Molecule ID: 5460991

IUPAC Name: (9E,11E,13E,15E)-octadeca-9,11,13,15-tetraenoate

Description: The molecule is a straight-chain, unsaturated fatty acid anion that is the conjugate base of trans-parinaric acid, arising from deprotonation of the carboxylic acid group. It is a long-chain fatty acid anion, a straight-chain fatty acid anion and a polyunsaturated fatty acid anion. It is a conjugate base of a trans-parinaric acid.

SMILES: CC/C=C/C=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][C][C][=Branch1][C][=O][O-1]

InChI: InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-10H,2,11-17H2,1H3,(H,19,20)/p-1/b4-3+,6-5+,8-7+,10-9+

Molecular Properties:
- Polar Surface Area: 40.1 Ų
- LogP: 6.6