RefMet Compound Details

RefMet ID	RM0033450
MW structure	51215 (View MW Metabolite Database details)
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
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)
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
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
Super Class	Nucleic acids
Main Class	Glycinamide ribonucleotides
Sub Class	Glycinamide ribonucleotides
Pubchem CID	16048611
ChEBI ID	18272
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