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CHEBI:46832 - 3-carboxypyridine-2-carboxylate

ChEBI IDCHEBI:46832
ChEBI Name3-carboxypyridine-2-carboxylate
Stars
DefinitionA quinolinate(1−) that is the tautomer of 2-carboxypyridine-3-carboxylate.
Last Modified26 June 2014
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC7H4NO4
Net Charge-1
Average Mass166.112
Monoisotopic Mass166.01458
SMILESO=C(O)c1cccnc1C(=O)[O-]
InChIInChI=1S/C7H5NO4/c9-6(10)4-2-1-3-8-5(4)7(11)12/h1-3H,(H,9,10)(H,11,12)/p-1
InChIKeyGJAWHXHKYYXBSV-UHFFFAOYSA-M
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
3-carboxypyridine-2-carboxylate (CHEBI:46832) is a quinolinate(1−) (CHEBI:46828)
3-carboxypyridine-2-carboxylate (CHEBI:46832) is tautomer of 2-carboxypyridine-3-carboxylate (CHEBI:46833)
Incoming Relation(s)
2-carboxypyridine-3-carboxylate (CHEBI:46833) is tautomer of 3-carboxypyridine-2-carboxylate (CHEBI:46832)
IUPAC Name 
3-carboxypyridine-2-carboxylate
Registry NumbersSources
Gmelin:329234Gmelin