CHEBI:79082 - 5-methyl-1-naphthoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-methyl-1-naphthoic acid
ChEBI ID CHEBI:79082
Definition A member of the class of naphthoic acids that is 1-naphthoic acid substituted at position 5 by a methyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C12H10O2
Net Charge 0
Average Mass 186.20660
Monoisotopic Mass 186.06808
InChI InChI=1S/C12H10O2/c1-8-4-2-6-10-9(8)5-3-7-11(10)12(13)14/h2-7H,1H3,(H,13,14)
InChIKey VLEZTIKHFUAVRK-UHFFFAOYSA-N
SMILES Cc1cccc2c(cccc12)C(O)=O
Metabolite of Species Details
Streptomyces griseofuscus (NCBI:txid146922) See: PubMed
Streptomyces sahachiroi (NCBI:txid285525) 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): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5-methyl-1-naphthoic acid (CHEBI:79082) has role bacterial metabolite (CHEBI:76969)
5-methyl-1-naphthoic acid (CHEBI:79082) is a naphthoic acid (CHEBI:25483)
5-methyl-1-naphthoic acid (CHEBI:79082) is conjugate acid of 5-methyl-1-naphthoate (CHEBI:78251)
Incoming 5-methyl-1-naphthoate (CHEBI:78251) is conjugate base of 5-methyl-1-naphthoic acid (CHEBI:79082)
IUPAC Name
5-methyl-1-naphthoic acid
Synonym Source
5-methylnaphthalene-1-carboxylic acid ChEBI
Manual Xref Database
CPD-16514 MetaCyc
View more database links
Registry Number Type Source
2362059 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
15147895 PubMed citation Europe PMC
18387946 PubMed citation Europe PMC
20485749 PubMed citation Europe PMC
20735485 PubMed citation Europe PMC
Last Modified
11 November 2014