Atropisomerism of a Podophyllotoxin Derivative: Experimental and Computational Study

作者:Zhou, Shi-Wen; Jiang, Fei; Yu, Yang; Huang, Xiu-Yong; Wang, Yong-Heng*; Luo, Shi-Lin*
来源:Natural Product Communications, 2018, 13(6): 735-736.
DOI:10.1177/1934578x1801300620

摘要

Diphyllin-7'-O-beta-D-glucoside, a podophyllotoxin derivative, was isolated from the roots of Dysosma versipellis. The H-1 and C-13 NMR spectra acquired at 300 K exhibited doubling of signals, suggesting the existence of two rotamers in solution. Variable-temperature H-1 NMR experiments indicated a dynamic exchange process between the two rotamers. DFT calculations verified nearly equal energies for the two rotamers about the single bond C7'-O7.

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