TPCN03417
![[object Object]](../../static/browser_molecular_png/TPCN03417.png)
| Name | Cheodontoin I |
| Molecular Formula | C18H28O3 |
| Molecular Weight | 292.42 |
| CAS Registry Number | 2696330-30-8 |
| SMILES | C=C1CCC2C(C)(C(=O)O)CCCC2(C)C1CCC(C)=O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Lamiaceae | Chelonopsis odontochila | Aerial parts | 0.000026% | None | 10.1016/j.bioorg.2020.103571 |
Properties
| HBA | 3 | HBD | 1 |
| HeavyAtoms | 21 | AlogP | 4.22 |
| TPSA | 54.37 | RotatableBonds | 4 |
| FractionCSP3 | 0.78 | Rings | 2 |
| AromaticRings | 0 | AliphaticRings | 2 |