[4-hexadecanoyloxy-2-(5-oxidanylidenepentanoyloxy)butyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [4-hexadecanoyloxy-2-(5-oxidanylidenepentanoyloxy)butyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [4-hexadecanoyloxy-2-(5-oxopentanoyloxy)butyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-(1,5-dioxopentoxy)-4-(1-oxohexadecoxy)butyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [4-hexadecanoyloxy-2-(5-oxopentanoyloxy)butyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [4-hexadecanoyloxy-2-(5-ketopentanoyloxy)butyl] 2-(trimethylammonio)ethyl phosphate Formula: C30H58NO9P MolecularWeight: 607.756581

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H58NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20-29(33)37-25-22-28(40-30(34)21-18-19-24-32)27-39-41(35,36)38-26-23-31(2,3)4/h24,28H,5-23,25-27H2,1-4H3