TPCN04954
![[object Object]](../../static/browser_molecular_png/TPCN04954.png)
| Name | Lupanes 4 |
| Molecular Formula | C47H76O16 |
| Molecular Weight | 897.11 |
| CAS Registry Number | 848784-88-3 |
| SMILES | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(OC6OCC(O)C(O)C6OC6OC(C)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(C)(C)C5CCC43C)C12 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Pulsatilla koreana | Roots | 0.003720% | J Nat Prod 68, 268-272 (2005) | 10.1021/np049813h |
Properties
| HBA | 16 | HBD | 9 |
| HeavyAtoms | 63 | AlogP | 2.23 |
| TPSA | 254.52 | RotatableBonds | 9 |
| FractionCSP3 | 0.94 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |