CAS 807617-46-5 appears in our catalog under these names: C16-Sphingomyelin-d13, N-Palmitoyl-D-sphingomyelin-d31, 99%, 16:0-D31 sm. Offered by: TRC, MedChemExpress, Sigma-Aldrich. Available pack sizes: 50mg, 1 mg, 1MG, 5MG.
[(E,2S,3R)-2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-hentriacontadeuteriohexadecanoylamino)-3-hydroxyoctadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate (CAS 807617-46-5) is a chemical compound with the molecular formula C39H79N2O6P and a molecular weight of 734.2 g/mol. IUPAC name: [(E,2S,3R)-2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-hentriacontadeuteriohexadecanoylamino)-3-hydroxyoctadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate. InChIKey: RWKUXQNLWDTSLO-XDEXOTOPSA-N.
| Molecular formula | C39H79N2O6P |
|---|---|
| Molecular weight | 734.2 g/mol |
| IUPAC name | [(E,2S,3R)-2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-hentriacontadeuteriohexadecanoylamino)-3-hydroxyoctadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate |
| InChIKey | RWKUXQNLWDTSLO-XDEXOTOPSA-N |
| SMILES | [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)N[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)[C@@H](/C=C/CCCCCCCCCCCCC)O |
Computed by PubChem (NCBI)