TPCN02045
![[object Object]](../../static/browser_molecular_png/TPCN02045.png)
| Name | Triptregeline J |
| Molecular Formula | C37H39NO10 |
| Molecular Weight | 657.72 |
| CAS Registry Number | 2197992-93-9 |
| SMILES | CC(=O)OC1CC(C)(O)C23OC(C)(C)C(CC(OC(=O)c4ccccc4)C2(C)C1OC(=O)c1ccccc1)C3OC(=O)c1cccnc1 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Celastraceae | Tripterygium regelii | Stems | 0.000010% | Fitoterapia 112: 1-8.(2016) | 10.1016/j.fitote.2016.04.016 |
Properties
| HBA | 11 | HBD | 1 |
| HeavyAtoms | 48 | AlogP | 4.72 |
| TPSA | 147.55 | RotatableBonds | 7 |
| FractionCSP3 | 0.43 | Rings | 6 |
| AromaticRings | 3 | AliphaticRings | 3 |