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 | C17H30O |
| Molecular Weight | 250.42 g/mol |
| Exact Mass | 250.2297 Da |
| InChI |
InChI=1S/C17H30O/c1-7-9-16(5,6)12-15-14(4)8-10-17(15,18)11-13(2)3/h7,14-15,18H,1-2,8-12H2,3-6H3/t14-,15+,17+/m1/s1
|
| InChIKey |
GIIAPBWSGDMVLN-VYDXJSESSA-N
|
| SMILES |
C=CCC(C)(C)C[C@H]1[C@H](C)CC[C@@]1(CC(=C)C)O
|
| Number of Atoms | 48 |
| Number of H-Bond Acceptors | 1 |
| Number of H-Bond Donors | 1 |
| Atoms in the Largest π-System | 1 |
| XLogP | 5.6 |
