TPCN02937
![[object Object]](../../static/browser_molecular_png/TPCN02937.png)
| Name | Inflexarabdonin E |
| Molecular Formula | C22H30O6 |
| Molecular Weight | 390.48 |
| CAS Registry Number | 124960-77-6 |
| SMILES | C=C1C(=O)C23CC(=O)C4C(C)(C)C(OC(C)=O)CC(O)C4(C)C2C(O)CC1C3 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lamiaceae | Isodon excisus | Aerial parts | 0.000156% | Bioorg Med Chem Lett 21, 1279-1281 (2011). | 10.1016/j.bmcl.2010.11.095 |
Properties
| HBA | 6 | HBD | 2 |
| HeavyAtoms | 28 | AlogP | 1.82 |
| TPSA | 100.90 | RotatableBonds | 1 |
| FractionCSP3 | 0.77 | Rings | 4 |
| AromaticRings | 0 | AliphaticRings | 4 |