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

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ChEBI Name 1,4-dihydroxy-2-naphthoic acid ChEBI ID CHEBI:18094 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 Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search 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) InChIKey VOJUXHHACRXLTD-UHFFFAOYSA-N 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) IUPAC Name 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 C03657 KEGG COMPOUND ECMDB04054 ECMDB View more database links Registry Numbers Types Sources 2111226 Reaxys Registry Number Reaxys 31519-22-9 CAS Registry Number KEGG COMPOUND 31519-22-9 CAS Registry Number ChemIDplus Citations Types Sources 1091286 PubMed citation Europe PMC 23801651 PubMed citation Europe PMC Last Modified 13 October 2016