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 C7H8O4
Molecular Weight 156.14 g/mol
Exact Mass 156.0423 Da
InChI
InChI=1S/C7H8O4/c1-5(8)11-7-3-2-6(9)4-10-7/h2-3,7H,4H2,1H3/t7-/m1/s1
InChIKey
JJVMFCRCFSJODB-SSDOTTSWSA-N
SMILES
CC(=O)O[C@@H]1C=CC(=O)CO1
Number of Atoms 19
Number of H-Bond Acceptors 4
Number of H-Bond Donors 0
Atoms in the Largest π-System 4
XLogP 0.0
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