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> Main
CHEBI:18386 - quinaldic acid
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ChEBI Name
quinaldic acid
ChEBI ID
CHEBI:18386
Definition
A quinolinemonocarboxylic acid having the carboxy group at the 2-position.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:45416, CHEBI:1276, CHEBI:19776, CHEBI:26488, CHEBI:14999
Supplier Information
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Molfile
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Molfile
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Formula
C10H7NO2
Net Charge
0
Average Mass
173.16810
Monoisotopic Mass
173.04768
InChI
InChI=1S/C10H7NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,12,13)
InChIKey
LOAUVZALPPNFOQ-UHFFFAOYSA-N
SMILES
OC(=O)c1ccc2ccccc2n1
Metabolite of Species
Details
Saccharomyces cerevisiae
(NCBI:txid4932)
Source: yeast.sf.net See:
PubMed
Homo sapiens
(NCBI:txid9606)
See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (
Saccharomyces cerevisiae
).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
quinaldic acid (
CHEBI:18386
)
has role
Saccharomyces cerevisiae
metabolite (
CHEBI:75772
)
quinaldic acid (
CHEBI:18386
)
has role
human metabolite (
CHEBI:77746
)
quinaldic acid (
CHEBI:18386
)
is a
quinolinemonocarboxylic acid (
CHEBI:26512
)
quinaldic acid (
CHEBI:18386
)
is conjugate acid of
quinaldate (
CHEBI:19775
)
Incoming
quinaldate (
CHEBI:19775
)
is conjugate base of
quinaldic acid (
CHEBI:18386
)
IUPAC Name
quinoline-2-carboxylic acid
Synonyms
Sources
2-carboxyquinoline
ChemIDplus
2-Chinolincarbonsäure
ChEBI
2-Quinolinecarboxylate
KEGG COMPOUND
2-Quinolinecarboxylic acid
KEGG COMPOUND
Chinaldinsäure
ChEBI
Quinaldate
KEGG COMPOUND
Quinaldic acid
KEGG COMPOUND
QUINALDIC ACID
PDBeChem
Quinaldinic acid
KEGG COMPOUND
quinoline-2-carboxylic acid
ChEBI
Manual Xrefs
Databases
C06325
KEGG COMPOUND
DB02428
DrugBank
HMDB0000842
HMDB
View more database links
Registry Numbers
Types
Sources
126322
Reaxys Registry Number
Reaxys
143145
Gmelin Registry Number
Gmelin
93-10-7
CAS Registry Number
NIST Chemistry WebBook
93-10-7
CAS Registry Number
ChemIDplus
Citations
Types
Sources
23801834
PubMed citation
Europe PMC
801703
PubMed citation
Europe PMC
Last Modified
20 November 2019