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CHEBI:58564 - 5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate

ChEBI IDCHEBI:58564
ChEBI Name5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate
Stars
ASCII Name5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate
DefinitionTrianion of 5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxylic acid.
Last Modified21 January 2016
DownloadsMolfile
FormulaC9H11N3O9P
Net Charge-3
Average Mass336.173
Monoisotopic Mass336.02494
SMILESNc1c(C(=O)[O-])ncn1[C@@H]1O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]1O
InChIInChI=1S/C9H14N3O9P/c10-7-4(9(15)16)11-2-12(7)8-6(14)5(13)3(21-8)1-20-22(17,18)19/h2-3,5-6,8,13-14H,1,10H2,(H,15,16)(H2,17,18,19)/p-3/t3-,5-,6-,8-/m1/s1
InChIKeyXFVULMDJZXYMSG-ZIYNGMLESA-K
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate (CHEBI:58564) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate (CHEBI:58564) has role human metabolite (CHEBI:77746)
5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate (CHEBI:58564) is a imidazolyl carboxylic acid anion (CHEBI:38466)
5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate (CHEBI:58564) is a organophosphate oxoanion (CHEBI:58945)
5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate (CHEBI:58564) is conjugate base of 5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxylic acid (CHEBI:28413)
Incoming Relation(s)
5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxylic acid (CHEBI:28413) is conjugate acid of 5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate (CHEBI:58564)
IUPAC Name 
5-amino-1-(5-O-phosphonato-β-D-ribofuranosyl)-1H-imidazole-4-carboxylate