TPCN04136
![[object Object]](../../static/browser_molecular_png/TPCN04136.png)
| Name | Asprellanosides E |
| Molecular Formula | C35H54O10S |
| Molecular Weight | 666.87 |
| CAS Registry Number | 1566520-76-0 |
| 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)O)CC1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Aquifoliaceae | Ilex asprella | Roots | 0.000040% | J Asian Nat Prod Res 15, 453-458 (2013). | 10.1080/10286020.2013.783023 |
Properties
| HBA | 10 | HBD | 4 |
| HeavyAtoms | 46 | AlogP | 5.44 |
| TPSA | 159.82 | RotatableBonds | 5 |
| FractionCSP3 | 0.86 | Rings | 6 |
| AromaticRings | 0 | AliphaticRings | 6 |