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CHEBI:133933 - (4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoate

ChEBI IDCHEBI:133933
ChEBI Name(4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoate
Stars
ASCII Name(4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoate
DefinitionA docosanoid anion that is the conjugate base of (4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified16 March 2017
Submitterlaimo
DownloadsMolfile
FormulaC22H31O3
Net Charge-1
Average Mass343.487
Monoisotopic Mass343.22787
SMILESCC/C=C\C/C=C\CC1OC1C/C=C\C/C=C\C/C=C\CCC(=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/h3-4,6-7,10-15,20-21H,2,5,8-9,16-19H2,1H3,(H,23,24)/p-1/b4-3-,7-6-,13-10-,14-11-,15-12-
InChIKeyDCFKVKFLEPMEGT-UQZHZJRSSA-M
ChEBI Ontology
Outgoing Relation(s)
(4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoate (CHEBI:133933) has functional parent (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoate (CHEBI:77016)
(4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoate (CHEBI:133933) is a docosanoid anion (CHEBI:131864)
(4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoate (CHEBI:133933) is a epoxydocosapentaenoate (CHEBI:157773)
(4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoate (CHEBI:133933) is a long-chain fatty acid anion (CHEBI:57560)
(4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoate (CHEBI:133933) is conjugate base of (4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoic acid (CHEBI:136563)
Incoming Relation(s)
(4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoic acid (CHEBI:136563) is conjugate acid of (4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoate (CHEBI:133933)
IUPAC Name 
(4Z,7Z,10Z)-12-{3-[(2Z,5Z)-octa-2,5-dien-1-yl]oxiran-2-yl}dodeca-4,7,10-trienoate
UniProt Name  Source
13,14-epoxy-(4Z,7Z,10Z,16Z,19Z)-docosapentaenoateUniProt
Citations