TPCN04888
![[object Object]](../../static/browser_molecular_png/TPCN04888.png)
| Name | 3-O-??-D-glucopyranosyl-(1 ?? 2)-??-D-glucopyranosyl hederagenin |
| Molecular Formula | C42H68O14 |
| Molecular Weight | 796.99 |
| CAS Registry Number | 73907-85-4 |
| SMILES | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Araliaceae | Hedera helix | Fruits | 0.012500% | Phytochemistry 53, 905-909 (2000). | 10.1016/s0031-9422(99)00503-8 |
Properties
| HBA | 14 | HBD | 9 |
| HeavyAtoms | 56 | AlogP | 1.85 |
| TPSA | 236.06 | RotatableBonds | 8 |
| FractionCSP3 | 0.93 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |