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CHEBI:40479 - 3-(5-amino-7-hydroxy-2H-[1,2,3]triazolo[4,5-d]pyrimidin-2-yl)benzoic acid

ChEBI IDCHEBI:40479
ChEBI Name3-(5-amino-7-hydroxy-2H-[1,2,3]triazolo[4,5-d]pyrimidin-2-yl)benzoic acid
Stars
ASCII Name3-(5-amino-7-hydroxy-2H-[1,2,3]triazolo[4,5-d]pyrimidin-2-yl)benzoic acid
Last Modified17 October 2009
DownloadsMolfile
FormulaC11H8N6O3
Net Charge0
Average Mass272.224
Monoisotopic Mass272.06579
SMILES[H]OC(=O)c1c([H])c([H])c([H])c(-n2nc3nc(N([H])[H])nc(O[H])c3n2)c1[H]
InChIInChI=1S/C11H8N6O3/c12-11-13-8-7(9(18)14-11)15-17(16-8)6-3-1-2-5(4-6)10(19)20/h1-4H,(H,19,20)(H3,12,13,14,16,18)
InChIKeyKNLLRZNGRRRPEW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(5-amino-7-hydroxy-2H-[1,2,3]triazolo[4,5-d]pyrimidin-2-yl)benzoic acid (CHEBI:40479) has functional parent benzoic acid (CHEBI:30746)
3-(5-amino-7-hydroxy-2H-[1,2,3]triazolo[4,5-d]pyrimidin-2-yl)benzoic acid (CHEBI:40479) is a triazolopyrimidines (CHEBI:48435)
Synonyms  Source
3-(5-AMINO-7-HYDROXY-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDIN-2-YL)-BENZOIC ACIDPDBeChem
3-(5-amino-7-hydroxy-2H-[1,2,3]triazolo[4,5-d]pyrimidin-2-yl)benzoic acidPDBeChem
Manual XrefsDatabases
A45PDBeChem