[(2R)-3-hexadecanoyloxy-2-(5-oxidanylidenepentanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(2R)-3-hexadecanoyloxy-2-(5-oxidanylidenepentanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(2R)-3-hexadecanoyloxy-2-(5-oxopentanoyloxy)propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2R)-2-(1,5-dioxopentoxy)-3-(1-oxohexadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2R)-3-hexadecanoyloxy-2-(5-oxopentanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(2R)-3-hexadecanoyloxy-2-(5-ketopentanoyloxy)propyl] 2-(trimethylammonio)ethyl phosphate Formula: C29H56NO9P MolecularWeight: 593.730001

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCC=O

InChI

InChI=1S/C29H56NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28(32)36-25-27(39-29(33)21-18-19-23-31)26-38-40(34,35)37-24-22-30(2,3)4/h23,27H,5-22,24-26H2,1-4H3/t27-/m1/s1