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CHEBI:19775 - quinaldate

ChEBI IDCHEBI:19775
ChEBI Namequinaldate
Stars
DefinitionA quinolinemonocarboxylate that is the conjugate base of quinaldic acid; major species at pH 7.3.
Secondary ChEBI IDCHEBI:241750
Last Modified11 November 2014
DownloadsMolfile
FormulaC10H6NO2
Net Charge-1
Average Mass172.163
Monoisotopic Mass172.04040
SMILESO=C([O-])c1ccc2ccccc2n1
InChIInChI=1S/C10H7NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,12,13)/p-1
InChIKeyLOAUVZALPPNFOQ-UHFFFAOYSA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (23801834)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
quinaldate (CHEBI:19775) has role human metabolite (CHEBI:77746)
quinaldate (CHEBI:19775) is a quinolinemonocarboxylate (CHEBI:38773)
quinaldate (CHEBI:19775) is conjugate base of quinaldic acid (CHEBI:18386)
Incoming Relation(s)
quinaldic acid (CHEBI:18386) is conjugate acid of quinaldate (CHEBI:19775)
Synonyms  Source
quinaldate anionChEBI
quinaldate(1−)ChEBI
quinoline-2-carboxylateChEBI
UniProt Name  Source
quinaldateUniProt
Registry NumbersSources
Beilstein:329846Beilstein
Reaxys:3905706Reaxys