TPCN01578
![[object Object]](../../static/browser_molecular_png/TPCN01578.png)
| Name | 6 beta-(2'-methylbutanoyloxy)-3 beta-acetoxy-10 beta-hydroxyeremophil-7(11)-en-8 beta,12-olide |
| Molecular Formula | C22H32O7 |
| Molecular Weight | 408.49 |
| CAS Registry Number | 1132757-96-0 |
| SMILES | CCC(C)C(=O)OC1C2=C(C)C(=O)OC2CC2(O)CCC(OC(C)=O)C(C)C12C |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Ligularia hodgsonii | Whole plants | 0.000300% | Planta Med 75(6): 635-640.(2019) | 10.1055/s-0029-1185359 |
Properties
| HBA | 7 | HBD | 1 |
| HeavyAtoms | 29 | AlogP | 2.69 |
| TPSA | 99.13 | RotatableBonds | 4 |
| FractionCSP3 | 0.77 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |