TY  - JOUR
TI  - New pyrimidine-N-β-D-glucosides: synthesis, biological evaluation, and molecular docking investigations
AB  - In this study, syntheses of new pyrimidine-coupled N-β-glucosides and tetra-O-acetyl derivatives were carried out. All glycoconjugates were investigated in comparison with known chemotherapeutic agents in terms of their antimicrobial and anticancer functions and DNA/protein binding affinities. Spectral data showed that all glycoside derivatives were obtained by diastereoselectivity as β-anomers. Both tested groups exhibited strong antiproliferative activity (2.29–66.84 μg/mL), but some of them had sufficiently ideal % cytotoxicity values (10.01%–16.78%). And also all synthetic compounds exhibited remarkable antibacterial activity against human pathogenic bacteria. Binding of these compounds to CT-DNA resulted in significant changes in spectral properties, consistent with groove binding. Molecular docking studies of some compounds revealed that the docking score, complex energy, and MM-GBSA $ΔG_{Bind}$ energy values were consistent with the experimental results, which showed that the new compounds were potent chemotherapeutic agents. Overall bioactivity results suggest that these compounds may be candidates as new chemotherapeutic agents and deserve further pharmacological evaluation.
AU  - PEKER, KIVANC
AU  - Kahriman, Nuran
AU  - Serdaroğlu, Vildan
AU  - aydin, ali
AU  - TÜRKMENOĞLU, BURÇİN
AU  - Usta, Asu
AU  - YAYLI, Nurettin
DO  - 10.55730/1300-0527.3553
PY  - 2023
JO  - Turkish Journal of Chemistry
VL  - 47
IS  - 2
SN  - 1300-0527
SP  - 476
EP  - 494
DB  - TRDizin
UR  - http://search/yayin/detay/1180487
ER  -