CHEBI:133988 - (9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoic acid
ChEBI ID CHEBI:133988
ChEBI ASCII Name (9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoic acid
Definition A hydroperoxyoctadecatrienoic acid, obtained by the formal substitution of a hydrogen at position 11 of (9Z,12Z,15Z)-octadecatrienoic acid by a hydroperoxy group (the 11R-stereoisomer).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C18H30O4
Net Charge 0
Average Mass 310.429
Monoisotopic Mass 310.21441
InChI InChI=1S/C18H30O4/c1-2-3-4-8-11-14-17(22-21)15-12-9-6-5-7-10-13-16-18(19)20/h3-4,11-12,14-15,17,21H,2,5-10,13,16H2,1H3,(H,19,20)/b4-3-,14-11-,15-12-/t17-/m0/s1
InChIKey RYAKCZURVOCRAI-JZTOSSBESA-N
SMILES C(CCCCCCC/C=C\[C@H](/C=C\C/C=C\CC)OO)(=O)O
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 (9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoic acid (CHEBI:133988) has functional parent α-linolenic acid (CHEBI:27432)
(9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoic acid (CHEBI:133988) is a hydroperoxyoctadecatrienoic acid (CHEBI:134615)
(9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoic acid (CHEBI:133988) is conjugate acid of (9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoate (CHEBI:133989)
Incoming (9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoate (CHEBI:133989) is conjugate base of (9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoic acid (CHEBI:133988)
IUPAC Name
(9Z,11R,12Z,15Z)-11-hydroperoxyoctadeca-9,12,15-trienoic acid
Synonyms Sources
(11R)-HPOTrE ChEBI
(11R)-hydroperoxy-(9Z,12Z,15Z)-octadecatrienoic acid ChEBI
11(R)-HPOTrE ChEBI
Last Modified
21 March 2017