trimethyl-[6-[[(2S)-1-octadecoxy-3-oxidanyl-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyhexyl]azanium

Systemtic Name: trimethyl-[6-[[(2S)-1-octadecoxy-3-oxidanyl-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyhexyl]azanium Openeye Name: 6-[hydroxy-[(1S)-1-(hydroxymethyl)-2-octadecoxy-ethoxy]phosphoryl]oxyhexyl-trimethyl-ammonium CAS Name: 6-[hydroxy-[(2S)-1-hydroxy-3-octadecoxypropan-2-yl]oxyphosphoryl]oxyhexyl-trimethylammonium IUPAC Name: 6-[hydroxy-[(2S)-1-hydroxy-3-octadecoxypropan-2-yl]oxyphosphoryl]oxyhexyl-trimethylazanium Traditional Name: 6-[hydroxy-[(1S)-1-methylol-2-stearyloxy-ethoxy]phosphoryl]oxyhexyl-trimethyl-ammonium Formula: C30H65NO6P+ MolecularWeight: 566.813961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CO)OP(=O)(O)OCCCCCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC[C@H](CO)OP(=O)(O)OCCCCCC[N+](C)(C)C

InChI

InChI=1S/C30H64NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23-26-35-29-30(28-32)37-38(33,34)36-27-24-21-19-22-25-31(2,3)4/h30,32H,5-29H2,1-4H3/p+1/t30-/m0/s1