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 | C13H22O2 |
| Molecular Weight | 210.31 g/mol |
| Exact Mass | 210.1620 Da |
| InChI |
InChI=1S/C13H22O2/c1-8(2)12-10-6-9(14)4-5-13(10,3)7-11(12)15/h8,10-12,15H,4-7H2,1-3H3/t10-,11+,12+,13-/m1/s1
|
| InChIKey |
ZJTHUEKFROFQJT-MROQNXINSA-N
|
| SMILES |
CC(C)[C@H]1[C@@]2([H])CC(=O)CC[C@]2(C)C[C@@H]1O
|
| Number of Atoms | 37 |
| Number of H-Bond Acceptors | 2 |
| Number of H-Bond Donors | 1 |
| Atoms in the Largest π-System | 1 |
| XLogP | 2.3 |