CHEBI:50526 - phenolate

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ChEBI Name phenolate
ChEBI ID CHEBI:50526
Definition A phenolate anion that is the conjugate base of phenol obtained by deprotonation of the OH group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H5O
Net Charge -1
Average Mass 93.10330
Monoisotopic Mass 93.034
InChI InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H/p-1
InChIKey ISWSIDIOOBJBQZ-UHFFFAOYSA-M
SMILES [O-]c1ccccc1
Roles Classification
Biological Role(s): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing phenolate (CHEBI:50526) has role human xenobiotic metabolite (CHEBI:76967)
phenolate (CHEBI:50526) is a phenolate anion (CHEBI:50525)
phenolate (CHEBI:50526) is conjugate base of phenol (CHEBI:15882)
Incoming sodium phenolate (CHEBI:52476) is a phenolate (CHEBI:50526)
phenol (CHEBI:15882) is conjugate acid of phenolate (CHEBI:50526)
IUPAC Name
phenolate
Synonyms Sources
Phenol ion ChemIDplus
phenoxide anion NIST Chemistry WebBook
Phenoxy ion ChemIDplus
Registry Numbers Types Sources
2793 Gmelin Registry Number Gmelin
3229-70-7 CAS Registry Number NIST Chemistry WebBook
3229-70-7 CAS Registry Number ChemIDplus
3587965 Beilstein Registry Number Beilstein
Last Modified
24 June 2014