TPCN05671
![[object Object]](../../static/browser_molecular_png/TPCN05671.png)
| Name | BeUidiastrosides C2;Bernardiosides C1 |
| Molecular Formula | C53H86O23 |
| Molecular Weight | 1091.25 |
| CAS Registry Number | 171746-12-6 |
| SMILES | CC1OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC4(C)C2(C)CC3O)C(OC2OC(C)C(OC3OCC(O)C(O)C3O)C(O)C2O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Bellis bernardii | Whole plants | 0.045500% | J Nat Prod. 1996 Oct;59(10):939-43. | 10.1021/np960400t. |
| Asteraceae | Aster bellidiastrum | Aerial parts | 0.003670% | Phytochemistry. 1995 Nov;40(5):1489-92. | 10.1016/0031-9422(95)00432-7. |
Properties
| HBA | 23 | HBD | 14 |
| HeavyAtoms | 76 | AlogP | -2.43 |
| TPSA | 374.13 | RotatableBonds | 10 |
| FractionCSP3 | 0.94 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |