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 | C15H22O3 |
| Molecular Weight | 250.33 g/mol |
| Exact Mass | 250.1569 Da |
| InChI |
InChI=1S/C15H22O3/c1-10-5-4-6-11(14(17)18-3)12-7-8-13(16)15(12,2)9-10/h5,11-12H,4,6-9H2,1-3H3/b10-5-/t11-,12+,15+/m0/s1
|
| InChIKey |
WKEQQQPTPXIXFJ-RPDWCJCGSA-N
|
| SMILES |
C/C/1=C/CC[C@@H]([C@@]2([H])CCC(=O)[C@]2(C)C1)C(=O)OC
|
| Number of Atoms | 40 |
| Number of H-Bond Acceptors | 3 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 3 |
| XLogP | 1.8 |