CHEBI:66038 - (10E,12Z,15Z)-9-hydroxy-10,12,15-octadecatrienoic acid methyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (10E,12Z,15Z)-9-hydroxy-10,12,15-octadecatrienoic acid methyl ester
ChEBI ID CHEBI:66038
ChEBI ASCII Name (10E,12Z,15Z)-9-hydroxy-10,12,15-octadecatrienoic acid methyl ester
Definition A fatty acid methyl ester isolated from leaves and twigs of Ehretia dicksonii. It exhibits anti-inflammatory and inhibition of lipoxygenase activities.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ZINC000059211766
Download Molfile XML SDF
more structures >>
Formula C19H32O3
Net Charge 0
Average Mass 308.45560
Monoisotopic Mass 308.23514
InChI InChI=1S/C19H32O3/c1-3-4-5-6-7-9-12-15-18(20)16-13-10-8-11-14-17-19(21)22-2/h4-5,7,9,12,15,18,20H,3,6,8,10-11,13-14,16-17H2,1-2H3/b5-4-,9-7-,15-12+
InChIKey MTOOOXVLHAITCG-RUDXKNGCSA-N
SMILES CC\C=C/C\C=C/C=C/C(O)CCCCCCCC(=O)OC
Metabolite of Species Details
Ehretia dicksonii (IPNI:116012-1) Found in twig (BTO:0001411). See: PubMed
Ehretia dicksonii (IPNI:116012-1) Found in leaf (BTO:0000713). See: PubMed
Roles Classification
Biological Role(s): lipoxygenase inhibitor
A compound or agent that combines with lipoxygenase and thereby prevents its substrate-enzyme combination with arachidonic acid and the formation of the icosanoid products hydroxyicosatetraenoic acid and various leukotrienes.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application(s): anti-inflammatory agent
Any compound that has anti-inflammatory effects.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (10E,12Z,15Z)-9-hydroxy-10,12,15-octadecatrienoic acid methyl ester (CHEBI:66038) has role anti-inflammatory agent (CHEBI:67079)
(10E,12Z,15Z)-9-hydroxy-10,12,15-octadecatrienoic acid methyl ester (CHEBI:66038) has role lipoxygenase inhibitor (CHEBI:35856)
(10E,12Z,15Z)-9-hydroxy-10,12,15-octadecatrienoic acid methyl ester (CHEBI:66038) has role metabolite (CHEBI:25212)
(10E,12Z,15Z)-9-hydroxy-10,12,15-octadecatrienoic acid methyl ester (CHEBI:66038) is a fatty acid methyl ester (CHEBI:4986)
IUPAC Name
methyl (10E,12Z,15Z)-9-hydroxyoctadeca-10,12,15-trienoate
Registry Number Type Source
2335185 Reaxys Registry Number Reaxys
Citation
Last Modified
03 March 2015