General Characteristics
| NatID | 1566 |
| Common Name | NatID_1566 |
| Molecular Formula | C10H16 |
| Chemical Class | Prenol lipids > Monoterpenoids |
| Molecular Weight | 136.125 g/mol |
| Other names | 80-56-8 |
Representations
| Smiles | CC1=CCC2CC1C2(C)C |
| Inchi | InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3 |
| Inchi Key | GRWFGVWFFZKLTI-UHFFFAOYSA-N |
| 3D Structure |
Calculated Properties
| clogP | 3.00 |
| TPSA | 0.00 |
| HBD | 0 |
| HBA | 0 |
| Rotatable Bonds | 0 |
| Aromatic Rings | 0 |
| Heavy Atoms | 10 |
| Aromatic Carbocycles | 0 |
| Aromatic Heterocycles | 0 |
| Number of NO | 0 |
Experiments
| EID | Source | Semisynthetic? | Confidence level | References |
|---|---|---|---|---|
| 10250 | Blepharocalyx salicifolius | No | Low | Talenti, E. C., Taher, H. A., & Ubiergo, G. O. (1984). Constituents of the Essential Oil of Blepharocalyx tweediei. Journal of Natural Products, 47(5), 905–906. https://doi.org/10.1021/np50035a036 |
| Bioassay ID | NPASS ID | Target | Activity type | Activity |
|---|---|---|---|---|
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