kynurenine	Kynurenine	ME812167	-	-	-	-
L-Lactic acid	Lactic acid	ME812168	-	-	-	-
L-Leucine	Leucine	ME812169	-	-	-	-
L-Lysine	Lysine	ME812170	-	-	-	-
L-Methionine	Methionine	ME812171	-	-	-	-
L-Palmitoylcarnitine	CAR 16:0	ME812172	-	-	-	-
L-Phenylalanine	Phenylalanine	ME812173	-	-	-	-
L-Pipecolic acid	Pipecolic acid	ME812174	-	-	-	-
L-Proline	Proline	ME812175	-	-	-	-
L-Serine	Serine	ME812176	-	-	-	-
L-Threonine	Threonine	ME812177	-	-	-	-
L-Tryptophan	Tryptophan	ME812178	-	-	-	-
L-Tyrosine	Tyrosine	ME812179	-	-	-	-
L-Valine	Valine	ME812180	-	-	-	-
Malic acid	Malic acid	ME812181	-	-	-	-
Myoinositol	Myo-inositol	ME812182	-	-	-	-
N6-Acetyl-L-lysine	N6-Acetyllysine	ME812196	-	-	-	-
"N6,N6,N6-Trimethyl-L-lysine"	N-6-Trimethyllysine	ME812197	-	-	-	-
N-Acetylasparagine	N-Acetylasparagine	ME812188	-	-	-	-
N-Acetylaspartylglutamic acid	N-Acetyl-Asp-Glu	ME812189	-	-	-	-
N-Acetyl-D-glucosamine	N-Acetylglucosamine	ME812183	-	-	-	-
N-Acetyl-glucosamine 1-phosphate	N-Acetylglucosamine 1-phosphate	ME812184	-	-	-	-
N-Acetylglutamic acid	N-Acetylglutamic acid	ME812190	-	-	-	-
N-Acetylglutamine	N-Acetylglutamine	ME812191	-	-	-	-
N-Acetyl-L-alanine	N-Acetylalanine	ME812185	-	-	-	-
N-Acetyl-L-aspartic acid	N-Acetylaspartic acid	ME812186	-	-	-	-
N-Acetyl-L-methionine	N-Acetylmethionine	ME812187	-	-	-	-
N-Acetylornithine	N-Acetylornithine	ME812192	-	-	-	-
N-Acetylputrescine	N-Acetylputrescine	ME812193	-	-	-	-
N-acetyltryptophan	N-Acetyl-tryptophan	ME812194	-	-	-	-
NAD	NAD	ME812198	-	-	-	-
NADH	NADH	ME812199	-	-	-	-
NADP	NADP	ME812200	-	-	-	-
NADPH	NADPH	ME812201	-	-	-	-
N-Formyl-L-methionine	N-Formylmethionine	ME812195	-	-	-	-
Niacinamide	Niacinamide	ME812202	-	-	-	-
Nicotinamide riboside	Nicotinamide riboside	ME812203	-	-	-	-
Nicotinamide ribotide	Nicotinamide ribotide	ME812204	-	-	-	-
Nicotinic acid	Nicotinic acid	ME812205	-	-	-	-
Nicotinic acid adenine dinucleotide	Nicotinic acid adenine dinucleotide	ME812206	-	-	-	-
Nicotinic acid mononucleotide	Nicotinic acid mononucleotide	ME812207	-	-	-	-
O-Phosphoethanolamine	Phosphoethanolamine	ME812208	-	-	-	-
Ornithine	Ornithine	ME812209	-	-	-	-
Orotic acid	Orotic acid	ME812210	-	-	-	-
Oxalacetic acid	Oxaloacetic acid	ME812211	-	-	-	-
Oxidized glutathione	Oxidized glutathione	ME812212	-	-	-	-
Oxoglutaric acid	2-Oxoglutaric acid	ME812213	-	-	-	-
Palmitic acid	Palmitic acid	ME812214	-	-	-	-
Pantothenic acid	Pantothenic acid	ME812215	-	-	-	-
Phosphocreatine	Phosphocreatine	ME812216	-	-	-	-
Phosphoenolpyruvic acid	Phosphoenolpyruvic acid	ME812217	-	-	-	-
Phosphorylcholine	Choline phosphate	ME812218	-	-	-	-
Phosphoserine	Phosphoserine	ME812219	-	-	-	-
Propionylcarnitine	CAR 3:0	ME812220	-	-	-	-
Purine	Purine	ME812221	-	-	-	-
Pyridoxine	Pyridoxine	ME812222	-	-	-	-
Pyroglutamic acid	Pyroglutamic acid	ME812223	-	-	-	-
Pyruvic acid	Pyruvic acid	ME812224	-	-	-	-
Riboflavin	Riboflavin	ME812225	-	-	-	-
S-Adenosylhomocysteine	S-Adenosylhomocysteine	ME812226	-	-	-	-
S-Adenosylmethionine	S-Adenosylmethionine	ME812227	-	-	-	-
"Sedoheptulose 1,7-bisphosphate"	Sedoheptulose 1,7-bisphosphate	ME812228	-	-	-	-
Succinic acid	Succinic acid	ME812229	-	-	-	-
Succinyl-CoA	Succinyl-CoA	ME812230	-	-	-	-
Taurine	Taurine	ME812231	-	-	-	-
Thiamine	Thiamine	ME812232	-	-	-	-
Thiamine monophosphate	Thiamine monophosphate	ME812233	-	-	-	-
Thymidine	Thymidine	ME812234	-	-	-	-
Thymidine 5'-triphosphate	dTTP	ME812235	-	-	-	-
Thymine	Thymine	ME812236	-	-	-	-
Uracil	Uracil	ME812237	-	-	-	-
Ureidopropionic acid	Ureidopropionic acid	ME812238	-	-	-	-
Ureidosuccinic acid	N-Carbamoylaspartic acid	ME812239	-	-	-	-
Uric acid	Uric acid	ME812240	-	-	-	-
Uridine	Uridine	ME812241	-	-	-	-
Uridine 5'-diphosphate	UDP	ME812242	-	-	-	-
Uridine 5'-monophosphate	UMP	ME812243	-	-	-	-
Uridine diphosphate glucose	UDP-glucose	ME812245	-	-	-	-
Uridine diphosphate glucuronic acid	UDP-glucuronic acid	ME812246	-	-	-	-
Uridine diphosphate-N-acetylglucosamine	UDP-N-acetylglucosamine	ME812244	-	-	-	-
Uridine triphosphate	UTP	ME812247	-	-	-	-
Urocanic acid	Urocanic acid	ME812248	-	-	-	-
Xanthine	Xanthine	ME812249	-	-	-	-
Xanthosine	Xanthosine	ME812250	-	-	-	-

Analysis: Reversed phase POSITIVE ION MODE

Metabolite Name	RefMet Name/Standardized Name*	WorkBench Metabolite_ID	PubChem Compound_ID	Kegg Id	Retention time/index	m/z ratio
aspartate_C12 PARENT	Aspartic acid	ME812260	-	C00049	-	134.044907
aspartate_N15-label-1	-	ME812261	-	C00049	-	135.042435
Cytosine_C12 PARENT	Cytosine	ME812252	-	C00380	-	112.050781
Cytosine_N15-label-1	-	ME812253	-	C00380	-	113.047829
L-Asparagine_C12 PARENT	Asparagine	ME812262	-	C00152	-	133.0593
L-Asparagine_N15-label-1	-	ME812263	-	C00152	-	134.0585
N-carbamoyl-L-aspartate_C12 PARENT	Carbamoylaspartate	ME812254	-	C00438	-	177.053192
N-carbamoyl-L-aspartate_N15-label-1	-	ME812255	-	C00438	-	178.050192
Orotate_C12 PARENT	Orotic acid	ME812264	-	C00295	-	157.026
Orotate_N15-label-1	-	ME812265	-	C00295	-	158.0237
Orotidine 5--phosphate_C12 PARENT	-	ME812266	-	C01103	-	369.0278
Orotidine 5--phosphate_N15-label-1	-	ME812267	-	C01103	-	370.0249
thymidine_15N-label-1	-	ME812257	-	C00214	-	243.100525
thymidine_C12 PARENT	Thymidine	ME812256	-	C00214	-	242.103656
UMP_C12 PARENT	UMP	ME812258	-	C00105	-	325.043152
UMP_N15-label-1	-	ME812259	-	C00105	-	326.040152

Analysis: Reversed phase NEGATIVE ION MODE

Metabolite Name	RefMet Name/Standardized Name*	WorkBench Metabolite_ID	PubChem Compound_ID	Kegg Id	Retention time/index	m/z ratio
Carbamoyl phosphate_C12 PARENT	Carbamoylphosphate	ME812274	-	C00169	-	139.980881
Carbamoyl phosphate_N15-label-1	-	ME812275	-	C00169	-	140.97905
L-Glutamate_C12 PARENT	Glutamic acid	ME812270	-	C00025	-	146.045883
L-Glutamate_N15-label-1	-	ME812271	-	C00025	-	147.042755
L-Glutamine_C12 PARENT	Glutamine	ME812268	-	C00064	-	145.061859
L-Glutamine_N15-label-2	-	ME812269	-	C00064	-	147.056
(S)-Dihydroorotate_C12 PARENT	4,5-Dihydroorotic acid	ME812272	-	C00337	-	157.02792
(S)-Dihydroorotate_N15-label-1	-	ME812273	-	C00337	-	158.022009