TPCN03166
![[object Object]](../../static/browser_molecular_png/TPCN03166.png)
| Name | Puberunine |
| Molecular Formula | C23H35NO7 |
| Molecular Weight | 437.53 |
| CAS Registry Number | 1379670-69-5 |
| SMILES | CCN1CC2CC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C3C2=O)C14 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Aconitum barbatum | Roots | 0.000038% | Org Lett 14, 2758-2761 (2012). | 10.1021/ol3008217 |
Properties
| HBA | 8 | HBD | 3 |
| HeavyAtoms | 31 | AlogP | -0.57 |
| TPSA | 108.69 | RotatableBonds | 4 |
| FractionCSP3 | 0.96 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |