CHEBI:140242 - 3-bromo-4,5-dihydroxybenzoic acid

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ChEBI Name 3-bromo-4,5-dihydroxybenzoic acid
Definition A dihydroxybenzoic acid that is 4,5-dihydroxybenzoic acid carrying an additional bromo substituent at position 3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C7H5BrO4
Net Charge 0
Average Mass 233.016
Monoisotopic Mass 231.93712
InChI InChI=1S/C7H5BrO4/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,9-10H,(H,11,12)
SMILES C=1(C=C(C(=C(C1)Br)O)O)C(O)=O
Metabolite of Species Details
Pseudoalteromonas phenolica (NCBI:txid1315281) of strain O-BC30 See: PubMed
Pseudoalteromonas luteoviolacea (NCBI:txid1353533) of strain 2ta16 See: PubMed
Rhodomela confervoides (NCBI:txid35163) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): algal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in algae including unicellular organisms like chlorella and diatoms to multicellular organisms like giant kelps and brown algae.
marine xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
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ChEBI Ontology
Outgoing 3-bromo-4,5-dihydroxybenzoic acid (CHEBI:140242) has functional parent benzoic acid (CHEBI:30746)
3-bromo-4,5-dihydroxybenzoic acid (CHEBI:140242) has role algal metabolite (CHEBI:84735)
3-bromo-4,5-dihydroxybenzoic acid (CHEBI:140242) has role marine xenobiotic metabolite (CHEBI:83399)
3-bromo-4,5-dihydroxybenzoic acid (CHEBI:140242) is a bromobenzenes (CHEBI:37149)
3-bromo-4,5-dihydroxybenzoic acid (CHEBI:140242) is a dihydroxybenzoic acid (CHEBI:23778)
3-bromo-4,5-dihydroxybenzoic acid (CHEBI:140242) is conjugate acid of 3-bromo-4,5-dihydroxybenzoate (CHEBI:140211)
Incoming 3-bromo-4,5-dihydroxybenzoate (CHEBI:140211) is conjugate base of 3-bromo-4,5-dihydroxybenzoic acid (CHEBI:140242)
3-bromo-4,5-dihydroxybenzoic acid
Synonyms Sources
5-Bromo-3,4-dihydroxybenzoic acid ChemIDplus
5-Bromoprotocatechuic acid ChemIDplus
Manual Xref Database
CPD-20593 MetaCyc
View more database links
Registry Numbers Types Sources
2368710 Reaxys Registry Number Reaxys
2368710 Beilstein Registry Number ChemIDplus
61203-46-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
12662116 PubMed citation Europe PMC
24974229 PubMed citation Europe PMC
25061970 PubMed citation Europe PMC
Last Modified
23 February 2018