Structure, absolute configuration, and antidiarrheal activity of a thymol derivative from Ageratina cylindrica

J Nat Prod. 2014 Feb 28;77(2):358-63. doi: 10.1021/np400964w. Epub 2014 Feb 6.

Abstract

The leaves of Ageratina cylindrica afforded a thymol derivative that was characterized by physical and spectroscopical methods as (8S)-8,9-epoxy-6-hydroxy-l0-benzoyloxy-7-oxothymol isobutyrate (1). The absolute configuration of 1 was established as 8S by vibrational circular dichroism spectroscopy in combination with density functional theory calculations and by evaluation of the Flack and Hooft X-ray parameters. Compound 1 showed weak antiprotozoal activity against Entamoeba histolytica and Giardia lamblia trophozoites and a high inhibitory effect on hyperpropulsive movement of the small intestine in rats.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Ageratina / chemistry*
  • Animals
  • Antidiarrheals* / chemistry
  • Antidiarrheals* / isolation & purification
  • Antidiarrheals* / pharmacology
  • Antiprotozoal Agents* / chemistry
  • Antiprotozoal Agents* / isolation & purification
  • Antiprotozoal Agents* / pharmacology
  • Circular Dichroism
  • Entamoeba histolytica / drug effects
  • Giardia lamblia / drug effects
  • Intestine, Small / drug effects
  • Mexico
  • Molecular Structure
  • Peristalsis / drug effects
  • Plant Leaves / chemistry
  • Rats
  • Thymol* / analogs & derivatives
  • Thymol* / chemistry
  • Thymol* / isolation & purification
  • Thymol* / pharmacology
  • Trophozoites / drug effects

Substances

  • (8S)-8,9-epoxy-6-hydroxy-l0-benzoyloxy-7-oxothymol isobutyrate
  • Antidiarrheals
  • Antiprotozoal Agents
  • Thymol