TPCN05480
| Name | Clematomandshurica saponins K |
| Molecular Formula | C74H112O32 |
| Molecular Weight | 1513.68 |
| CAS Registry Number | 1609198-26-6 |
| SMILES | COc1ccc(C=CC(=O)OC2C(OC3COC(OC4C(O)C(C)OC(OC5C(OC6CCC7(C)C(CCC8(C)C7CC=C7C9CC(C)(C)CCC9(C(=O)O)CCC78C)C6(C)C)OCC(OC6OC(CO)C(O)C(O)C6O)C5O)C4O)C(O)C3O)OC(COC3OC(C)C(O)C(O)C3O)C(O)C2O)cc1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Clematis mandshurica | Roots | 0.000560% | Planta Med. 2013. 79, 987-994. | 10.1055/s-0032-1328657. |
Properties
| HBA | 32 | HBD | 16 |
| HeavyAtoms | 106 | AlogP | -0.51 |
| TPSA | 487.04 | RotatableBonds | 19 |
| FractionCSP3 | 0.84 | Rings | 12 |
| AromaticRings | 1 | AliphaticRings | 11 |