Molecule ID: 86289237

IUPAC Name: (3-hexadecoxy-2-oxopropyl) phosphate

Description: The molecule is a 1-alkylglycerone 3-phosphate(2-) obtained by deprotonation of the phosphate OH groups of 1-palmitylglycerone 3-phosphate; major species at pH 7.3. It is a conjugate base of a 1-palmitylglycerone 3-phosphate.

SMILES: CCCCCCCCCCCCCCCCOCC(=O)COP(=O)([O-])[O-]

SELFIES: [C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][O][C][C][=Branch1][C][=O][C][O][P][=Branch1][C][=O][Branch1][C][O-1][O-1]

InChI: InChI=1S/C19H39O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-19(20)18-25-26(21,22)23/h2-18H2,1H3,(H2,21,22,23)/p-2

Molecular Properties:
- Polar Surface Area: 98.7 Ų
- LogP: 5.7