4-hydroxy-8-methoxyquinaldic acid (CHEBI:2323)

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ChEBI Name	4-hydroxy-8-methoxyquinaldic acid

ChEBI ID	CHEBI:2323

Definition	A quinolinemonocarboxylic acid that is kynurenic acid which is substituted by a methoxy group at position 8.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C11H9NO4

Net Charge

Average Mass

219.19350

Monoisotopic Mass

219.05316

InChI

InChI=1S/C11H9NO4/c1-16-9-4-2-3-6-8(13)5-7(11(14)15)12-10(6)9/h2-5H,1H3,(H,12,13)(H,14,15)

InChIKey

BXZSKDOPGDPDEG-UHFFFAOYSA-N

SMILES

COc1cccc2c(O)cc(nc12)C(O)=O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Source: BioModels - MODEL1507180067 See: PubMed

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. carcinogenic agent A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.

ChEBI Ontology
Outgoing	4-hydroxy-8-methoxyquinaldic acid (CHEBI:2323) has functional parent kynurenic acid (CHEBI:18344) 4-hydroxy-8-methoxyquinaldic acid (CHEBI:2323) has role carcinogenic agent (CHEBI:50903) 4-hydroxy-8-methoxyquinaldic acid (CHEBI:2323) has role metabolite (CHEBI:25212) 4-hydroxy-8-methoxyquinaldic acid (CHEBI:2323) has role mouse metabolite (CHEBI:75771) 4-hydroxy-8-methoxyquinaldic acid (CHEBI:2323) is a aromatic ether (CHEBI:35618) 4-hydroxy-8-methoxyquinaldic acid (CHEBI:2323) is a monohydroxyquinoline (CHEBI:38775) 4-hydroxy-8-methoxyquinaldic acid (CHEBI:2323) is a quinolinemonocarboxylic acid (CHEBI:26512)

IUPAC Name

4-hydroxy-8-methoxyquinoline-2-carboxylic acid

Synonyms	Sources
8-Methoxy-4-hydroxyquinoline-2-carboxylic acid	ChemIDplus
8-Methoxykynurenate	KEGG COMPOUND
Xanthurenic acid 8-methyl ether	KEGG COMPOUND

Last Modified

29 April 2021