[(2R)-2-(4-azanylbutanoyloxy)-3-octadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(2R)-2-(4-azanylbutanoyloxy)-3-octadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(2R)-2-(4-aminobutanoyloxy)-3-octadecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2R)-2-(4-amino-1-oxobutoxy)-3-(1-oxooctadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2R)-2-(4-aminobutanoyloxy)-3-octadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(2R)-2-(4-aminobutanoyloxy)-3-stearoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C30H61N2O8P MolecularWeight: 608.787701

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCN

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCN

InChI

InChI=1S/C30H61N2O8P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-29(33)37-26-28(40-30(34)22-20-23-31)27-39-41(35,36)38-25-24-32(2,3)4/h28H,5-27,31H2,1-4H3/t28-/m1/s1