[(2R)-3-heptadecanoyloxy-2-tricosanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(2R)-3-heptadecanoyloxy-2-tricosanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(2R)-3-heptadecanoyloxy-2-tricosanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2R)-3-(1-oxoheptadecoxy)-2-(1-oxotricosoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2R)-3-heptadecanoyloxy-2-tricosanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(2R)-3-heptadecanoyloxy-2-tricosanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C48H96NO8P MolecularWeight: 846.251501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C48H96NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-31-33-35-37-39-41-48(51)57-46(45-56-58(52,53)55-43-42-49(3,4)5)44-54-47(50)40-38-36-34-32-30-28-21-19-17-15-13-11-9-7-2/h46H,6-45H2,1-5H3/t46-/m1/s1