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homovanillate

Go to external page http://purl.obolibrary.org/obo/CHEBI_133744

A hydroxy monocarboxylic acid anion which is obtained by deprotonation of the carboxy group of homovanillic acid.

Term info

Label

homovanillate

Synonyms
  • (4-hydroxy-3-methoxyphenyl)acetate
Subsets

3_STAR

IUPAC NAME
(4-hydroxy-3-methoxyphenyl)acetate [ IUPAC ]

charge

-1

formula

C9H9O4

has obo namespace

chebi_ontology

has related synonym

3-methoxy-4-hydroxyphenylacetate

id

CHEBI:133744

inchi

InChI=1S/C9H10O4/c1-13-8-4-6(5-9(11)12)2-3-7(8)10/h2-4,10H,5H2,1H3,(H,11,12)/p-1

inchikey

QRMZSPFSDQBLIX-UHFFFAOYSA-M

mass

181.166

monoisotopicmass

181.05063

smiles

C1=C(C(=CC(=C1)CC([O-])=O)OC)O