TPCN01492
![[object Object]](../../static/browser_molecular_png/TPCN01492.png)
| Name | 8??-O-(4-acetoxy-5-hydroxyangeloyl)-11??,13-dihydrocnicin |
| Molecular Formula | C22H30O8 |
| Molecular Weight | 422.47 |
| CAS Registry Number | 1000370-43-3 |
| SMILES | CC(=O)OCC=C(CO)C(=O)OC1CC(C)=CCCC(CO)=CC2OC(=O)C(C)C21 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Centaurea pullata | Aerial parts | 0.000392% | J Nat Prod 70(11): 1796-1799.（2007） | 10.1021/np070125i |
Properties
| HBA | 8 | HBD | 2 |
| HeavyAtoms | 30 | AlogP | 1.61 |
| TPSA | 119.36 | RotatableBonds | 6 |
| FractionCSP3 | 0.59 | Rings | 2 |
| AromaticRings | 0 | AliphaticRings | 2 |