TPCN05509
| Name | Silenorubicosides B |
| Molecular Formula | C76H116O40 |
| Molecular Weight | 1669.72 |
| CAS Registry Number | 857411-55-3 |
| SMILES | CC(=O)OCC1OC(OC2C(OC(C)=O)C(C)OC(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(OC7OC(C(=O)O)C(O)C(OC8OCC(O)C(O)C8O)C7OC7OC(CO)C(O)C(O)C7O)C(C)(C=O)C6CCC5(C)C3(C)CC4O)C2OC2OC(C)C(OC3OCC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1OC(C)=O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryophyllaceae | Silene rubicunda | Roots | 0.000350% | J Nat Prod. 2005. 68, 754-758. | 10.1021/np049586j. |
Properties
| HBA | 40 | HBD | 17 |
| HeavyAtoms | 116 | AlogP | -5.27 |
| TPSA | 603.24 | RotatableBonds | 21 |
| FractionCSP3 | 0.89 | Rings | 12 |
| AromaticRings | 0 | AliphaticRings | 12 |