CHEBI:140205 - (7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid
ChEBI ID CHEBI:140205
ChEBI ASCII Name (7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid
Definition An docosanoid that is (7Z,10Z,14E,16Z,19Z)-docosapentaenoic acid carrying an oxo substituent at position 13. An intermediate of specialised proresolving mediators.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Bijay
Supplier Information
Download Molfile XML SDF
Formula C22H32O3
Net Charge 0
Average Mass 344.489
Monoisotopic Mass 344.23514
InChI InChI=1S/C22H32O3/c1-2-3-4-5-9-12-15-18-21(23)19-16-13-10-7-6-8-11-14-17-20-22(24)25/h3-4,6-7,9,12-13,15-16,18H,2,5,8,10-11,14,17,19-20H2,1H3,(H,24,25)/b4-3-,7-6-,12-9-,16-13-,18-15+
InChIKey AGDTWQLXNUYUDC-RBIAUOINSA-N
SMILES C(C(O)=O)CCCC/C=C\C/C=C\CC(/C=C/C=C\C/C=C\CC)=O
Metabolite of Species Details
Homo sapiens (NCBI:txidtxid9606) See: PubMed
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): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid (CHEBI:140205) has functional parent (7Z,10Z,13Z,16Z,19Z)-docosapentaenoic acid (CHEBI:53488)
(7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid (CHEBI:140205) has role human xenobiotic metabolite (CHEBI:76967)
(7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid (CHEBI:140205) is a docosanoid (CHEBI:131863)
(7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid (CHEBI:140205) is a enone (CHEBI:51689)
(7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid (CHEBI:140205) is a oxo fatty acid (CHEBI:59644)
(7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid (CHEBI:140205) is conjugate acid of (7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoate (CHEBI:140237)
Incoming (7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoate (CHEBI:140237) is conjugate base of (7Z,10Z,14E,16Z,19Z)-13-oxodocosapentaenoic acid (CHEBI:140205)
IUPAC Name
(7Z,10Z,14E,16Z,19Z)-13-oxodocosa-7,10,14,16,19-pentaenoic acid
Synonyms Sources
(7Z,10Z,14E,16Z,19Z)-13-ketodocosapentaenoic acid ChEBI
13-oxo-(7Z,10Z,14E,16Z,19Z)-docosapentaenoic acid ChEBI
13-oxo-DPAn-3 SUBMITTER
13-oxo-ω-3-docosapentaenoic acid ChEBI
Citation Waiting for Citations Type Source
26339618 PubMed citation Europe PMC
Last Modified
22 February 2018