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 | C32H46O4Si |
| Molecular Weight | 522.79 g/mol |
| Exact Mass | 522.3165 Da |
| InChI |
InChI=1S/C32H46O4Si/c1-8-29-31(6,23-34-24-33-7)19-20-32(29)25(2)21-26(36-32)22-35-37(30(3,4)5,27-15-11-9-12-16-27)28-17-13-10-14-18-28/h8-18,25-26,29H,1,19-24H2,2-7H3/t25-,26+,29+,31+,32-/m0/s1
|
| InChIKey |
PHOIWAGCAMHYBJ-KCNNOPKCSA-N
|
| SMILES |
C=C[C@]1([H])[C@](C)(CC[C@@]21[C@@H](C)C[C@H](CO[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)O2)COCOC
|
| Number of Atoms | 83 |
| Number of H-Bond Acceptors | 4 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 6 |
| XLogP | 5.9 |
