TPCN04674
![[object Object]](../../static/browser_molecular_png/TPCN04674.png)
| Name | Saponin 2 |
| Molecular Formula | C52H84O21 |
| Molecular Weight | 1045.22 |
| CAS Registry Number | 914491-12-6 |
| SMILES | CC1OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(O)C(C)(O)C5CCC4(C)C2(C)CC3)C(OC2OC(C)C(OC3OCC(O)C(O)C3O)C(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryophyllaceae | Gypsophila oldhamiana | Roots | 0.000128% | Chem Pharm Bull (Tokyo) 54(8): 1200-1202. | 10.1248/cpb.54.1200 |
Properties
| HBA | 21 | HBD | 12 |
| HeavyAtoms | 73 | AlogP | -0.62 |
| TPSA | 333.67 | RotatableBonds | 9 |
| FractionCSP3 | 0.94 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |