TPCN02301
![[object Object]](../../static/browser_molecular_png/TPCN02301.png)
| Name | Ballonigrin |
| Molecular Formula | C20H24O4 |
| Molecular Weight | 328.41 |
| CAS Registry Number | 62340-62-9 |
| SMILES | CC1=C(CCc2ccoc2)C2(C)CCCC3(C)C(=O)OC(C1=O)C32 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lamiaceae | Ballota undulata | Aerial parts | 0.003000% | Magn Reson Chem 45, 899-901 (2007). | 10.1002/mrc.2050 |
Properties
| HBA | 4 | HBD | 0 |
| HeavyAtoms | 24 | AlogP | 3.85 |
| TPSA | 56.51 | RotatableBonds | 3 |
| FractionCSP3 | 0.60 | Rings | 4 |
| AromaticRings | 1 | AliphaticRings | 3 |