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 | C19H26O2 |
| Molecular Weight | 286.41 g/mol |
| Exact Mass | 286.1933 Da |
| InChI |
InChI=1S/C19H26O2/c1-10-5-6-12-11(2)7-17-18-14(8-13(10)12)16(20)9-15(18)19(3,4)21-17/h10,12-13,15,17H,2,5-9H2,1,3-4H3/t10-,12+,13+,15+,17+/m1/s1
|
| InChIKey |
ZRTJTZNEZIFPPJ-KBDDINLNSA-N
|
| SMILES |
C[C@@H]1CC[C@@]2([H])C(=C)C[C@@]3([H])C4=C(C[C@@]12[H])C(=O)C[C@]4([H])C(C)(C)O3
|
| Number of Atoms | 47 |
| Number of H-Bond Acceptors | 2 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 4 |
| XLogP | 3.2 |
