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 | C21H34OSi |
| Molecular Weight | 330.58 g/mol |
| Exact Mass | 330.2379 Da |
| InChI |
InChI=1S/C21H34OSi/c1-10-12-18-16(3)14-15-19(18)17(4)20(13-11-2)22-23(8,9)21(5,6)7/h1,13,17,19-20H,2,12,14-15H2,3-9H3/t17-,19+,20-/m1/s1
|
| InChIKey |
SJMXTYMBAKCEPW-YZGWKJHDSA-N
|
| SMILES |
C#CCC1=C(C)CC[C@@]1([H])[C@@H](C)[C@@H](C=C=C)O[Si](C)(C)C(C)(C)C
|
| Number of Atoms | 57 |
| Number of H-Bond Acceptors | 1 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 3 |
| XLogP | 8.0 |
