TPCN03707
![[object Object]](../../static/browser_molecular_png/TPCN03707.png)
| Name | Theasaponins E9 |
| Molecular Formula | C61H92O28 |
| Molecular Weight | 1273.38 |
| CAS Registry Number | 929877-74-7 |
| SMILES | CC=C(C)C(=O)OC1C(O)C2(COC(C)=O)C(OC(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=O)C5CCC43C)C2CC1(C)C |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apiaceae | Centella asiatica | Aerial parts | 0.001067% | Molecules, 2006, 11, 661-665. | 10.3390/11090661 |
Properties
| HBA | 28 | HBD | 12 |
| HeavyAtoms | 89 | AlogP | -1.44 |
| TPSA | 429.64 | RotatableBonds | 16 |
| FractionCSP3 | 0.85 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |