TPCN02080
![[object Object]](../../static/browser_molecular_png/TPCN02080.png)
| Name | Illisimonin A |
| Molecular Formula | C15H20O6 |
| Molecular Weight | 296.32 |
| CAS Registry Number | 2162197-76-2 |
| SMILES | CC1(O)CCC23OC(=O)C4(O)C5(C)C(O)(CC124)OCC35C |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Illicium simonsii | Fruits | 0.000004% | Org Lett 19(22): 6160-6163.(2017) | 10.1021/acs.orglett.7b03050 |
Properties
| HBA | 6 | HBD | 3 |
| HeavyAtoms | 21 | AlogP | -0.31 |
| TPSA | 96.22 | RotatableBonds | 0 |
| FractionCSP3 | 0.93 | Rings | 5 |
| AromaticRings | 0 | AliphaticRings | 5 |