TPCN01915
![[object Object]](../../static/browser_molecular_png/TPCN01915.png)
| Name | Isoalloalantolactone |
| Molecular Formula | C15H20O2 |
| Molecular Weight | 232.32 |
| CAS Registry Number | 64395-76-2 |
| SMILES | C=C1C(=O)OC2CC3(C)CCC=C(C)C3CC12 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Ratibida mexicana | Roots | 0.000053% | Phytochemistry 40(2): 419-425.(1995) | 10.1016/0031-9422(95)00257-8 |
Properties
| HBA | 2 | HBD | 0 |
| HeavyAtoms | 17 | AlogP | 3.24 |
| TPSA | 26.30 | RotatableBonds | 0 |
| FractionCSP3 | 0.67 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |