CHEBI:18094 - 1,4-dihydroxy-2-naphthoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1,4-dihydroxy-2-naphthoic acid
Definition A naphthoic acid that is 2-naphthoic acid substituted by hydroxy groups at positions 1 and 4.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:539, CHEBI:18933
Supplier Information
Download Molfile XML SDF
Formula C11H8O4
Net Charge 0
Average Mass 204.17880
Monoisotopic Mass 204.04226
InChI InChI=1S/C11H8O4/c12-9-5-8(11(14)15)10(13)7-4-2-1-3-6(7)9/h1-5,12-13H,(H,14,15)
SMILES OC(=O)c1cc(O)c2ccccc2c1O
Metabolite of Species Details
Escherichia coli (NCBI:txid562) See: PubMed
Escherichia coli (NCBI:txid562) 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): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1,4-dihydroxy-2-naphthoic acid (CHEBI:18094) has functional parent 2-naphthoic acid (CHEBI:36106)
1,4-dihydroxy-2-naphthoic acid (CHEBI:18094) has role Escherichia coli metabolite (CHEBI:76971)
1,4-dihydroxy-2-naphthoic acid (CHEBI:18094) is a dihydroxy monocarboxylic acid (CHEBI:35972)
1,4-dihydroxy-2-naphthoic acid (CHEBI:18094) is a naphthalenediols (CHEBI:23783)
1,4-dihydroxy-2-naphthoic acid (CHEBI:18094) is a naphthohydroquinone (CHEBI:51475)
1,4-dihydroxy-2-naphthoic acid (CHEBI:18094) is a naphthoic acid (CHEBI:25483)
1,4-dihydroxy-2-naphthoic acid (CHEBI:18094) is conjugate acid of 1,4-dihydroxy-2-naphthoate (CHEBI:11173)
Incoming 1,4-dihydroxy-2-naphthoyl-CoA (CHEBI:52668) has functional parent 1,4-dihydroxy-2-naphthoic acid (CHEBI:18094)
1,4-dihydroxy-2-naphthoate (CHEBI:11173) is conjugate base of 1,4-dihydroxy-2-naphthoic acid (CHEBI:18094)
1,4-dihydroxynaphthalene-2-carboxylic acid
Synonyms Sources
1,4-Dihydroxy-2-naphthalenecarboxylic acid ChemIDplus
1,4-Dihydroxy-2-naphthoic acid KEGG COMPOUND
Manual Xrefs Databases
C00000736 KNApSAcK
View more database links
Registry Numbers Types Sources
2111226 Reaxys Registry Number Reaxys
2111226 Beilstein Registry Number Beilstein
31519-22-9 CAS Registry Number KEGG COMPOUND
31519-22-9 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
1091286 PubMed citation Europe PMC
23801651 PubMed citation Europe PMC
Last Modified
13 October 2016