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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>15</sub>H<sub>19</sub>IO<sub>3</sub>

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Extracted from

Scheme 50

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₅H₁₉IO₃
Molecular Weight	374.21 g/mol
Exact Mass	374.0379 Da
InChI	InChI=1S/C15H19IO3/c1-11(10-17)5-4-6-12-9-13(19-14(12)18)15(2,3)7-8-16/h5,7-10,13H,4,6H2,1-3H3/b8-7+,11-5+/t13-/m0/s1
InChIKey	MZHZXIZOORUAJF-JGHAMJDISA-N
SMILES	C/C(=C\CCC1=C[C@@H](C(C)(C)/C=C/I)OC1=O)/C=O
Number of Atoms	38
Number of H-Bond Acceptors	3
Number of H-Bond Donors	0
Atoms in the Largest π-System	5
XLogP	3.5

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