TPCN02417
![[object Object]](../../static/browser_molecular_png/TPCN02417.png)
| Name | Ajugacumbins B |
| Molecular Formula | C25H36O6 |
| Molecular Weight | 432.56 |
| CAS Registry Number | 124961-67-7 |
| SMILES | CC=C(C)C(=O)OCC12C(O)CC(C)C(C)(CCC3=CC(=O)OC3)C1CCCC21CO1 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lamiaceae | Ajuga decumbens | Whole plants | 0.001500% | Nat Prod Res 28, 196-200 (2014). | 10.1080/14786419.2013.866114 |
Properties
| HBA | 6 | HBD | 1 |
| HeavyAtoms | 31 | AlogP | 3.72 |
| TPSA | 85.36 | RotatableBonds | 6 |
| FractionCSP3 | 0.76 | Rings | 4 |
| AromaticRings | 0 | AliphaticRings | 4 |