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CHEBI:147339 - 2-hydroxy-6-oxonona-2,4-dienoic acid

ChEBI IDCHEBI:147339
ChEBI Name2-hydroxy-6-oxonona-2,4-dienoic acid
Stars
DefinitionAn α,β-unsaturated monocarboxylic acid that is nona-2,4-dienoic acid carrying hydroxy and oxo substituents at positions 2 and 6 respectively.
Last Modified27 March 2020
SubmitterAdnan
DownloadsMolfile
FormulaC9H12O4
Net Charge0
Average Mass184.191
Monoisotopic Mass184.07356
SMILES[H]C(C(=O)CCC)=C([H])C([H])=C(O)C(=O)O
InChIInChI=1S/C9H12O4/c1-2-4-7(10)5-3-6-8(11)9(12)13/h3,5-6,11H,2,4H2,1H3,(H,12,13)
InChIKeyXUNCLPUITPERRV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pseudomonas sp. (ncbitaxon:306) - PubMed (8481010) Strain: HBP1
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
2-hydroxy-6-oxonona-2,4-dienoic acid (CHEBI:147339) has role bacterial xenobiotic metabolite (CHEBI:76976)
2-hydroxy-6-oxonona-2,4-dienoic acid (CHEBI:147339) is a 2-hydroxy monocarboxylic acid (CHEBI:49302)
2-hydroxy-6-oxonona-2,4-dienoic acid (CHEBI:147339) is a 6-oxo monocarboxylic acid (CHEBI:35960)
2-hydroxy-6-oxonona-2,4-dienoic acid (CHEBI:147339) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
2-hydroxy-6-oxonona-2,4-dienoic acid (CHEBI:147339) is conjugate acid of 2-hydroxy-6-oxo-nona-2,4-dienoate (CHEBI:147333)
Incoming Relation(s)
2-hydroxy-6-oxo-nona-2,4-dienoate (CHEBI:147333) is conjugate base of 2-hydroxy-6-oxonona-2,4-dienoic acid (CHEBI:147339)
IUPAC Name 
2-hydroxy-6-oxonona-2,4-dienoic acid
Citations