TPCN04947
![[object Object]](../../static/browser_molecular_png/TPCN04947.png)
| Name | Caryocaroside III-3 |
| Molecular Formula | C48H78O20 |
| Molecular Weight | 975.13 |
| CAS Registry Number | 880493-67-4 |
| SMILES | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C6O)C(C)(CO)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryocaraceae | Caryocar glabrum | Fruits | 0.004202% | J Nat Prod 69, 196-205 (2006) | 10.1021/np050336s |
Properties
| HBA | 20 | HBD | 13 |
| HeavyAtoms | 68 | AlogP | -1.35 |
| TPSA | 335.44 | RotatableBonds | 11 |
| FractionCSP3 | 0.94 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |