TPCN02148
![[object Object]](../../static/browser_molecular_png/TPCN02148.png)
| Name | Scaberlactone A |
| Molecular Formula | C19H22O6 |
| Molecular Weight | 346.38 |
| CAS Registry Number | 2738378-27-1 |
| SMILES | C=C(C)C(=O)OC1CC2=CC(CC(C)=CC3OC(=O)C(C)C31)OC2=O |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Elephantopus scaber | Whole plants | 0.000017% | Bioorganic Chemistry 104, (2020). | 10.1016/j.bioorg.2020.104314 |
Properties
| HBA | 6 | HBD | 0 |
| HeavyAtoms | 25 | AlogP | 2.24 |
| TPSA | 78.90 | RotatableBonds | 2 |
| FractionCSP3 | 0.53 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |