(3-chloro-4-hydroxyphenyl)acetic acid (CHEBI:47106)

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ChEBI Name	(3-chloro-4-hydroxyphenyl)acetic acid

ChEBI ID	CHEBI:47106

Definition	A hydroxy monocarboxylic acid that is acetic acid in which one of the methyl hydrogens is replaced by a 3-chloro-4-hydroxyphenyl group. It is a major chlorinated metabolite of chlorotyrosine.

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

Supplier Information

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Formula

C8H7ClO3

Net Charge

Average Mass

186.59200

Monoisotopic Mass

186.00837

InChI

InChI=1S/C8H7ClO3/c9-6-3-5(4-8(11)12)1-2-7(6)10/h1-3,10H,4H2,(H,11,12)

InChIKey

IYTUKSIOQKTZEG-UHFFFAOYSA-N

SMILES

OC(=O)Cc1ccc(O)c(Cl)c1

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):	mammalian metabolite Any animal metabolite produced during a metabolic reaction in mammals.

ChEBI Ontology
Outgoing	(3-chloro-4-hydroxyphenyl)acetic acid (CHEBI:47106) has functional parent acetic acid (CHEBI:15366) (3-chloro-4-hydroxyphenyl)acetic acid (CHEBI:47106) has role mammalian metabolite (CHEBI:75768) (3-chloro-4-hydroxyphenyl)acetic acid (CHEBI:47106) is a hydroxy monocarboxylic acid (CHEBI:35868) (3-chloro-4-hydroxyphenyl)acetic acid (CHEBI:47106) is a monochlorobenzenes (CHEBI:83403) (3-chloro-4-hydroxyphenyl)acetic acid (CHEBI:47106) is a phenols (CHEBI:33853)

IUPAC Name

(3-chloro-4-hydroxyphenyl)acetic acid

Synonyms	Sources
3-Chloro-4-hydroxybenzeneacetic acid	ChemIDplus
3-chloro-4-hydroxyphenylacetic acid	ChEBI

Last Modified

23 October 2014