CHEBI:72844 - 15-oxoEDE

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 15-oxoEDE
ChEBI ID CHEBI:72844
Definition An oxoeicosadienoic acid that consists of 11Z,13E-oxoeicosadienoic acid with the oxo substituent located at position 15.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H34O3
Net Charge 0
Average Mass 322.48220
Monoisotopic Mass 322.25079
InChI InChI=1S/C20H34O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h9,11,14,17H,2-8,10,12-13,15-16,18H2,1H3,(H,22,23)/b11-9-,17-14+
InChIKey QZCMHXPXGACWLJ-QWAPPMFBSA-N
SMILES CCCCCC(=O)\C=C\C=C/CCCCCCCCCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via OxoEDE )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 15-oxoEDE (CHEBI:72844) has functional parent 15-HEDE (CHEBI:72847)
15-oxoEDE (CHEBI:72844) has role metabolite (CHEBI:25212)
15-oxoEDE (CHEBI:72844) is a enone (CHEBI:51689)
15-oxoEDE (CHEBI:72844) is a OxoEDE (CHEBI:72846)
15-oxoEDE (CHEBI:72844) is conjugate acid of 15-oxo-EDE(1−) (CHEBI:134546)
Incoming 15-oxo-EDE(1−) (CHEBI:134546) is conjugate base of 15-oxoEDE (CHEBI:72844)
IUPAC Name
(11Z,13E)-15-oxoicosa-11,13-dienoic acid
Synonyms Sources
15-KEDE ChEBI
15-keto-11Z,13E-eicosadienoic acid ChEBI
15-oxo-11Z,13E-eicosadienoic acid LIPID MAPS
Manual Xref Database
LMFA01060073 LIPID MAPS
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Last Modified
17 April 2013