TPCN01942
![[object Object]](../../static/browser_molecular_png/TPCN01942.png)
| Name | Aggreganoids E |
| Molecular Formula | C31H34O5 |
| Molecular Weight | 486.61 |
| CAS Registry Number | 2369659-44-7 |
| SMILES | C=CC1(C)Cc2oc(Cc3oc4c(c3C)C(O)C3C(=C)C5CC5C3(C)C4)c(C)c2C2OC(=O)C(=C)C21 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Celastraceae | Lindera aggregata | Roots | 0.000043% | Org Lett 21(14): 5753-5756.(2019) | 10.1021/acs.orglett.9b02166 |
Properties
| HBA | 5 | HBD | 1 |
| HeavyAtoms | 36 | AlogP | 6.02 |
| TPSA | 72.81 | RotatableBonds | 3 |
| FractionCSP3 | 0.52 | Rings | 7 |
| AromaticRings | 2 | AliphaticRings | 5 |