RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0033450
RefMet name	FGAR
Alternative name	N(2)-Formyl-N(1)-(5-phospho-D-ribosyl)glycinamide
Systematic name	N-(N-formylglycyl)-5-O-phosphono-D-ribofuranosylamine
Synonyms	PubChem Synonyms
Exact mass	314.051517 (neutral)	Calculate m/z: (Choose adduct) [M+H]+ [M+H-H2O]+ [M.]+ [M+2H]2+ [M+3H]3+ [M+4H]4+ [M+K]+ [M+2K]2+ [M+2K-H]+ [M+Na]+ [M+2Na]2+ [M+2Na-H]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M.CH3]+ [M+Ag]+ [M+H+CH3OH]+ [M+H+CH3CN]+ [M+H+2CH3CN]+ [M+Na+CH3CN]+ [M.NaFormate+H]+ [M.NH4Formate+H]+ [M.TMSi]+ [M.tBuDMSi]+ [M+H-Hexose]+ [M+H-EtnP]+ [M+H-SerP]+ [M-H]- [M-H-H2O]- [M-CH3]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+Na-2H]- [M+K-2H]- [M.Formate]- [M.NaFormate-H]- [M.NH4Formate-H]- [M.F]- [M-H-Ser]- [M.HF2]- M(neutral)    View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
Formula	C8H15N2O9P	View other entries in RefMet with this formula
Molecular descriptors
Molfile	51215 (Download molfile/View MW Metabolite Database details)
InChI	InChI=1S/C8H15N2O9P/c11-3-9-1-5(12)10-8-7(14)6(13)4(19-8)2-18-20(15,16)17/h3-4,6-8,13-14H,1-2H2,(H,9,11)(H,10,12)(H2,15,16,17)/t4- ,6-,7-,8?/m1/s1
InChIKey	VDXLUNDMVKSKHO-ZRTZXPPTSA-N	View other enantiomers/diastereomers of this metabolite in RefMet
SMILES	C(C(=O)NC1[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O1)O)O)NC=O Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super Class	Nucleic acids
Main Class	Glycinamide ribonucleotides
Sub Class	Glycinamide ribonucleotides
Distribution of FGAR in NMDR studies
Species	Plot Species distribution
Sample source	Plot Sample source(tissue) distribution
Platform	Platform (MS/NMR) used for detection
Chromatography	Chromatography methods used for detection
Studies	NMDR Studies reporting FGAR
External Links
Pubchem CID	16048611
ChEBI ID	18272
KEGG ID	C04376
HMDB ID	HMDB0001308
Structural annotation level
Annotation level	1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving FGAR

Rxn ID	KEGG Reaction	Enzyme
R04325	10-Formyltetrahydrofolate + 5'-Phosphoribosylglycinamide <=> Tetrahydrofolate + 5'-Phosphoribosyl-N-formylglycinamide	10-formyltetrahydrofolate:5'-phosphoribosylglycinamide formyltransferase
R04463	ATP + 5'-Phosphoribosyl-N-formylglycinamide + L-Glutamine + H2O <=> ADP + Orthophosphate + 2-(Formamido)-N1-(5'-phosphoribosyl)acetamidine + L-Glutamate	5'-Phosphoribosylformylglycinamide:L-glutamine amido-ligase (ADP-forming)
R06974	Formate + ATP + 5'-Phosphoribosylglycinamide <=> ADP + Orthophosphate + 5'-Phosphoribosyl-N-formylglycinamide	formate:N1-(5-phospho-beta-D-ribosyl)glycinamide ligase (ADP-forming)

Table of KEGG human pathways containing FGAR

Pathway ID	Human Pathway	# of reactions
hsa00230	Purine metabolism	2
hsa00670	One carbon pool by folate	1
hsa01100	Metabolic pathways	1