TPCN04768
![[object Object]](../../static/browser_molecular_png/TPCN04768.png)
| Name | Saponin 2 |
| Molecular Formula | C56H90O25 |
| Molecular Weight | 1163.31 |
| CAS Registry Number | 1028100-29-9 |
| SMILES | CC1OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(O)C(C)(O)C5CCC4(C)C2(C)CC3O)C(OC2OC(C)C(OC3OCC(O)C(OC4OCC(OC5OCC(O)C(O)C5O)C(O)C4O)C3O)C(O)C2O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryophyllaceae | Gypsophila oldhamiana | Roots | 0.000033% | Bioorg Med Chem 16(6): 2912-2920. | 10.1016/j.bmc.2007.12.053 |
Properties
| HBA | 25 | HBD | 14 |
| HeavyAtoms | 81 | AlogP | -2.54 |
| TPSA | 392.59 | RotatableBonds | 10 |
| FractionCSP3 | 0.95 | Rings | 10 |
| AromaticRings | 0 | AliphaticRings | 10 |