TPCN03971
![[object Object]](../../static/browser_molecular_png/TPCN03971.png)
| Name | Assamsaponin E |
| Molecular Formula | C59H92O26 |
| Molecular Weight | 1217.36 |
| CAS Registry Number | 259748-74-8 |
| SMILES | CC=C(C)C(=O)OC1C(O)C2(COC(C)=O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OCC(O)C(O)C7OC7OCC(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2CC1(C)C |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Aquifoliaceae | Ilex cornuta | Roots | 0.000206% | Curr Med Sci 38, 976-981 (2018). | 10.1007/s11596-018-1972-4 |
Properties
| HBA | 26 | HBD | 13 |
| HeavyAtoms | 85 | AlogP | -1.19 |
| TPSA | 406.50 | RotatableBonds | 14 |
| FractionCSP3 | 0.88 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |