CHEBI:137981 - 5-amino-1-(5-phosphonato-β-D-ribosyl)imidazol-3-ium

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 5-amino-1-(5-phosphonato-β-D-ribosyl)imidazol-3-ium ChEBI ID CHEBI:137981 ChEBI ASCII Name 5-amino-1-(5-phosphonato-beta-D-ribosyl)imidazol-3-ium Definition An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups as well as protonation of the endocyclic nitrogen at position 3 in the imidazole ring of 5-amino-1-(5-phospho-β-D-ribosyl)imidazole. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). Stars This entity has been manually annotated by the ChEBI Team. Submitter Anne Morgat Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H13N3O7P Net Charge -1 Average Mass 294.179 Monoisotopic Mass 294.04966 InChI InChI=1S/C8H14N3O7P/c9-5-1-10-3-11(5)8-7(13)6(12)4(18-8)2-17-19(14,15)16/h1,3-4,6-8,12-13H,2,9H2,(H2,14,15,16)/p-1/t4-,6-,7-,8-/m1/s1 InChIKey PDACUKOKVHBVHJ-XVFCMESISA-M SMILES O1[C@@H]([C@H]([C@H]([C@@H]1N2C(=C[NH+]=C2)N)O)O)COP(=O)([O-])[O-] ChEBI Ontology Outgoing 5-amino-1-(5-phosphonato-β-D-ribosyl)imidazol-3-ium (CHEBI:137981) is a organophosphate oxoanion (CHEBI:58945) 5-amino-1-(5-phosphonato-β-D-ribosyl)imidazol-3-ium (CHEBI:137981) is conjugate base of 5-amino-1-(5-phospho-β-D-ribosyl)imidazole (CHEBI:138560) Incoming 5-amino-1-(5-phospho-β-D-ribosyl)imidazole (CHEBI:138560) is conjugate acid of 5-amino-1-(5-phosphonato-β-D-ribosyl)imidazol-3-ium (CHEBI:137981) IUPAC Name 5-amino-1-(5-O-phosphonato-β-D-ribofuranosyl)-1H-imidazol-3-ium Synonym Source 5-amino-1-(5-phospho-β-D-ribosyl)imidazole UniProt Manual Xref Database 5-PHOSPHORIBOSYL-5-AMINOIMIDAZOLE MetaCyc View more database links Citations Types Sources 2684279 PubMed citation SUBMITTER 3530323 PubMed citation SUBMITTER Last Modified 28 September 2017