Delphonine
6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,5,8-triol
Also Known As: Delphonine|Nordelphonine, N-methyl-|1,6,16-Trimethoxy-4-(methoxymethyl)-20-methylaconitane-8,13,14-triol (1alpha,6alpha,14alpha,16beta)-|1,6,16-Trimethoxy-4-(methoxymethyl)-20-methylaconitane-8,13,14-triol|Aconitane-8,13,14-triol, 1,6,16-trimethoxy-4-(methoxymethyl)-20-methyl-, (1alpha,6alpha,14alpha,16beta)-|Aconitane-8,13,14-triol, 1,6,16-trimethoxy-4-(methoxymethyl)-20-methyl-, (1.alpha.,6.alpha.,14.alpha.,16.beta.)-
| Molecular Formula | C24H39NO7 |
|---|---|
| Molecular Weight | 453.27264 g/mol |
| LogP | -0.1191 |
| Topological Polar Surface Area | 100.85 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.27264 |
| Monoisotopic Mass | 453.27264 |
| Heavy Atoms | 32 |
| Complexity | 798.3094 |
Chemical Identifiers
| CAS Number | 466-23-9 |
|---|---|
| SMILES | CN1CC2(CCC(C34C2C(C(C31)C5(CC(C6(CC4C5C6O)O)OC)O)OC)OC)COC |
Product Overview
Delphonine (CAS 466-23-9), with molecular formula C24H39NO7 and molecular weight 453.27264 g/mol. IUPAC: 6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,5,8-triol.