TPCN02811
![[object Object]](../../static/browser_molecular_png/TPCN02811.png)
| Name | Ajugarins II |
| Molecular Formula | C22H32O6 |
| Molecular Weight | 392.49 |
| CAS Registry Number | 62640-06-6 |
| SMILES | CC1CC(O)C2(COC(=O)O)C(CCCC23CO3)C1(C)CCC1=CC(=O)CC1 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lamiaceae | Ajuga decumbens | Whole plants | 0.000250% | Nat Prod Res 28, 196-200 (2014). | 10.1080/14786419.2013.866114 |
Properties
| HBA | 6 | HBD | 2 |
| HeavyAtoms | 28 | AlogP | 3.71 |
| TPSA | 96.36 | RotatableBonds | 5 |
| FractionCSP3 | 0.82 | Rings | 4 |
| AromaticRings | 0 | AliphaticRings | 4 |