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 | C18H28O2 |
| Molecular Weight | 276.41 g/mol |
| Exact Mass | 276.2089 Da |
| InChI |
InChI=1S/C18H28O2/c1-11(2)15-5-6-17(3)16-10-13(19)8-12(16)9-14-4-7-18(15,17)20-14/h11-12,14-16H,4-10H2,1-3H3/t12-,14?,15+,16-,17+,18?/m1/s1
|
| InChIKey |
VOOANMMMHTXHQS-GJATXHONSA-N
|
| SMILES |
CC(C)[C@@H]1CC[C@@]2(C)[C@]3([H])CC(=O)C[C@]3([H])CC4CCC12O4
|
| Number of Atoms | 48 |
| Number of H-Bond Acceptors | 2 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 1 |
| XLogP | 3.5 |
