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CHEBI:28128 - 3,5-dibromo-4-hydroxyphenylpyruvic acid

ChEBI IDCHEBI:28128
ChEBI Name3,5-dibromo-4-hydroxyphenylpyruvic acid
Stars
DefinitionA 2-oxo monocarboxylic acid that is pyruvic acid in which one of the methyl hydrogens is substituted by a 3,5-dibromo-4-hydroxyphenyl group.
Secondary ChEBI IDsCHEBI:1397, CHEBI:19899
Last Modified18 February 2011
DownloadsMolfile
FormulaC9H6Br2O4
Net Charge0
Average Mass337.951
Monoisotopic Mass335.86328
SMILESO=C(O)C(=O)Cc1cc(Br)c(O)c(Br)c1
InChIInChI=1S/C9H6Br2O4/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,13H,3H2,(H,14,15)
InChIKeyNJXFZTOQSMPMRY-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3,5-dibromo-4-hydroxyphenylpyruvic acid (CHEBI:28128) has functional parent 2,6-dibromophenol (CHEBI:19391)
3,5-dibromo-4-hydroxyphenylpyruvic acid (CHEBI:28128) has functional parent pyruvic acid (CHEBI:32816)
3,5-dibromo-4-hydroxyphenylpyruvic acid (CHEBI:28128) is a 2-oxo monocarboxylic acid (CHEBI:35910)
3,5-dibromo-4-hydroxyphenylpyruvic acid (CHEBI:28128) is a organobromine compound (CHEBI:37141)
3,5-dibromo-4-hydroxyphenylpyruvic acid (CHEBI:28128) is a phenols (CHEBI:33853)
IUPAC Name 
3-(3,5-dibromo-4-hydroxyphenyl)-2-oxopropanoic acid
Synonym  Source
3,5-Dibromo-4-hydroxyphenylpyruvateKEGG COMPOUND
Manual XrefsDatabases
C04285KEGG COMPOUND
Registry NumbersSources
Reaxys:2654920Reaxys