CHEBI:57903 - [1-(5-phosphonatoribosyl)imidazol-4-yl]acetate(3−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name [1-(5-phosphonatoribosyl)imidazol-4-yl]acetate(3−)
ChEBI ID CHEBI:57903
ChEBI ASCII Name [1-(5-phosphonatoribosyl)imidazol-4-yl]acetate(3-)
Definition Trianion of [1-(5-phosphoribosyl)imidazol-4-yl]acetic acid arising from deprotonation of the carboxy and phosphate groups; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C10H12N2O9P
Net Charge -3
Average Mass 335.18400
Monoisotopic Mass 335.02969
InChI InChI=1S/C10H15N2O9P/c13-7(14)1-5-2-12(4-11-5)10-9(16)8(15)6(21-10)3-20-22(17,18)19/h2,4,6,8-10,15-16H,1,3H2,(H,13,14)(H2,17,18,19)/p-3/t6-,8-,9-,10?/m1/s1
InChIKey RDQUQBHPMYFYMX-XIWVQZPPSA-K
SMILES O[C@@H]1[C@@H](COP([O-])([O-])=O)OC([C@@H]1O)n1cnc(CC([O-])=O)c1
ChEBI Ontology
Outgoing [1-(5-phosphonatoribosyl)imidazol-4-yl]acetate(3−) (CHEBI:57903) is a monocarboxylic acid anion (CHEBI:35757)
[1-(5-phosphonatoribosyl)imidazol-4-yl]acetate(3−) (CHEBI:57903) is a organophosphate oxoanion (CHEBI:58945)
[1-(5-phosphonatoribosyl)imidazol-4-yl]acetate(3−) (CHEBI:57903) is conjugate base of [1-(5-phosphoribosyl)imidazol-4-yl]acetic acid (CHEBI:16805)
Incoming [1-(5-phosphoribosyl)imidazol-4-yl]acetic acid (CHEBI:16805) is conjugate acid of [1-(5-phosphonatoribosyl)imidazol-4-yl]acetate(3−) (CHEBI:57903)
IUPAC Names
4-(carboxylatomethyl)-1-(5-O-phosphonato-D-ribofuranosyl)-1H-imidazole
[1-(5-phosphonatoribofuranosyl)imidazol-4-yl]acetate
Synonyms Sources
1-(5-phosphoribosyl)imidazole-4-acetate UniProt
[1-(5-phosphonatoribosyl)imidazol-4-yl]acetate trianion ChEBI
Last Modified
01 March 2011