TPCN02664
![[object Object]](../../static/browser_molecular_png/TPCN02664.png)
| Name | Wedtrilosides B |
| Molecular Formula | C26H40O12S |
| Molecular Weight | 576.66 |
| CAS Registry Number | 2305740-66-1 |
| SMILES | CC1(C(=O)OC2OC(COS(=O)(=O)O)C(O)C(O)C2O)CCCC2(C)C3=CCC4CC3(CCC12)CC4(O)CO |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Wedelia trilobata | Leaves | 0.000425% | Bioorg Chem 85, 319-324 (2019). | 10.1016/j.bioorg.2019.01.010 |
Properties
| HBA | 12 | HBD | 6 |
| HeavyAtoms | 39 | AlogP | 0.21 |
| TPSA | 200.28 | RotatableBonds | 6 |
| FractionCSP3 | 0.88 | Rings | 5 |
| AromaticRings | 0 | AliphaticRings | 5 |