CHEBI:140387 - 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate
ChEBI ID CHEBI:140387
ChEBI ASCII Name 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate
Definition A docosanoid anion that is the conjugate base of 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C22H33O4
Net Charge -1
Average Mass 361.496
Monoisotopic Mass 361.23843
InChI InChI=1S/C22H34O4/c1-2-3-4-5-11-14-17-20(23)21(24)18-15-12-9-7-6-8-10-13-16-19-22(25)26/h3-4,6-7,9,11-12,14-15,18,20-21,23-24H,2,5,8,10,13,16-17,19H2,1H3,(H,25,26)/p-1/b4-3-,7-6-,12-9+,14-11-,18-15+/t20-,21?/m0/s1
InChIKey WQCVCAMRMROGHL-PZSFLIPTSA-M
SMILES C(\C=C\C=C\C([C@@H](O)C/C=C\C/C=C\CC)O)=C\CCCCCC([O-])=O
ChEBI Ontology
Outgoing 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate (CHEBI:140387) is a docosanoid anion (CHEBI:131864)
13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate (CHEBI:140387) is a hydroxy polyunsaturated fatty acid anion (CHEBI:131871)
13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate (CHEBI:140387) is a long-chain fatty acid anion (CHEBI:57560)
13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate (CHEBI:140387) is conjugate base of 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoic acid (CHEBI:140257)
Incoming 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoic acid (CHEBI:140257) is conjugate acid of 13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoate (CHEBI:140387)
IUPAC Name
(7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosa-7,9,11,16,19-pentaenoate
Synonyms Sources
(7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosapentaenoate ChEBI
13,14(S)-dihydroxy-ω3-docosapentaenoate ChEBI
13,14(S)-dihydroxy-omega3-docosapentaenoate ChEBI
MaR2n-3 DPA(1−) ChEBI
Last Modified
08 March 2018