Molecule ID: 5312915

IUPAC Name: (9Z,11Z,13E,15E)-4-oxooctadeca-9,11,13,15-tetraenoic acid

Description: The molecule is a polyunsaturated fatty acid that is (9Z,11Z,13E,15E)-octadecatetraenoic acid carrying an oxo substituent at position 4. It has a role as a marine metabolite. It is an oxo fatty acid, a polyunsaturated fatty acid and a long-chain fatty acid.

SMILES: CC/C=C/C=C/C=C\C=C/CCCCC(=O)CCC(=O)O

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

InChI: InChI=1S/C18H26O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19)15-16-18(20)21/h3-10H,2,11-16H2,1H3,(H,20,21)/b4-3+,6-5+,8-7-,10-9-

Molecular Properties:
- Polar Surface Area: 54.4 Ų
- LogP: 3.9