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C28 Terpenoids from Lamiaceous Plant Perovskia scrophulariifolia: Their Structures and Anti-neuroinflammatory Activity.

Naonobu TanakaKanji NiwaSeita KajiharaDaisuke TsujiKohji ItohNilufar Z MamadalievaYoshiki Kashiwada
Published in: Organic letters (2020)
Structurally unique C28 terpenoids, perovsfolins A (1) and B (2), were isolated from the aerial parts of an Uzbek medicinal plant, Perovskia scrophulariifolia (Lamiaceae). Their chemical structures including an unprecedented 6/8/6/6/6 pentacyclic carbon skeleton with a C6-C3 ester moiety were elucidated on the basis of spectroscopic analyses aided by density functional theory calculations as well as chemical evidence. Perovsfolin B (2) exhibited an anti-neuroinflammatory activity.
Keyphrases
  • density functional theory
  • molecular dynamics
  • molecular docking
  • plant growth
  • monte carlo