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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>17</sub>H<sub>21</sub>NO<sub>3</sub>

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Extracted from

Scheme 9

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₇H₂₁NO₃
Molecular Weight	287.35 g/mol
Exact Mass	287.1521 Da
InChI	InChI=1S/C17H21NO3/c1-16(2)11-20-17(3,21-12-16)9-15-18-14(10-19-15)13-7-5-4-6-8-13/h4-8,10H,9,11-12H2,1-3H3
InChIKey	FWAUFOFJRAPSHU-UHFFFAOYSA-N
SMILES	CC1(C)COC(C)(CC2=NC(=CO2)C3=CC=CC=C3)OC1
Number of Atoms	42
Number of H-Bond Acceptors	4
Number of H-Bond Donors	0
Atoms in the Largest π-System	11
XLogP	2.6

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