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CHEBI:77209 - (10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoate

ChEBI IDCHEBI:77209
ChEBI Name(10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoate
Stars
ASCII Name(10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoate
DefinitionA polyunsaturated fatty acid anion that is the conjugate base of (10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified30 January 2019
Submitterlaimo
DownloadsMolfile
FormulaC28H43O2
Net Charge-1
Average Mass411.650
Monoisotopic Mass411.32685
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)[O-]
InChIInChI=1S/C28H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28(29)30/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-27H2,1H3,(H,29,30)/p-1/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-
InChIKeyBQXYAHWVQOZPTF-KUBAVDMBSA-M
ChEBI Ontology
Outgoing Relation(s)
(10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoate (CHEBI:77209) is a octacosahexaenoate (CHEBI:78066)
(10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoate (CHEBI:77209) is conjugate base of (10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoic acid (CHEBI:77373)
Incoming Relation(s)
(10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoic acid (CHEBI:77373) is conjugate acid of (10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoate (CHEBI:77209)
IUPAC Name 
(10Z,13Z,16Z,19Z,22Z,25Z)-octacosa-10,13,16,19,22,25-hexaenoate
Synonyms  Source
C28:6(ω-3)(1−)SUBMITTER
all-cis-octacosa-10,13,16,19,22,25-hexaenoateChEBI
UniProt Name  Source
(10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoateUniProt