Molecule ID: 5282944

IUPAC Name: (10E,12Z)-9-hydroxyoctadeca-10,12-dienoic acid

Description: The molecule is a HODE that consists of (10E,12Z)-octadecadienoic acid with the hydroxy substituent located at position 9. It has a role as a plant metabolite, a human metabolite and a mouse metabolite. It is a conjugate acid of a 9-HODE(1-).

SMILES: CCCCC/C=C\C=C\C(O)CCCCCCCC(=O)O

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]

InChI: InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+

Molecular Properties:
- Polar Surface Area: 57.5 Ų
- LogP: 5.3