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 | C32H50O3Si |
| Molecular Weight | 510.82 g/mol |
| Exact Mass | 510.3529 Da |
| InChI |
InChI=1S/C32H50O3Si/c1-23(2)27-17-18-32(7)20-30(35-36(8,9)31(4,5)6)28(19-24(3)33)26(15-16-29(27)32)22-34-21-25-13-11-10-12-14-25/h10-15,19,23,27,29-30H,16-18,20-22H2,1-9H3/b26-15-,28-19+/t27-,29+,30+,32-/m1/s1
|
| InChIKey |
ACRAOFFVVPUGKE-QDEMZVLNSA-N
|
| SMILES |
CC(C)[C@H]1CC[C@]2(C)C[C@@H](/C(=C/C(=O)C)/C(=C\C[C@@]12[H])/COCC3=CC=CC=C3)O[Si](C)(C)C(C)(C)C
|
| Number of Atoms | 86 |
| Number of H-Bond Acceptors | 3 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 6 |
| XLogP | 8.8 |
