CHEBI:28978 - (2E,4Z)-6-(4-chlorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2E,4Z)-6-(4-chlorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid
ChEBI ID CHEBI:28978
ChEBI ASCII Name (2E,4Z)-6-(4-chlorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid
Definition A 2-hydroxy monocarboxylic acid formed by biodegradative cleavage of the dihydroxylated aromatic ring of 2,3-dihydroxybiphenyl.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1136, CHEBI:19618
Supplier Information
Download Molfile XML SDF
Formula C12H9ClO4
Net Charge 0
Average Mass 252.65000
Monoisotopic Mass 252.01894
InChI InChI=1S/C12H9ClO4/c13-9-6-4-8(5-7-9)10(14)2-1-3-11(15)12(16)17/h1-7,15H,(H,16,17)/b2-1-,11-3+
InChIKey BKVFPMUIZMNOHF-QRLZPCCQSA-N
SMILES OC(=O)C(\O)=C/C=C\C(=O)c1ccc(Cl)cc1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (2E,4Z)-6-(4-chlorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid (CHEBI:28978) has functional parent sorbic acid (CHEBI:35962)
(2E,4Z)-6-(4-chlorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid (CHEBI:28978) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
(2E,4Z)-6-(4-chlorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid (CHEBI:28978) is a 2-hydroxy monocarboxylic acid (CHEBI:49302)
(2E,4Z)-6-(4-chlorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid (CHEBI:28978) is a 6-oxo monocarboxylic acid (CHEBI:35960)
(2E,4Z)-6-(4-chlorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid (CHEBI:28978) is a monochlorobenzenes (CHEBI:83403)
IUPAC Name
(2E,4Z)-6-(4-chlorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid
Synonym Source
2-Hydroxy-6-oxo-6-(4'-chlorophenyl)-hexa-2,4-dienoate KEGG COMPOUND
Manual Xrefs Databases
c0180 UM-BBD
C06587 KEGG COMPOUND
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Citations Waiting for Citations Types Sources
12430413 PubMed citation Europe PMC
15480459 PubMed citation Europe PMC
Last Modified
23 October 2014