Molecule ID: 5312427

IUPAC Name: (9Z,12Z)-hexadeca-9,12-dienoic acid

Description: The molecule is a hexadecadienoic acid in which the two double bonds are located at positions 9 and 12 (the 9Z,12Z-isomer). It has a role as a plant metabolite. It is a conjugate acid of a (9Z,12Z)-hexadecadienoate.

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

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

InChI: InChI=1S/C16H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h4-5,7-8H,2-3,6,9-15H2,1H3,(H,17,18)/b5-4-,8-7-

Molecular Properties:
- Polar Surface Area: 37.3 Ų
- LogP: 5.5