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CHEBI:28489 - 2-chloromaleylacetic acid

ChEBI IDCHEBI:28489
ChEBI Name2-chloromaleylacetic acid
Stars
DefinitionAn organochlorine compound that is maleylacetic acid substituted by a chloro group at position 2.
Secondary ChEBI IDsCHEBI:1045, CHEBI:19509
Last Modified18 June 2024
DownloadsMolfile
FormulaC6H5ClO5
Net Charge0
Average Mass192.554
Monoisotopic Mass191.98255
SMILESO=C(O)CC(=O)/C=C(/Cl)C(=O)O
InChIInChI=1S/C6H5ClO5/c7-4(6(11)12)1-3(8)2-5(9)10/h1H,2H2,(H,9,10)(H,11,12)/b4-1+
InChIKeyQOHGUQUQCPIROQ-DAFODLJHSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
2-chloromaleylacetic acid (CHEBI:28489) has functional parent maleylacetic acid (CHEBI:1184)
2-chloromaleylacetic acid (CHEBI:28489) has role bacterial metabolite (CHEBI:76969)
2-chloromaleylacetic acid (CHEBI:28489) is a organochlorine compound (CHEBI:36683)
2-chloromaleylacetic acid (CHEBI:28489) is a oxo dicarboxylic acid (CHEBI:36145)
2-chloromaleylacetic acid (CHEBI:28489) is conjugate acid of 2-chloromaleylacetate (CHEBI:231622)
Incoming Relation(s)
2-chloromaleylacetate (CHEBI:231622) is conjugate base of 2-chloromaleylacetic acid (CHEBI:28489)
IUPAC Name 
(2E)-2-chloro-4-oxohex-2-enedioic acid
Synonyms  Source
2-chloro(maleyl)acetic acidChEBI
(E)-2-chloro-4-oxo-2-hexenedioic acidChEBI
Manual XrefsDatabases
C00007488KNApSAcK
Citations