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
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Chemical structure [C<sub>20</sub>H<sub>33</sub>]<sup>+</sup>

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Scheme 51

Chemical Information

Calculated using the Chemistry Development Kit 2.12
Molecular Formula [C20H33]+
Molecular Weight 273.48 g/mol
Exact Mass 273.2582 Da
InChI
InChI=1S/C20H33/c1-12(2)17-8-9-19(5)10-16-13(3)6-7-15(16)14(4)18-11-20(17,18)19/h12-13,15-18H,6-11H2,1-5H3/q+1/t13-,15+,16-,17-,18-,19-,20+/m1/s1
InChIKey
HHALDVRDFCDKQV-UOUQIJRISA-N
SMILES
CC(C)[C@H]1CC[C@]2(C)C[C@]3([H])[C@]([H])(C)CC[C@@]3([H])[C+](C)[C@H]4C[C@]142
Number of Atoms 53
Number of H-Bond Acceptors 0
Number of H-Bond Donors 0
Atoms in the Largest π-System 0
XLogP 9.8
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