(1S,5S)-4,6,6-Trimethylbicyclo[3.1.1]Hept-3-Ene
Representations & DB's id
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| ChEBI: | CHEBI:28660 | |
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| ChEMBL: | CHEMBL3109297 | |
| PubChem: | 440968 | |
| IUPAC: | (1S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-ene | |
| Standard InChI: | InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,9-/m0/s1 | |
| Standard InChI Key: | GRWFGVWFFZKLTI-IUCAKERBSA-N | |
| SMILES: | CC1=CC[C@H]2C[C@@H]1C2(C)C | |
Molecular propeties
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| AlogP: | 3 | |
|---|---|---|
| Hydrogen bonds acceptors: | 0 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 3 | |
| Molecular Weight: | 136.13 | |
| Topological polar surface area: | 0 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.8 | |
| Number of carbons: | 10 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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