Molecule ID: 10244787

IUPAC Name: methyl (10E,12Z,15Z)-9-hydroxyoctadeca-10,12,15-trienoate

Description: The molecule is a fatty acid methyl ester isolated from leaves and twigs of Ehretia dicksonii. It exhibits anti-inflammatory and inhibition of lipoxygenase activities. It has a role as a metabolite, an anti-inflammatory agent and a lipoxygenase inhibitor.

SMILES: CC/C=C\C/C=C\C=C\C(O)CCCCCCCC(=O)OC

SELFIES: [C][C][/C][=C][\C][/C][=C][\C][=C][\C][Branch1][C][O][C][C][C][C][C][C][C][C][=Branch1][C][=O][O][C]

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+

Molecular Properties:
- Polar Surface Area: 46.5 Ų
- LogP: 5.0