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 | C19H32 |
| Molecular Weight | 260.46 g/mol |
| Exact Mass | 260.2504 Da |
| InChI |
InChI=1S/C19H32/c1-13(2)16-11-15(5)7-8-18-17(14(3)4)9-10-19(18,6)12-16/h11,14-15,17-18H,1,7-10,12H2,2-6H3/b16-11+/t15-,17+,18-,19+/m0/s1
|
| InChIKey |
DJUQDIJTWAGXAE-YFYSVWDSSA-N
|
| SMILES |
C=C(C)/C/1=C/[C@@H](C)CC[C@@]2([H])[C@H](CC[C@]2(C)C1)C(C)C
|
| Number of Atoms | 51 |
| Number of H-Bond Acceptors | 0 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 4 |
| XLogP | 8.9 |
