[(2S)-2-acetyloxy-3-heptadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(2S)-2-acetyloxy-3-heptadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(2S)-2-acetoxy-3-heptadecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(2S)-2-acetyloxy-3-(1-oxoheptadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(2S)-2-acetyloxy-3-heptadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(2S)-2-acetoxy-3-heptadecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C27H54NO8P MolecularWeight: 551.693321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H54NO8P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27(30)33-23-26(36-25(2)29)24-35-37(31,32)34-22-21-28(3,4)5/h26H,6-24H2,1-5H3/t26-/m0/s1