CHEBI:140258 - 14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid

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ChEBI Name 14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid
ChEBI ID CHEBI:140258
ChEBI ASCII Name 14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid
Definition A docosanoid that is (7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid carrying two hydroxy substituents at positions 14S and 21. An intermediate of specialised proresolving mediators.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Bijay
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C22H34O4
Net Charge 0
Average Mass 362.504
Monoisotopic Mass 362.24571
InChI InChI=1S/C22H34O4/c1-20(23)16-12-10-11-14-18-21(24)17-13-8-6-4-2-3-5-7-9-15-19-22(25)26/h2-3,6,8,11-14,16-17,20-21,23-24H,4-5,7,9-10,15,18-19H2,1H3,(H,25,26)/b3-2-,8-6-,14-11-,16-12-,17-13+/t20?,21-/m1/s1
InChIKey INESDRVMAJDUCT-SYINVYGLSA-N
SMILES C(C(O)=O)CCCC/C=C\C\C=C/C=C/[C@H](C/C=C\C/C=C\C(C)O)O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) 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.
Application(s): anti-inflammatory agent
Any compound that has anti-inflammatory effects.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid (CHEBI:140258) has role anti-inflammatory agent (CHEBI:67079)
14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid (CHEBI:140258) has role human xenobiotic metabolite (CHEBI:76967)
14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid (CHEBI:140258) is a docosanoid (CHEBI:131863)
14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid (CHEBI:140258) is a hydroxy polyunsaturated fatty acid (CHEBI:140345)
14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid (CHEBI:140258) is a long-chain fatty acid (CHEBI:15904)
14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid (CHEBI:140258) is a secondary allylic alcohol (CHEBI:134396)
14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid (CHEBI:140258) is conjugate acid of 14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoate (CHEBI:140393)
Incoming 14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoate (CHEBI:140393) is conjugate base of 14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid (CHEBI:140258)
IUPAC Name
(7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosa-7,10,12,16,19-pentaenoic acid
Synonyms Sources
(7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosapentaenoic acid ChEBI
14(S),21-dihydroxy-ω3-docosapentaenoic acid ChEBI
14(S),21-dihydroxy-omega3-docosapentaenoic acid ChEBI
MaR3n-3 DPA SUBMITTER
Citations Waiting for Citations Types Sources
23736886 PubMed citation Europe PMC
28408222 PubMed citation Europe PMC
Last Modified
08 March 2018