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CHEBI:189559 - (3,5-dihydroxyphenyl)acetate

Default Structure
ChEBI IDCHEBI:189559
ChEBI Name(3,5-dihydroxyphenyl)acetate
Stars
DefinitionA dihydroxy monocarboxylic acid anion that is the conjugate base of (3,5-dihydroxyphenyl)acetic acid, arising from deprotonation of the carboxy group; major microspecies at pH 7.3.
Last Modified27 January 2022
SubmitterAnne Morgat
DownloadsMolfile
FormulaC8H7O4
Net Charge-1
Average Mass167.140
Monoisotopic Mass167.03498
SMILESO=C([O-])Cc1cc(O)cc(O)c1
InChIInChI=1S/C8H8O4/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4,9-10H,3H2,(H,11,12)/p-1
InChIKeyIOVOJJDSFSXJQN-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
(3,5-dihydroxyphenyl)acetate (CHEBI:189559) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
(3,5-dihydroxyphenyl)acetate (CHEBI:189559) is conjugate base of (3,5-dihydroxyphenyl)acetic acid (CHEBI:131431)
Incoming Relation(s)
(3,5-dihydroxyphenyl)acetic acid (CHEBI:131431) is conjugate acid of (3,5-dihydroxyphenyl)acetate (CHEBI:189559)
IUPAC Name 
(3,5-dihydroxyphenyl)acetate
Synonym  Source
3,5-dihydroxyphenylacetateSUBMITTER
UniProt Name  Source
(3,5-dihydroxyphenyl)acetateUniProt
Citations