CHEBI:36298 - 1-naphthoate

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ChEBI Name 1-naphthoate
ChEBI ID CHEBI:36298
Definition A naphthoate that is the conjugate base of 1-naphthoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:19072, CHEBI:30901
Supplier Information
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Formula C11H7O2
Net Charge -1
Average Mass 171.17208
Monoisotopic Mass 171.04515
InChI InChI=1S/C11H8O2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H,12,13)/p-1
InChIKey LNETULKMXZVUST-UHFFFAOYSA-M
SMILES [O-]C(=O)c1cccc2ccccc12
Roles Classification
Biological Role(s): bacterial xenobiotic metabolite
Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
fungal xenobiotic metabolite
Any fungal metabolite produced by metabolism of a xenobiotic compound in fungi.
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ChEBI Ontology
Outgoing 1-naphthoate (CHEBI:36298) has role bacterial xenobiotic metabolite (CHEBI:76976)
1-naphthoate (CHEBI:36298) has role fungal xenobiotic metabolite (CHEBI:76968)
1-naphthoate (CHEBI:36298) is a naphthoate (CHEBI:25482)
1-naphthoate (CHEBI:36298) is conjugate base of 1-naphthoic acid (CHEBI:36466)
Incoming 1-naphthoic acid (CHEBI:36466) is conjugate acid of 1-naphthoate (CHEBI:36298)
IUPAC Name
naphthalene-1-carboxylate
Synonyms Sources
1-naphthoate UniProt
1-naphthoate(1−) ChEBI
Manual Xref Database
CPD-7615 MetaCyc
View more database links
Registry Numbers Types Sources
332225 Gmelin Registry Number Gmelin
3905477 Beilstein Registry Number Beilstein
3905477 Reaxys Registry Number Reaxys
Last Modified
15 January 2019