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CHEBI:140279 - (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoate

ChEBI IDCHEBI:140279
ChEBI Name(4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoate
Stars
ASCII Name(4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoate
DefinitionA docosanoid anion that is the conjugate base of (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified6 April 2022
SubmitterSteve
DownloadsMolfile
FormulaC22H31O4
Net Charge-1
Average Mass359.486
Monoisotopic Mass359.22278
SMILESCC/C=C\C/C=C\C[C@@H](/C=C/C=C\C=C\CC/C=C\CCC(=O)[O-])OO
InChIInChI=1S/C22H32O4/c1-2-3-4-5-12-15-18-21(26-25)19-16-13-10-8-6-7-9-11-14-17-20-22(23)24/h3-4,6,8,10-16,19,21,25H,2,5,7,9,17-18,20H2,1H3,(H,23,24)/p-1/b4-3-,8-6+,13-10-,14-11-,15-12-,19-16+/t21-/m0/s1
InChIKeyQEAQJVYOZNBPLR-KSJZJIFISA-M
ChEBI Ontology
Outgoing Relation(s)
(4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoate (CHEBI:140279) is a hydroperoxydocosahexaenoate (CHEBI:131868)
(4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoate (CHEBI:140279) is conjugate base of (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoic acid (CHEBI:140220)
Incoming Relation(s)
(4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoic acid (CHEBI:140220) is conjugate acid of (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoate (CHEBI:140279)
IUPAC Name 
(4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-4,8,10,12,16,19-hexaenoate
Synonym  Source
14(S)-HpDHA(1−)ChEBI