2-[[(3R,4R,5R)-4-acetyloxy-5-heptadecyl-oxolan-3-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(3R,4R,5R)-4-acetyloxy-5-heptadecyl-oxolan-3-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(3R,4R,5R)-4-acetoxy-5-heptadecyl-tetrahydrofuran-3-yl]oxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[(3R,4R,5R)-4-acetyloxy-5-heptadecyl-3-oxolanyl]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(3R,4R,5R)-4-acetyloxy-5-heptadecyloxolan-3-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(3R,4R,5R)-4-acetoxy-5-heptadecyl-tetrahydrofuran-3-yl]oxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C28H57NO7P+ MolecularWeight: 550.728441

Click to see the large picture

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/p+1/t26-,27-,28-/m1/s1