TPCN04038
![[object Object]](../../static/browser_molecular_png/TPCN04038.png)
| Name | (20S)-niga-ichigoside F1 |
| Molecular Formula | C36H58O11 |
| Molecular Weight | 666.85 |
| CAS Registry Number | 871018-31-4 |
| SMILES | CC1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1(C)O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Aquifoliaceae | Ilex litseaefolia | Stems | 0.000123% | J Nat Prod 68, 1531-1535 (2005). | 10.1021/np050285z |
Properties
| HBA | 11 | HBD | 8 |
| HeavyAtoms | 47 | AlogP | 1.41 |
| TPSA | 197.37 | RotatableBonds | 4 |
| FractionCSP3 | 0.92 | Rings | 6 |
| AromaticRings | 0 | AliphaticRings | 6 |