[2-[(Z)-hexadec-9-enoyl]oxy-3-pentadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [2-[(Z)-hexadec-9-enoyl]oxy-3-pentadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-[(Z)-hexadec-9-enoyl]oxy-3-pentadecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-[(Z)-1-oxohexadec-9-enoxy]-3-(1-oxopentadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [2-[(Z)-hexadec-9-enoyl]oxy-3-pentadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-[(Z)-hexadec-9-enoyl]oxy-3-pentadecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C39H76NO8P MolecularWeight: 717.996401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C39H76NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40(3,4)5)35-45-38(41)31-29-27-25-23-21-19-17-15-13-11-9-7-2/h16,18,37H,6-15,17,19-36H2,1-5H3/b18-16-