TPCN01261
![[object Object]](../../static/browser_molecular_png/TPCN01261.png)
| Name | Gracilone |
| Molecular Formula | C15H22O3 |
| Molecular Weight | 250.34 |
| CAS Registry Number | 1900726-69-3 |
| SMILES | C=C1C(=O)OC2CC(C)CC(=O)CC(C)CCC12 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Tanacetum gracile | Whole plants | 0.001053% | Nat Prod Res 30, 2291-2298(2016) | 10.1080/14786419.2016.1164701 |
Properties
| HBA | 3 | HBD | 0 |
| HeavyAtoms | 18 | AlogP | 2.89 |
| TPSA | 43.37 | RotatableBonds | 0 |
| FractionCSP3 | 0.73 | Rings | 2 |
| AromaticRings | 0 | AliphaticRings | 2 |