نتایج جستجو برای: chemotypes
تعداد نتایج: 676 فیلتر نتایج به سال:
Hierarchical in silico screening protocols against the agonist bound acetylcholine binding protein (AChBP) crystal structure were efficient in identifying novel chemotypes for AChBP and the human α7 receptor. Two hit structures were cocrystallized with AChBP revealing intermolecular cation-π interactions with loop C but lacking intermolecular hydrogen bonding. The compounds act as competitive α...
HPLC, column and thin layer chromatography guided studies led to the isolation of seven different compounds in methanolic extracts of Podophyllum hexandrum. The isolated compounds were analyzed using LC-MS and High Performance Liquid Chromatography (HPLC) studies interfaced to mass spectroscopy. Isolated compounds were used successfully as chemical markers for the comparison of the twelve diffe...
A multidisciplinary project has led to the discovery of novel, structurally diverse, L-type calcium entry blockers (CEBs). The absolute configuration of a recently reported CEB has been determined by vibrational circular dichroism spectroscopy, to assign the stereospecificity of the ligand-channel interaction. Thereafter, a virtual screening procedure was performed with the aim of identifying n...
The aim of this study was to identify small molecule compounds that inhibit the kinase activity of the IGF1 receptor and represent novel chemical scaffolds, which can be potentially exploited to develop drug candidates that are superior to the existing experimental anti-IGF1R therapeuticals. To this end, targeted compound libraries were produced by virtual screening using molecular modeling and...
Six distinct chemotypes of the mediterranean 7’lzymus vulgaris L. are characterized by differences in the major monoterpenes produced. The nature of the monoterpenes is shown to be controlled by a series of loci. Each locus probably has a dominant and a recessive allele. Epistatic relationships between these loci are interpreted by assuming that terpenes are end products of branches from the sa...
The variability of the flavonoid content of two populations of Z. noltii from different geographical zones, i.e., the Bay of Arcachon and the Bay of Cadiz, was evaluated. Samples were collected in spring and autumn at the two sites, and extracts were prepared by maceration in water. The phenolic content was fully characterized using Nuclear Magnetic Resonance (NMR), UV and Liquid Chromatography...
The chemical structures of the glucans, galactoglucomannans and galactomannoglucans of two species of the Cladonia, section Cocciferae, Cladonia miniata and Cladonia salmonea, were determined and compared. alpha-D-Glucans of the nigeran type were isolated from both species, in common with all Cladonia spp., along with galactoglucomannans containing (1-->6)-linked main-chains of alpha-D-Manp uni...
We have obtained evidence for two structurally and antigenically different Saccharomyces cerevisiae cell wall mannans. One, which occurs widely and is found in S. cerevisiae strain 238C, is already known to be a neutral mannan which yields mannose, mannobiose, mannotriose, and mannotetraose on acetolysis of the (1 --> 6)-linked backbone. The other, which was found in S. cerevisiae brewer's stra...
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