TPCN02874
![[object Object]](../../static/browser_molecular_png/TPCN02874.png)
| Name | Triptoquinone A |
| Molecular Formula | C20H24O4 |
| Molecular Weight | 328.41 |
| CAS Registry Number | 142950-86-5 |
| SMILES | CC1=C(C(=O)O)CCC2(C)C3=C(CCC12)C(=O)C(C(C)C)=CC3=O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Celastraceae | Tripterygium regelii | Roots | 0.000189% | Nat Prod Res 32, 2418-2423 (2018). | 10.1080/14786419.2017.1416379 |
Properties
| HBA | 4 | HBD | 1 |
| HeavyAtoms | 24 | AlogP | 3.63 |
| TPSA | 71.44 | RotatableBonds | 2 |
| FractionCSP3 | 0.55 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |