TPCN05040
| Name | Caryocarosides III-16 |
| Molecular Formula | C65H106O34 |
| Molecular Weight | 1431.53 |
| CAS Registry Number | 905448-51-3 |
| SMILES | CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(OC7OC(COC8OC(CO)C(O)C(OC9OC(CO)C(O)C(OC%10OCC(O)C(O)C%10O)C9O)C8O)C(O)C(O)C7O)C6O)C(C)(CO)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryocaraceae | Caryocar villosum | Fruits | 0.001011% | J Nat Prod 69, 919-926 (2006) | 10.1021/np060097o |
Properties
| HBA | 34 | HBD | 21 |
| HeavyAtoms | 99 | AlogP | -7.80 |
| TPSA | 552.66 | RotatableBonds | 18 |
| FractionCSP3 | 0.95 | Rings | 11 |
| AromaticRings | 0 | AliphaticRings | 11 |