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CHEBI:63093 - purine-6-carboxylic acid

ChEBI IDCHEBI:63093
ChEBI Namepurine-6-carboxylic acid
Stars
DefinitionA purinemonocarboxylic acid that consists of purine having the carboxy group located at position 6.
Last Modified24 October 2011
SubmitterSteve
DownloadsMolfile
FormulaC6H4N4O2
Net Charge0
Average Mass164.124
Monoisotopic Mass164.03343
SMILESO=C(O)c1ncnc2ncnc12
InChIInChI=1S/C6H4N4O2/c11-6(12)4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H,11,12)(H,7,8,9,10)
InChIKeyCIEQXUBLKKQRIS-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
purine-6-carboxylic acid (CHEBI:63093) is a purinemonocarboxylic acid (CHEBI:38667)
Incoming Relation(s)
purin-6-oyl group (CHEBI:63084) is substituent group from purine-6-carboxylic acid (CHEBI:63093)
IUPAC Name 
9H-purine-6-carboxylic acid
Synonyms  Source
6-carboxypurineChEBI
1H-purine-6-carboxylic acidChEBI
7(9)H-purine-6-carboxylic acidChEBI
Purin-6-carbonsäureChEBI
Registry NumbersSources
Reaxys:610875Reaxys