In Silico 3D/4D QSAR Prediction of 5-O-Caffeoylquinic Acid, Cyanidin-3-O-Galactoside Chloride and L-Epicatechin Anti-Inflammatory Activity, Cytotoxicity and Metabolism

In Silico 3D/4D QSAR Prediction of 5-O-Caffeoylquinic Acid, Cyanidin-3-O-Galactoside Chloride and L-Epicatechin Anti-Inflammatory Activity, Cytotoxicity and Metabolism

Background and objectives: Sambucus ebulus (SE) fruits are applied in folk medicine for the treatment of inflammatory gastrointestinal disorders and for immune stimulation in the autumn–winter period. LS-MS analysis has revealed that 5-O-Caffeoylquinic acid (Compound <b>1</b>, C<b>...

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Bibliographic Details
Main Authors: Yoana Kiselova-Kaneva, Irina Potoroko, Diana Ivanova
Format: Article
Language:English
Published: MDPI AG 2024-02-01
Series:Proceedings
Subjects:
Sambucus ebulus
polyphenols
in silico
QSAR
Online Access:https://www.mdpi.com/2504-3900/91/1/246
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