homoveratric acid (CHEBI:86655)

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ChEBI Name	homoveratric acid

ChEBI ID	CHEBI:86655

Definition	A phenylacetic acid substituted at positions 3 and 4 by methoxy groups.

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

Supplier Information

Download	Molfile XML SDF

Formula

C10H12O4

Net Charge

Average Mass

196.202

Monoisotopic Mass

196.07356

InChI

InChI=1S/C10H12O4/c1-13-8-4-3-7(6-10(11)12)5-9(8)14-2/h3-5H,6H2,1-2H3,(H,11,12)

InChIKey

WUAXWQRULBZETB-UHFFFAOYSA-N

SMILES

O(C=1C=C(CC(O)=O)C=CC1OC)C

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in urine (BTO:0001419). See: PubMed
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO_0000131). See: PubMed

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):	human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples.

ChEBI Ontology
Outgoing	homoveratric acid (CHEBI:86655) has role human urinary metabolite (CHEBI:84087) homoveratric acid (CHEBI:86655) has role human xenobiotic metabolite (CHEBI:76967) homoveratric acid (CHEBI:86655) is a dimethoxybenzene (CHEBI:51681) homoveratric acid (CHEBI:86655) is a phenylacetic acids (CHEBI:25978)

IUPAC Name

(3,4-dimethoxyphenyl)acetic acid

Synonyms	Sources
2-(3,4-dimethoxyphenyl)acetic acid	ChEBI
2-(3,4-dimethoxyphenyl)ethanoic acid	ChEBI
3,4-dimethoxybenzeneacetic acid	HMDB
3,4-dimethoxyphenylacetic acid	HMDB
homoveratrumic acid	ChEBI

Last Modified

20 August 2019