[(2R)-2-hexadecanoyloxy-3-[(Z)-hexadec-9-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(2R)-2-hexadecanoyloxy-3-[(Z)-hexadec-9-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(2R)-2-hexadecanoyloxy-3-[(Z)-hexadec-9-enoxy]propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2R)-3-[(Z)-hexadec-9-enoxy]-2-(1-oxohexadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2R)-2-hexadecanoyloxy-3-[(Z)-hexadec-9-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(2R)-2-hexadecanoyloxy-3-[(Z)-hexadec-9-enoxy]propyl] 2-(trimethylammonio)ethyl phosphate Formula: C40H80NO7P MolecularWeight: 718.039461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(COCCCCCCCCC=CCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCC/C=C\CCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C40H80NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-35-45-37-39(38-47-49(43,44)46-36-34-41(3,4)5)48-40(42)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h16,18,39H,6-15,17,19-38H2,1-5H3/b18-16-/t39-/m1/s1