Natural Products Containing the Oxetane and Related Moieties Present Additional Challenges for Structure Elucidation: A DU8+ Computational Case Study
Author:
Affiliation:
1. Department of Chemistry and Biochemistry, University of Denver, Denver, Colorado 80208, United States
Funder
Division of Chemistry
Publisher
American Chemical Society (ACS)
Subject
Organic Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.joc.9b01005
Reference104 articles.
1. Search of the Dictionary of Natural Products (http://dnp.chemnetbase.com) revealed that the oxetane-containing natural products constitute less than 0.5% of NPs in the database.
2. Computational Prediction of 1H and 13C Chemical Shifts: A Useful Tool for Natural Product, Mechanistic, and Synthetic Organic Chemistry
3. See also Tantillo’s compilation of various computational approaches at http://cheshirenmr.info.
4. Assigning Stereochemistry to Single Diastereoisomers by GIAO NMR Calculation: The DP4 Probability
5. Beyond DP4: an Improved Probability for the Stereochemical Assignment of Isomeric Compounds using Quantum Chemical Calculations of NMR Shifts
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