TPCN04162
![[object Object]](../../static/browser_molecular_png/TPCN04162.png)
| Name | Asprellanosides D |
| Molecular Formula | C41H64O15S |
| Molecular Weight | 829.02 |
| CAS Registry Number | 1566520-75-9 |
| SMILES | CC1=C(C)C2C3=CCC4C5(C)CCC(OC6OCC(O)C(O)C6OS(=O)(=O)O)C(C)(C)C5CCC4(C)C3(C)CCC2(C(=O)OC2OC(CO)C(O)C(O)C2O)CC1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Aquifoliaceae | Ilex asprella | Roots | 0.000022% | J Asian Nat Prod Res 15, 453-458 (2013). | 10.1080/10286020.2013.783023 |
Properties
| HBA | 15 | HBD | 7 |
| HeavyAtoms | 57 | AlogP | 2.70 |
| TPSA | 238.97 | RotatableBonds | 7 |
| FractionCSP3 | 0.88 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |