TPCN04923
![[object Object]](../../static/browser_molecular_png/TPCN04923.png)
| Name | Cephalaria saponin B |
| Molecular Formula | C52H84O21 |
| Molecular Weight | 1045.22 |
| CAS Registry Number | 165198-93-6 |
| SMILES | CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)OC6OC(CO)C(O)C(O)C6O)CCC45C)C3(C)CO)OCC(O)C2O)C(O)C(O)C1OC1OCC(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caprifoliaceae | Cephalaria transsylvanica | Flowers | 0.006200% | Phytochemistry 38, 1493-1495 (1995) | 10.1016/0031-9422(94)00789-v |
Properties
| HBA | 21 | HBD | 12 |
| HeavyAtoms | 73 | AlogP | -0.76 |
| TPSA | 333.67 | RotatableBonds | 10 |
| FractionCSP3 | 0.94 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |