TPCN04827
![[object Object]](../../static/browser_molecular_png/TPCN04827.png)
| Name | 3-O-??-D-glucopyranosyl hederagenin 28-O-b-D-glucopyranosyl-(1 ?? 6)-??-D-glucopyranosyl ester |
| Molecular Formula | C48H78O19 |
| Molecular Weight | 959.13 |
| CAS Registry Number | 153118-55-9 |
| SMILES | CC1(C)CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Araliaceae | Hedera helix | Fruits | 0.066000% | Phytochemistry 53, 905-909 (2000). | 10.1016/s0031-9422(99)00503-8 |
Properties
| HBA | 19 | HBD | 12 |
| HeavyAtoms | 67 | AlogP | -0.89 |
| TPSA | 315.21 | RotatableBonds | 10 |
| FractionCSP3 | 0.94 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |