TPCN03242
![[object Object]](../../static/browser_molecular_png/TPCN03242.png)
| Name | Grayanotoxins IV |
| Molecular Formula | C22H34O6 |
| Molecular Weight | 394.51 |
| CAS Registry Number | 30272-17-4 |
| SMILES | C=C1C2CCC3C(OC(C)=O)C2(CC(O)C2(O)C1CC(O)C2(C)C)CC3(C)O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ericaceae | Rhododendron micranthum | Leaves | 0.000011% | Phytochemistry 158, 1-12 (2019). | 10.1016/j.phytochem.2018.10.017 |
Properties
| HBA | 6 | HBD | 4 |
| HeavyAtoms | 28 | AlogP | 1.54 |
| TPSA | 107.22 | RotatableBonds | 1 |
| FractionCSP3 | 0.86 | Rings | 4 |
| AromaticRings | 0 | AliphaticRings | 4 |