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 | C15H20O4 |
| Molecular Weight | 264.32 g/mol |
| Exact Mass | 264.1362 Da |
| InChI |
InChI=1S/C15H20O4/c1-13(2)7-8-10(16)14(3)6(19-14)4-5-15(8)9(7)11(13)18-12(15)17/h6-11,16H,4-5H2,1-3H3/t6-,7+,8-,9-,10-,11-,14-,15?/m0/s1
|
| InChIKey |
SYGYFGVFOCHMLI-DGORJZCJSA-N
|
| SMILES |
CC1(C)[C@]2([H])[C@@]3([H])[C@@H]([C@]4(C)[C@H](CCC35[C@]2([H])[C@]1([H])OC5=O)O4)O
|
| Number of Atoms | 39 |
| Number of H-Bond Acceptors | 4 |
| Number of H-Bond Donors | 1 |
| Atoms in the Largest π-System | 3 |
| XLogP | 0.8 |
