[2-[(Z)-octadec-9-enoyl]oxy-3-tetradecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [2-[(Z)-octadec-9-enoyl]oxy-3-tetradecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-[(Z)-octadec-9-enoyl]oxy-3-tetradecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-[(Z)-1-oxooctadec-9-enoxy]-3-(1-oxotetradecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [2-[(Z)-octadec-9-enoyl]oxy-3-tetradecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-[(Z)-octadec-9-enoyl]oxy-3-tetradecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C40H78NO8P MolecularWeight: 732.022981

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC

InChI

InChI=1S/C40H78NO8P/c1-6-8-10-12-14-16-18-19-20-21-23-25-27-29-31-33-40(43)49-38(37-48-50(44,45)47-35-34-41(3,4)5)36-46-39(42)32-30-28-26-24-22-17-15-13-11-9-7-2/h19-20,38H,6-18,21-37H2,1-5H3/b20-19-