TPCN02111
![[object Object]](../../static/browser_molecular_png/TPCN02111.png)
| Name | Angepubesin B |
| Molecular Formula | C15H22O4 |
| Molecular Weight | 266.34 |
| CAS Registry Number | 2758596-81-3 |
| SMILES | CC1=CC(=O)C2C(C1)OC1(CCC(C)(C)O1)C2(C)O |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apiaceae | Angelica pubescens | Roots | 0.000132% | Bioorganic Chemistry 107, (2021). | 10.1016/j.bioorg.2020.104604 |
Properties
| HBA | 4 | HBD | 1 |
| HeavyAtoms | 19 | AlogP | 1.96 |
| TPSA | 55.76 | RotatableBonds | 0 |
| FractionCSP3 | 0.80 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |