CHEBI:19480 - 2-bromomaleylacetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-bromomaleylacetate
ChEBI ID CHEBI:19480
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H3BrO5
Net Charge -2
Average Mass 234.98902
Monoisotopic Mass 233.91748
InChI InChI=1S/C6H5BrO5/c7-4(6(11)12)1-3(8)2-5(9)10/h1H,2H2,(H,9,10)(H,11,12)/p-2/b4-1+
InChIKey BUEHDPHFFMWTBP-DAFODLJHSA-L
SMILES [O-]C(=O)CC(=O)\C=C(\Br)C([O-])=O
ChEBI Ontology
Outgoing 2-bromomaleylacetate (CHEBI:19480) has functional parent hex-2-enedioate (CHEBI:25781)
2-bromomaleylacetate (CHEBI:19480) has functional parent maleylacetate (CHEBI:16468)
2-bromomaleylacetate (CHEBI:19480) is a bromocarboxylic acid anion (CHEBI:37159)
2-bromomaleylacetate (CHEBI:19480) is a oxo dicarboxylate (CHEBI:36147)
IUPAC Name
(2E)-2-bromo-4-oxohex-2-enedioate
Synonyms Sources
2-bromo-4-oxo-2E-hexenedioate UM-BBD
2-bromomaleylacetate UM-BBD
Manual Xrefs Databases
c0507 UM-BBD
C16249 KEGG COMPOUND
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Last Modified
04 August 2014