Molecule ID: 86289259

IUPAC Name: (2-oxo-3-phosphonooxypropyl) (9Z,12Z)-octadeca-9,12-dienoate

Description: The molecule is a 1-acylglycerone 3-phosphate in which the acyl group is specified as linoleoyl. It derives from a linoleic acid. It is a conjugate acid of a 1-linoleoylglycerone 3-phosphate(2-).

SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(=O)COP(=O)(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][C][C][=Branch1][C][=O][C][O][P][=Branch1][C][=O][Branch1][C][O][O]

InChI: InChI=1S/C21H37O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)27-18-20(22)19-28-29(24,25)26/h6-7,9-10H,2-5,8,11-19H2,1H3,(H2,24,25,26)/b7-6-,10-9-

Molecular Properties:
- Polar Surface Area: 110.0 Ų
- LogP: 4.9