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 | C16H24O2 |
| Molecular Weight | 248.36 g/mol |
| Exact Mass | 248.1776 Da |
| InChI |
InChI=1S/C16H24O2/c1-5-7-8-9-12-13-11(6-2)10-16(3,4)14(13)18-15(12)17/h5-6,11-14H,1-2,7-10H2,3-4H3/t11?,12-,13?,14?/m0/s1
|
| InChIKey |
KFYWBWMOGCDLAQ-UDXKHGJESA-N
|
| SMILES |
C=CCCC[C@H]1C2C(C=C)CC(C)(C)C2OC1=O
|
| Number of Atoms | 42 |
| Number of H-Bond Acceptors | 2 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 3 |
| XLogP | 4.6 |
