3-fluorocatechol (CHEBI:39876)

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ChEBI Name	3-fluorocatechol

ChEBI ID	CHEBI:39876

Definition	A catechol bearing an additional fluoro substituent at position 3.

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

Supplier Information

Download	Molfile XML SDF

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Formula

C6H5FO2

Net Charge

Average Mass

128.10110

Monoisotopic Mass

128.02736

InChI

InChI=1S/C6H5FO2/c7-4-2-1-3-5(8)6(4)9/h1-3,8-9H

InChIKey

DXOSJQLIRGXWCF-UHFFFAOYSA-N

SMILES

Oc1cccc(F)c1O

Metabolite of Species	Details
Burkholderia fungorum (NCBI:txid134537)	See: PubMed
Pisolithus tinctorius (NCBI:txid37468)	See: PubMed

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.

ChEBI Ontology
Outgoing	3-fluorocatechol (CHEBI:39876) has role bacterial xenobiotic metabolite (CHEBI:76976) 3-fluorocatechol (CHEBI:39876) has role fungal xenobiotic metabolite (CHEBI:76968) 3-fluorocatechol (CHEBI:39876) is a catechols (CHEBI:33566) 3-fluorocatechol (CHEBI:39876) is a fluorophenol (CHEBI:142486) 3-fluorocatechol (CHEBI:39876) is a monofluorobenzenes (CHEBI:83575)

Incoming	WZB-117 (CHEBI:229781) has functional parent 3-fluorocatechol (CHEBI:39876)

IUPAC Name

3-fluorobenzene-1,2-diol

Last Modified

15 March 2024