TPCN01936
![[object Object]](../../static/browser_molecular_png/TPCN01936.png)
| Name | 10,12-peroxycalamenene |
| Molecular Formula | C15H20O2 |
| Molecular Weight | 232.32 |
| CAS Registry Number | 168207-85-0 |
| SMILES | Cc1ccc2c(c1)C1CCC2(C)OOC1(C)C |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Cyperaceae | Cyperus rotundus | Subterraneous stems | 0.000045% | Phytochemistry 40(1): 125-128.(1995) | 10.1016/0031-9422(95)00260-e |
Properties
| HBA | 2 | HBD | 0 |
| HeavyAtoms | 17 | AlogP | 3.83 |
| TPSA | 18.46 | RotatableBonds | 0 |
| FractionCSP3 | 0.60 | Rings | 4 |
| AromaticRings | 1 | AliphaticRings | 3 |