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CHEBI:140235 - (7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoate

ChEBI IDCHEBI:140235
ChEBI Name(7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoate
Stars
ASCII Name(7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoate
DefinitionA docosanoid anion that is the conjugate base of (7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified22 February 2018
SubmitterSteve
DownloadsMolfile
FormulaC22H31O3
Net Charge-1
Average Mass343.487
Monoisotopic Mass343.22787
SMILESCC/C=C\C/C=C\CC1OC1/C=C/C=C/C=C\CCCCCC(=O)[O-]
InChIInChI=1S/C22H32O3/c1-2-3-4-5-11-14-17-20-21(25-20)18-15-12-9-7-6-8-10-13-16-19-22(23)24/h3-4,6-7,9,11-12,14-15,18,20-21H,2,5,8,10,13,16-17,19H2,1H3,(H,23,24)/p-1/b4-3-,7-6-,12-9+,14-11-,18-15+
InChIKeyLVAPVCGLGWDERB-DUKKATAHSA-M
ChEBI Ontology
Outgoing Relation(s)
(7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoate (CHEBI:140235) is a docosanoid anion (CHEBI:131864)
(7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoate (CHEBI:140235) is a long-chain fatty acid anion (CHEBI:57560)
(7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoate (CHEBI:140235) is conjugate base of (7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoic acid (CHEBI:140200)
Incoming Relation(s)
(7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoic acid (CHEBI:140200) is conjugate acid of (7Z,9E,11E,16Z,19Z)-13,14-epoxydocosapentaenoate (CHEBI:140235)
IUPAC Name 
(7Z,9E,11E)-12-{3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-7,9,11-trienoate
Synonym  Source
13,14-epoxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoateChEBI