CHEBI:133543 - (4Z,7E,9E,11E,13Z,15E,17S,19Z)-7,8-epoxy-17-hydroxydocosahexaenoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (4Z,7E,9E,11E,13Z,15E,17S,19Z)-7,8-epoxy-17-hydroxydocosahexaenoate
ChEBI ID CHEBI:133543
ChEBI ASCII Name (4Z,7E,9E,11E,13Z,15E,17S,19Z)-7,8-epoxy-17-hydroxydocosahexaenoate
Definition A hydroxy polyunsaturated fatty acid anion that is the conjugate base of (4Z,7E,9E,11E,13Z,15E,17S,19Z)-7,8-epoxy-17-hydroxydocosahexaenoic 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.
Submitter AnneNiknejad
Supplier Information
Download Molfile XML SDF
Formula C22H29O4
Net Charge -1
Average Mass 357.464
Monoisotopic Mass 357.20713
InChI InChI=1S/C22H30O4/c1-2-3-9-14-19(23)15-10-6-4-5-7-11-16-20-21(26-20)17-12-8-13-18-22(24)25/h3-12,15-16,19-21,23H,2,13-14,17-18H2,1H3,(H,24,25)/p-1/b6-4-,7-5+,9-3-,12-8-,15-10+,16-11+/t19-,20?,21?/m0/s1
InChIKey BOFBVWROGCPAFH-VEYGSZKMSA-M
SMILES C1(\C=C\C=C\C=C/C=C/[C@H](C/C=C\CC)O)C(C/C=C\CCC([O-])=O)O1
ChEBI Ontology
Outgoing (4Z,7E,9E,11E,13Z,15E,17S,19Z)-7,8-epoxy-17-hydroxydocosahexaenoate (CHEBI:133543) is a hydroxy polyunsaturated fatty acid anion (CHEBI:131871)
(4Z,7E,9E,11E,13Z,15E,17S,19Z)-7,8-epoxy-17-hydroxydocosahexaenoate (CHEBI:133543) is a long-chain fatty acid anion (CHEBI:57560)
(4Z,7E,9E,11E,13Z,15E,17S,19Z)-7,8-epoxy-17-hydroxydocosahexaenoate (CHEBI:133543) is conjugate base of (4Z,9E,11E,13Z,15E,17S,19Z)-7,8-epoxy-17-hydroxydocosahexaenoic acid (CHEBI:134608)
Incoming (4Z,9E,11E,13Z,15E,17S,19Z)-7,8-epoxy-17-hydroxydocosahexaenoic acid (CHEBI:134608) is conjugate acid of (4Z,7E,9E,11E,13Z,15E,17S,19Z)-7,8-epoxy-17-hydroxydocosahexaenoate (CHEBI:133543)
IUPAC Name
(4Z)-6-{3-[(1E,3E,5Z,7E,9S,11Z)-9-hydroxytetradeca-1,3,5,7,11-pentaen-1-yl]oxiran-2-yl}hex-4-enoate
Synonyms Sources
7,8-epoxy-(17S)-hydroxy-(4Z,7E,9E,11E,13Z,15E,19Z)-docosahexaenoate ChEBI
7,8-epoxy-17S-HDHA(1−) ChEBI
Last Modified
20 February 2017