TPCN01429
![[object Object]](../../static/browser_molecular_png/TPCN01429.png)
| Name | Vernolide-B |
| Molecular Formula | C23H30O8 |
| Molecular Weight | 434.49 |
| CAS Registry Number | 618860-58-5 |
| SMILES | CC=C(C)C(=O)OC1CC(C)C2(OC)CCC(C)(C=C3OC(=O)C(COC(C)=O)=C31)O2 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Vernonia chinensis | Whole plants | 0.000480% | Planta Med 71(10): 949-954.（2005） | 10.1055/s-2005-871212 |
Properties
| HBA | 8 | HBD | 0 |
| HeavyAtoms | 31 | AlogP | 3.12 |
| TPSA | 97.36 | RotatableBonds | 5 |
| FractionCSP3 | 0.61 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |