Molecule ID: 86289479

IUPAC Name: [(2R)-3-hexanoyloxy-2-hydroxypropyl] phosphate

Description: The molecule is a 1-acyl-sn-glycero-3-phosphate(2-) in which the acyl group is specified as caproyl (hexanoyl). It derives from a hexanoate. It is a conjugate base of a 1-hexanoyl-sn-glycero-3-phosphate.

SMILES: CCCCCC(=O)OC[C@@H](O)COP(=O)([O-])[O-]

SELFIES: [C][C][C][C][C][C][=Branch1][C][=O][O][C][C@@H1][Branch1][C][O][C][O][P][=Branch1][C][=O][Branch1][C][O-1][O-1]

InChI: InChI=1S/C9H19O7P/c1-2-3-4-5-9(11)15-6-8(10)7-16-17(12,13)14/h8,10H,2-7H2,1H3,(H2,12,13,14)/p-2/t8-/m1/s1

Molecular Properties:
- Polar Surface Area: 119.0 Ų
- LogP: -0.5