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CHEBI:140203 - 3-bromo-4-hydroxybenzoate
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ChEBI Name
3-bromo-4-hydroxybenzoate
ChEBI ID
CHEBI:140203
Definition
A 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.
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This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
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Formula
C7H4BrO3
Net Charge
-1
Average Mass
216.009
Monoisotopic Mass
214.93493
InChI
InChI=1S/C7H5BrO3/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3,9H,(H,10,11)/p-1
InChIKey
XMEQDAIDOBVHEK-UHFFFAOYSA-M
SMILES
C=1(C=CC(=C(C1)Br)O)C([O-])=O
ChEBI Ontology
Outgoing
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
3-bromo-4-hydroxybenzoic acid (
CHEBI:140241
)
is conjugate acid of
3-bromo-4-hydroxybenzoate (
CHEBI:140203
)
IUPAC Name
3-bromo-4-hydroxybenzoate
Synonym
Source
3-bromo-4-hydroxybenzoate
UniProt
Manual Xref
Database
CPD-20550
MetaCyc
View more database links
Last Modified
22 February 2018