TPCN00869
![[object Object]](../../static/browser_molecular_png/TPCN00869.png)
| Name | Kandavanolide |
| Molecular Formula | C17H20O5 |
| Molecular Weight | 304.34 |
| CAS Registry Number | 92484-33-8 |
| SMILES | C=C1CC(O)C2C(=C)C(=O)OC2C2C(=C)C(OC(C)=O)CC12 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Centaurea rhizantha | Whole plants | 0.023333% | Nat Prod Res 33(14): 2016-2023.(2019) | 10.1080/14786419.2018.1483926 |
| Asteraceae | Saussurea calcicola | Aerial parts | 0.000300% | Arch Pharm Res 28(10): 1142-1146.（2005） | 10.1007/bf02972976 |
Properties
| HBA | 5 | HBD | 1 |
| HeavyAtoms | 22 | AlogP | 1.53 |
| TPSA | 72.83 | RotatableBonds | 1 |
| FractionCSP3 | 0.53 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |