(2-docosanoyloxy-3-oxidanyl-propyl) 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: (2-docosanoyloxy-3-oxidanyl-propyl) 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: (2-docosanoyloxy-3-hydroxy-propyl) 2-(trimethylammonio)ethyl phosphate CAS Name: [3-hydroxy-2-(1-oxodocosoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: (2-docosanoyloxy-3-hydroxypropyl) 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: (2-docosanoyloxy-3-hydroxy-propyl) 2-(trimethylammonio)ethyl phosphate Formula: C30H62NO7P MolecularWeight: 579.789541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(CO)COP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(CO)COP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C30H62NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-30(33)38-29(27-32)28-37-39(34,35)36-26-25-31(2,3)4/h29,32H,5-28H2,1-4H3