2,3,4-trihydroxbenzophenone (CHEBI:176813)

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ChEBI Name	2,3,4-trihydroxbenzophenone

ChEBI ID	CHEBI:176813

Definition	A benzenetriol that is benzophenone in which one of the phenyl groups is substituted by hydroxy groups at positions 2, 3, and 4. It is a redox mediator.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	MetaboLights Rahi Navelkar

Secondary ChEBI IDs	CHEBI:180666

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Formula

C13H10O4

Net Charge

Average Mass

230.219

Monoisotopic Mass

230.05791

InChI

InChI=1S/C13H10O4/c14-10-7-6-9(12(16)13(10)17)11(15)8-4-2-1-3-5-8/h1-7,14,16-17H

InChIKey

HTQNYBBTZSBWKL-UHFFFAOYSA-N

SMILES

OC1=C(O)C(O)=C(C=C1)C(=O)C1=CC=CC=C1

Metabolite of Species	Details
Rattus norvegicus (NCBI:txid10116)	See: PubMed
Homo sapiens (NCBI:txid9606)	Found in semen (UBERON:0001968). See: PubMed
Homo sapiens (NCBI:txid9606)	Found in urine (BTO:0001419). See: PubMed
Homo sapiens (NCBI:txid9606)	Found in feces (BTO:0000440). See: MetaboLights Study

Roles Classification
Biological Role(s):	quorum sensing inhibitor Any compound that interferes with bacterial communication (quorum sensing, QS). EC 1.14.18.1 (tyrosinase) inhibitor Any EC 1.14.18.* (oxidoreductase acting on paired donors, miscellaneous compound as one donor, incorporating 1 atom of oxygen) inhibitor that interferes with the action of tyrosinase (monophenol monooxygenase), EC 1.14.18.1, an enzyme that catalyses the oxidation of phenols (such as tyrosine) and is widespread in plants and animals. human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. rat metabolite Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus). drug metabolite

ChEBI Ontology
Outgoing	2,3,4-trihydroxbenzophenone (CHEBI:176813) has role drug metabolite (CHEBI:49103) 2,3,4-trihydroxbenzophenone (CHEBI:176813) has role EC 1.14.18.1 (tyrosinase) inhibitor (CHEBI:59997) 2,3,4-trihydroxbenzophenone (CHEBI:176813) has role human urinary metabolite (CHEBI:84087) 2,3,4-trihydroxbenzophenone (CHEBI:176813) has role quorum sensing inhibitor (CHEBI:138977) 2,3,4-trihydroxbenzophenone (CHEBI:176813) has role rat metabolite (CHEBI:86264) 2,3,4-trihydroxbenzophenone (CHEBI:176813) is a benzenetriol (CHEBI:22707) 2,3,4-trihydroxbenzophenone (CHEBI:176813) is a hydroxybenzophenone (CHEBI:24677)

IUPAC Name

phenyl(2,3,4-trihydroxyphenyl)methanone

Last Modified

18 October 2021