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Bufospirostenin A and Bufogargarizin C, Steroids with Rearranged Skeletons from the Toad Bufo bufo gargarizans.

Hai-Yan TianLi-Jun RuanTong YuQing-Fei ZhengNan-Hao ChenRui-Bo WuXiao-Qi ZhangLei WangRen-Wang JiangWen-Cai Ye
Published in: Journal of natural products (2017)
Bufospirostenin A (1) and bufogargarizin C (2), two novel steroids with rearranged A/B rings, were isolated from the toad Bufo bufo gargarizans. Compound 1 represents the first spirostanol found in animals. Compound 2 is an unusual bufadienolide with a cycloheptatriene B ring. Their structures were elucidated by spectroscopic analysis, single crystal X-ray diffraction analysis, and computational calculations.
Keyphrases
  • high resolution
  • molecular docking
  • density functional theory
  • mass spectrometry