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Structural Reassignment of Obtusallenes V, VI, and VII by GIAO-Based Density Functional Prediction

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    Structural Reassignment of Obtusallenes V, VI, and VII by GIAO-Based Density Functional Prediction
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    Department of Chemistry, Imperial College London, London SW7 2AZ, U.K.
    * Corresponding author. Tel: +44 207 5945771 . E-mail: [email protected].
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    Journal of Natural Products

    Cite this: J. Nat. Prod. 2008, 71, 4, 728–730
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    https://doi.org/10.1021/np0705918
    Published February 23, 2008
    Copyright © 2008 The American Chemical Society and American Society of Pharmacognosy
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    Abstract

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    Revised structures proposed previously for obtusallenes V−VII (5–7) have been confirmed on the basis of computed GIAO-DFT 13C NMR chemical shifts.

    Copyright © 2008 The American Chemical Society and American Society of Pharmacognosy

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    Excel spreadsheet for 5–7, cases (a)–(c). This material is available free of charge via the Internet at http://pubs.acs.org. For entries in the institutional digital repository, see WEO 1.

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    Journal of Natural Products

    Cite this: J. Nat. Prod. 2008, 71, 4, 728–730
    Click to copy citationCitation copied!
    https://doi.org/10.1021/np0705918
    Published February 23, 2008
    Copyright © 2008 The American Chemical Society and American Society of Pharmacognosy
    Request reuse permissions

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