Molecule ID: 49791756

IUPAC Name: (3-octadecoxy-2-oxopropyl) dihydrogen phosphate

Description: The molecule is a 1-alkylglycerone 3-phosphate in which the alkyl group is specified as octadecyl. It is a conjugate acid of a 1-octadecylglycerone 3-phosphate(2-).

SMILES: CCCCCCCCCCCCCCCCCCOCC(=O)COP(=O)(O)O

SELFIES: [C][C][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][O]

InChI: InChI=1S/C21H43O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26-19-21(22)20-27-28(23,24)25/h2-20H2,1H3,(H2,23,24,25)

Molecular Properties:
- Polar Surface Area: 93.1 Ų
- LogP: 6.9