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 | C11H15F3O4S |
| Molecular Weight | 300.30 g/mol |
| Exact Mass | 300.0643 Da |
| InChI |
InChI=1S/C11H15F3O4S/c1-7(2)8-4-5-10(3,6-15)9(8)18-19(16,17)11(12,13)14/h6-7H,4-5H2,1-3H3/t10-/m1/s1
|
| InChIKey |
SQZHOHFZCWALMN-SNVBAGLBSA-N
|
| SMILES |
CC(C)C1=C([C@](C)(CC1)C([H])=O)OS(=O)(=O)C(F)(F)F
|
| Number of Atoms | 34 |
| Number of H-Bond Acceptors | 4 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 6 |
| XLogP | 2.0 |