TPCN01504
![[object Object]](../../static/browser_molecular_png/TPCN01504.png)
| Name | Vernonilides B |
| Molecular Formula | C21H24O7 |
| Molecular Weight | 388.42 |
| CAS Registry Number | 1954729-03-3 |
| SMILES | C=CC12COC(=O)C(=C)C1C1OC(=O)C(=C)C1C(OC(=O)C(=C)COCC)C2 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Malvaceae | Vernonia anthelmintica | Seeds | 0.000375% | Bioorg Med Chem Lett 26(15): 3608-3611.(2016) | 10.1016/j.bmcl.2016.06.009 |
Properties
| HBA | 7 | HBD | 0 |
| HeavyAtoms | 28 | AlogP | 1.89 |
| TPSA | 88.13 | RotatableBonds | 6 |
| FractionCSP3 | 0.48 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |