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 | C17H26O3 |
| Molecular Weight | 278.39 g/mol |
| Exact Mass | 278.1882 Da |
| InChI |
InChI=1S/C17H26O3/c1-6-7-8-13(16(19)20-5)14-9-10-15(18)17(14,4)11-12(2)3/h6,13-14H,1-2,7-11H2,3-5H3/t13-,14+,17+/m0/s1
|
| InChIKey |
MNFHKGDDUKMOBM-JJRVBVJISA-N
|
| SMILES |
C=CCC[C@@H]([C@@]1([H])CCC(=O)[C@]1(C)CC(=C)C)C(=O)OC
|
| Number of Atoms | 46 |
| Number of H-Bond Acceptors | 3 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 3 |
| XLogP | 3.0 |
