TPCN02463
![[object Object]](../../static/browser_molecular_png/TPCN02463.png)
| Name | Isodonoiol |
| Molecular Formula | C22H30O7 |
| Molecular Weight | 406.48 |
| CAS Registry Number | 82460-75-1 |
| SMILES | C=C1C(=O)C23CC1CC(O)C2C1(COC(C)=O)C(CCC(C)(C)C1CO)OC3=O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lamiaceae | Isodon japonica | Leaves | 0.001112% | Nat Prod Res 27, 1388-1392 (2013). | 10.1080/14786419.2012.746339 |
Properties
| HBA | 7 | HBD | 2 |
| HeavyAtoms | 29 | AlogP | 1.40 |
| TPSA | 110.13 | RotatableBonds | 3 |
| FractionCSP3 | 0.77 | Rings | 4 |
| AromaticRings | 0 | AliphaticRings | 4 |