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CHEBI:63797 - 3-hydroxy-4-methoxybenzoate

Default Structure
ChEBI IDCHEBI:63797
ChEBI Name3-hydroxy-4-methoxybenzoate
Stars
DefinitionA monohydroxybenzoate that is the conjugate base of 3-hydroxy-4-methoxybenzoic acid, arising from deprotonation of the carboxy group.
Last Modified24 May 2022
SubmitterSteve
DownloadsMolfile
FormulaC8H7O4
Net Charge-1
Average Mass167.140
Monoisotopic Mass167.03498
SMILESCOc1ccc(C(=O)[O-])cc1O
InChIInChI=1S/C8H8O4/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4,9H,1H3,(H,10,11)/p-1
InChIKeyLBKFGYZQBSGRHY-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
3-hydroxy-4-methoxybenzoate (CHEBI:63797) is a methoxybenzoate (CHEBI:25236)
3-hydroxy-4-methoxybenzoate (CHEBI:63797) is a monohydroxybenzoate (CHEBI:25388)
3-hydroxy-4-methoxybenzoate (CHEBI:63797) is conjugate base of 3-hydroxy-4-methoxybenzoic acid (CHEBI:63798)
Incoming Relation(s)
3-hydroxy-4-methoxybenzoic acid (CHEBI:63798) is conjugate acid of 3-hydroxy-4-methoxybenzoate (CHEBI:63797)
IUPAC Name 
3-hydroxy-4-methoxybenzoate
Synonym  Source
isovanillateChEBI
UniProt Name  Source
3-hydroxy-4-methoxybenzoateUniProt
Registry NumbersSources
Reaxys:6504382Reaxys
Citations