TPCN03779
![[object Object]](../../static/browser_molecular_png/TPCN03779.png)
| Name | Eesculiosides Ie |
| Molecular Formula | C41H66O16 |
| Molecular Weight | 814.96 |
| CAS Registry Number | 886840-37-5 |
| SMILES | CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OC(CO)C(O)C7O)C6O)C(C)(CO)C5CCC4(C)C3(C)CC(O)C2(CO)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Biebersteiniaceae | Aesculus pavia | Fruits | 0.000714% | Phytochemistry 67, 784-794 (2006). | 10.1016/j.phytochem.2006.01.017 |
Properties
| HBA | 16 | HBD | 11 |
| HeavyAtoms | 57 | AlogP | -0.59 |
| TPSA | 276.52 | RotatableBonds | 8 |
| FractionCSP3 | 0.93 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |