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/c1-7-9-13-19(6)14-12-17(15(3)4)18(19)11-10-16(5)8-2/h8,15-18H,2,10-14H2,1,3-6H3/t16-,17-,18+,19+/m1/s1
|
| InChIKey |
BSGTTWRTQBRPFV-YRXWBPOGSA-N
|
| SMILES |
CC#CC[C@@]1(C)CC[C@H](C(C)C)[C@]1([H])CC[C@H](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 | 2 |
| XLogP | 9.1 |
