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CHEBI:38432 - (E,E)-3-chloromuconic acid

ChEBI IDCHEBI:38432
ChEBI Name(E,E)-3-chloromuconic acid
Stars
ASCII Name(E,E)-3-chloromuconic acid
Last Modified6 June 2007
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC6H5ClO4
Net Charge0
Average Mass176.555
Monoisotopic Mass175.98764
SMILESO=C(O)/C=C/C(Cl)=C\C(=O)O
InChIInChI=1S/C6H5ClO4/c7-4(3-6(10)11)1-2-5(8)9/h1-3H,(H,8,9)(H,10,11)/b2-1+,4-3+
InChIKeyICMVYBXQDUXEEE-MVJNYCIBSA-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)
(E,E)-3-chloromuconic acid (CHEBI:38432) has functional parent cis,trans-muconic acid (CHEBI:27671)
(E,E)-3-chloromuconic acid (CHEBI:38432) is a 3-chloromuconic acid (CHEBI:38428)
IUPAC Name 
(2E,4E)-3-chlorohexa-2,4-dienedioic acid
Registry NumbersSources
Beilstein:1724080Beilstein