CHEBI:156049 - 7S-hydroperoxy-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoate(1−)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 7S-hydroperoxy-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoate(1−)
ChEBI ID CHEBI:156049
ChEBI ASCII Name 7S-hydroperoxy-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoate(1-)
Stars This entity has been manually annotated by a third party.
Submitter laimo
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C22H31O4
Net Charge -1
Average Mass 359.487
Monoisotopic Mass 359.22278
InChI InChI=1S/C22H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21(26-25)19-16-14-17-20-22(23)24/h3-4,6-7,9-10,12-16,18,21,25H,2,5,8,11,17,19-20H2,1H3,(H,23,24)/p-1/b4-3-,7-6-,10-9-,13-12-,16-14-,18-15+/t21-/m1/s1
InChIKey IYPGULUSNSBANC-VPNHEHDPSA-M
SMILES C(C([O-])=O)C/C=C\C[C@@H](/C=C/C=C\C/C=C\C/C=C\C/C=C\CC)OO
ChEBI Ontology
Outgoing 7S-hydroperoxy-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoate(1−) (CHEBI:156049) is a hydroperoxydocosahexaenoate (CHEBI:131868)
Synonyms Sources
(7S)-hydroperoxy-(4Z,8E,10Z,13Z,16Z,19Z)-docosahexaenoate UniProt
7S-22:6n-3(1−) SUBMITTER
7S-HpDHA(1−) SUBMITTER
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Last Modified
06 April 2022