TPCN03679
| Name | Perennisaponins B |
| Molecular Formula | C71H112O31 |
| Molecular Weight | 1461.65 |
| CAS Registry Number | 1033766-70-9 |
| SMILES | CC(=O)OC1C(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(O)C(C)(CO)C6CCC5(C)C3(C)CC4O)OC(C)C(OC(=O)CC(C)OC(=O)CC(C)OC(=O)CC(C)OC(=O)CC(C)O)C2O)OC(C)C(OC2OCC(O)C(OC3OC(C)C(O)C(O)C3O)C2O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Bellis perennis | Flowers | 0.001220% | Chem Pharm Bull (Tokyo), 2008, 56, 559-568. | 10.1248/cpb.56.559 |
Properties
| HBA | 31 | HBD | 12 |
| HeavyAtoms | 102 | AlogP | 0.46 |
| TPSA | 465.17 | RotatableBonds | 22 |
| FractionCSP3 | 0.89 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |