Publications [#232021] of David N. Beratan
Journal Articles
- Zuber, G; Goldsmith, M-R; Hopkins, TD; Beratan, DN; Wipf, P, "Systematic assignment of the configuration of flexible natural products by spectroscopic and computational methods: the bistramide C analysis.", Organic lettersNovember,, 2005, 7(23), 5269-5272 [16268555], [doi].
(last updated on 2024/04/19)Abstract:
[reaction: see text] The combination of NMR NOE, chemical shift, and J-coupling measurements with molar rotation and circular dichroism (CD) determinations, including RI-DFT BP86/aug-cc-pVDZ calculations, reduced a candidate pool of 1024 possible stereoisomers of (+)-bistramide C to a single absolute configuration assignment for the 10 stereogenic carbons of the marine natural product.