Strategies to access the [5-8] bicyclic core encountered in the sesquiterpene, diterpene and sesterterpene series
Cécile Alleman, Charlène Gadais, Laurent Legentil and François-Hugues Porée
Beilstein J. Org. Chem. 2023, 19, 245–281.
https://doi.org/10.3762/bjoc.19.23
Chemical Information
Calculated using the Chemistry Development Kit 2.12
| Molecular Formula | C11H14O |
| Molecular Weight | 162.23 g/mol |
| Exact Mass | 162.1045 Da |
| InChI |
InChI=1S/C11H14O/c12-11-8-7-9-5-3-1-2-4-6-10(9)11/h2,4H,1,3,5-8H2/b4-2-
|
| InChIKey |
RSHGDTRYQPKOLJ-RQOWECAXSA-N
|
| SMILES |
C1/C=C\CC2=C(CC1)CCC2=O
|
| Number of Atoms | 26 |
| Number of H-Bond Acceptors | 1 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 4 |
| XLogP | 1.9 |