TPCN05057
![[object Object]](../../static/browser_molecular_png/TPCN05057.png)
| Name | Caryocaroside IV-21 |
| Molecular Formula | C65H104O34 |
| Molecular Weight | 1429.51 |
| CAS Registry Number | 905448-59-1 |
| SMILES | CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(C(=O)O)C(O)C(OC7OC(CO)C(OC8OC(CO)C(O)C(OC9OC(CO)C(O)C(OC%10OCC(O)C(O)C%10O)C9O)C8O)C(O)C7O)C6O)C(C)(C)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryocaraceae | Caryocar villosum | Fruits | 0.000787% | J Nat Prod 69, 919-926 (2006) | 10.1021/np060097o |
Properties
| HBA | 34 | HBD | 20 |
| HeavyAtoms | 99 | AlogP | -6.68 |
| TPSA | 549.50 | RotatableBonds | 17 |
| FractionCSP3 | 0.94 | Rings | 11 |
| AromaticRings | 0 | AliphaticRings | 11 |