TPCN05679
![[object Object]](../../static/browser_molecular_png/TPCN05679.png)
| Name | Bellissaponin BA1 |
| Molecular Formula | C63H100O27 |
| Molecular Weight | 1289.47 |
| CAS Registry Number | 137853-61-3 |
| SMILES | CC=CC(=O)OC1C(C)OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CC(O)C(OC6OC(C)C(O)C(O)C6O)C(C)(CO)C5CCC4(C)C2(C)CC3O)C(OC2OC(C)C(OC3OCC(O)C(OC4OC(C)C(O)C(O)C4O)C3O)C(O)C2O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Bellis sylvestris | Roots | 0.017647% | J Nat Prod. 1996 Apr;59(4):355-9. | 10.1021/np9600715. |
Properties
| HBA | 27 | HBD | 14 |
| HeavyAtoms | 90 | AlogP | -1.42 |
| TPSA | 418.89 | RotatableBonds | 13 |
| FractionCSP3 | 0.90 | Rings | 10 |
| AromaticRings | 0 | AliphaticRings | 10 |