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CHEBI:140203 - 3-bromo-4-hydroxybenzoate

ChEBI IDCHEBI:140203
ChEBI Name3-bromo-4-hydroxybenzoate
Stars
DefinitionA monohydroxybenzoate that is the conjugate base of 3-bromo-4-hydroxybenzoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified22 February 2018
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC7H4BrO3
Net Charge-1
Average Mass216.010
Monoisotopic Mass214.93493
SMILESO=C([O-])c1ccc(O)c(Br)c1
InChIInChI=1S/C7H5BrO3/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3,9H,(H,10,11)/p-1
InChIKeyXMEQDAIDOBVHEK-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
3-bromo-4-hydroxybenzoate (CHEBI:140203) has functional parent benzoate (CHEBI:16150)
3-bromo-4-hydroxybenzoate (CHEBI:140203) is a monohydroxybenzoate (CHEBI:25388)
3-bromo-4-hydroxybenzoate (CHEBI:140203) is conjugate base of 3-bromo-4-hydroxybenzoic acid (CHEBI:140241)
Incoming Relation(s)
3-bromo-4-hydroxybenzoic acid (CHEBI:140241) is conjugate acid of 3-bromo-4-hydroxybenzoate (CHEBI:140203)
IUPAC Name 
3-bromo-4-hydroxybenzoate
UniProt Name  Source
3-bromo-4-hydroxybenzoateUniProt
Manual XrefsDatabases
CPD-20550MetaCyc