CHEBI:63238 - (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid

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ChEBI Name (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid
ChEBI ID CHEBI:63238
ChEBI ASCII Name (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid
Definition A lipid hydroperoxide, obtained by the formal substitution of a hydrogen at position 9 of (10E,12Z,15Z)-octadeca-10,12,15-trienoic acid by a hydroperoxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ZINC000059211766
Download Molfile XML SDF
Formula C18H30O4
Net Charge 0
Average Mass 310.42840
Monoisotopic Mass 310.21441
InChI InChI=1S/C18H30O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h3-4,6,8,11,14,17,21H,2,5,7,9-10,12-13,15-16H2,1H3,(H,19,20)/b4-3-,8-6-,14-11+
InChIKey RWKJTIHNYSIIHW-CUHSZNQNSA-N
SMILES CC\C=C/C\C=C/C=C/C(CCCCCCCC(O)=O)OO
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid (CHEBI:63238) is a hydroperoxyoctadecatrienoic acid (CHEBI:134615)
(10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid (CHEBI:63238) is conjugate acid of (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoate (CHEBI:63239)
Incoming (9R,10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid (CHEBI:63237) is a (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid (CHEBI:63238)
(9S,10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid (CHEBI:60961) is a (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid (CHEBI:63238)
(10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoate (CHEBI:63239) is conjugate base of (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid (CHEBI:63238)
IUPAC Name
(10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid
Registry Number Type Source
15426607 Reaxys Registry Number Reaxys
Last Modified
13 April 2018