TPCN04697
![[object Object]](../../static/browser_molecular_png/TPCN04697.png)
| Name | Ilexsaponin F |
| Molecular Formula | C47H72O20 |
| Molecular Weight | 957.07 |
| CAS Registry Number | 1469715-57-8 |
| SMILES | CC1=C(CO)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(C)(C(=O)O)C5CCC43C)C12 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Aquifoliaceae | Ilex pubescens | Roots | 0.000100% | J Asian Nat Prod Res 14(12): 1169-1174. | 10.1080/10286020.2012.738674 |
Properties
| HBA | 20 | HBD | 12 |
| HeavyAtoms | 67 | AlogP | -1.26 |
| TPSA | 332.28 | RotatableBonds | 10 |
| FractionCSP3 | 0.87 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |