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CHEBI:144490 - (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate

ChEBI IDCHEBI:144490
ChEBI Name(2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate
Stars
ASCII Name(2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate
DefinitionA 2-hydroxy-6-oxo-2,4-heptadienoate which has 2Z,4E configuration. Obtained by deprotonation of the carboxy group of (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoic acid, it is the major species at pH 7.3.
Last Modified14 August 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC7H7O4
Net Charge-1
Average Mass155.129
Monoisotopic Mass155.03498
SMILESCC(=O)/C=C/C=C(\O)C(=O)[O-]
InChIInChI=1S/C7H8O4/c1-5(8)3-2-4-6(9)7(10)11/h2-4,9H,1H3,(H,10,11)/p-1/b3-2+,6-4-
InChIKeyHVZGWILTESYJSP-ZPYFUIHZSA-M
Roles Classification
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
(2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate (CHEBI:144490) is a 2-hydroxy-6-oxo-2,4-heptadienoate (CHEBI:90887)
(2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate (CHEBI:144490) is conjugate base of (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoic acid (CHEBI:144513)
Incoming Relation(s)
(2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoic acid (CHEBI:144513) is conjugate acid of (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate (CHEBI:144490)
IUPAC Name 
(2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate
UniProt Name  Source
(2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoateUniProt
Manual XrefsDatabases
CPD-8782MetaCyc
Citations