TPCN06256
![[object Object]](../../static/browser_molecular_png/TPCN06256.png)
| Name | Asprelloside F |
| Molecular Formula | C42H64O17S |
| Molecular Weight | 873.02 |
| CAS Registry Number | 2377393-63-8 |
| SMILES | CC1=C2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OS(=O)(=O)O)C6O)C(C)(C)C5CCC4(C)C3(C)CCC2(C(=O)OC2OC(CO)C(O)C(O)C2O)CCC1C |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Aquifoliaceae | Ilex asprella | Roots | 0.000108% | Chem Biodivers . 2019 Jul;16(7):e1900202 | 10.1002/cbdv.201900202 |
Properties
| HBA | 17 | HBD | 8 |
| HeavyAtoms | 60 | AlogP | 2.16 |
| TPSA | 276.27 | RotatableBonds | 8 |
| FractionCSP3 | 0.86 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |