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The Correct Structure of Aquatolide—Experimental Validation of a Theoretically-Predicted Structural Revision

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Department of Chemistry, University of California, Davis, One Shields Avenue, Davis, California 95616, United States
Department of Chemistry, Wake Forest University, Winston-Salem, North Carolina 27109, United States
§ Biology Department, Balearic Islands University, Palma de Mallorca, Spain
Cite this: J. Am. Chem. Soc. 2012, 134, 45, 18550–18553
Publication Date (Web):October 29, 2012
https://doi.org/10.1021/ja3089394
Copyright © 2012 American Chemical Society
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Abstract

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Aquatolide has been reisolated from its natural source, and its structure has been revised on the basis of quantum-chemical NMR calculations, extensive experimental NMR analysis, and crystallography.

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