[(3R,4R,5R)-4-acetyloxy-5-heptadecyl-oxolan-3-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [(3R,4R,5R)-4-acetyloxy-5-heptadecyl-oxolan-3-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [(3R,4R,5R)-4-acetoxy-5-heptadecyl-tetrahydrofuran-3-yl] 2-(trimethylammonio)ethyl phosphate CAS Name: [(3R,4R,5R)-4-acetyloxy-5-heptadecyl-3-oxolanyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [(3R,4R,5R)-4-acetyloxy-5-heptadecyloxolan-3-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [(3R,4R,5R)-4-acetoxy-5-heptadecyl-tetrahydrofuran-3-yl] 2-(trimethylammonio)ethyl phosphate Formula: C28H56NO7P MolecularWeight: 549.720501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1C(C(CO1)OP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC[C@@H]1[C@H]([C@@H](CO1)OP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C

InChI

InChI=1S/C28H56NO7P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-28(35-25(2)30)27(24-33-26)36-37(31,32)34-23-22-29(3,4)5/h26-28H,6-24H2,1-5H3/t26-,27-,28-/m1/s1