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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoate
ChEBI ID CHEBI:140279
ChEBI ASCII Name (4Z,8E,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosahexaenoate
Definition A 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.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C22H31O4
Net Charge -1
Average Mass 359.480
Monoisotopic Mass 359.22278
InChI InChI=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
InChIKey QEAQJVYOZNBPLR-KSJZJIFISA-M
SMILES [O-]C(CC/C=C\CC/C=C/C=C\C=C\[C@H](C/C=C\C/C=C\CC)OO)=O
ChEBI Ontology
Outgoing (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 (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
Last Modified
06 April 2022