Synthesis, α-glucosidase inhibition and molecular docking study of coumarin based derivatives

Synthesis, α-glucosidase inhibition and molecular docking study of coumarin based derivatives

We have synthesized seventeen Coumarin based derivatives (1–17), characterized by 1HNMR, 13CNMR and EI-MS and evaluated for α-glucosidase inhibitory potential. Among the series, all derivatives exhibited outstanding α-glucosidase inhibition with IC50 values ranging between 1.10 ± 0.01 and 36.46 ± 0....

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Published in:Bioorganic Chemistry
Main Author: Taha M.; Shah S.A.A.; Afifi M.; Imran S.; Sultan S.; Rahim F.; Khan K.M.
Format: Article
Language:English
Published: Academic Press Inc. 2018
Online Access:https://www.scopus.com/inward/record.uri?eid=2-s2.0-85042298379&doi=10.1016%2fj.bioorg.2018.01.033&partnerID=40&md5=5c35beb970165c041387e80b318fdd17
id 2-s2.0-85042298379
spelling 2-s2.0-85042298379
Taha M.; Shah S.A.A.; Afifi M.; Imran S.; Sultan S.; Rahim F.; Khan K.M.
Synthesis, α-glucosidase inhibition and molecular docking study of coumarin based derivatives
2018
Bioorganic Chemistry
77

10.1016/j.bioorg.2018.01.033
https://www.scopus.com/inward/record.uri?eid=2-s2.0-85042298379&doi=10.1016%2fj.bioorg.2018.01.033&partnerID=40&md5=5c35beb970165c041387e80b318fdd17
We have synthesized seventeen Coumarin based derivatives (1–17), characterized by 1HNMR, 13CNMR and EI-MS and evaluated for α-glucosidase inhibitory potential. Among the series, all derivatives exhibited outstanding α-glucosidase inhibition with IC50 values ranging between 1.10 ± 0.01 and 36.46 ± 0.70 μM when compared with the standard inhibitor acarbose having IC50 value 39.45 ± 0.10 μM. The most potent derivative among the series is derivative 3 having IC50 value 1.10 ± 0.01 μM, which are many folds better than the standard acarbose. The structure activity relationship (SAR) was mainly based upon by bring about difference of substituent's on phenyl part. Molecular docking studies were carried out to understand the binding interaction of the most active compounds. © 2018 Elsevier Inc.
Academic Press Inc.
452068
English
Article
author Taha M.; Shah S.A.A.; Afifi M.; Imran S.; Sultan S.; Rahim F.; Khan K.M.
spellingShingle Taha M.; Shah S.A.A.; Afifi M.; Imran S.; Sultan S.; Rahim F.; Khan K.M.
Synthesis, α-glucosidase inhibition and molecular docking study of coumarin based derivatives
author_facet Taha M.; Shah S.A.A.; Afifi M.; Imran S.; Sultan S.; Rahim F.; Khan K.M.
author_sort Taha M.; Shah S.A.A.; Afifi M.; Imran S.; Sultan S.; Rahim F.; Khan K.M.
title Synthesis, α-glucosidase inhibition and molecular docking study of coumarin based derivatives
title_short Synthesis, α-glucosidase inhibition and molecular docking study of coumarin based derivatives
title_full Synthesis, α-glucosidase inhibition and molecular docking study of coumarin based derivatives
title_fullStr Synthesis, α-glucosidase inhibition and molecular docking study of coumarin based derivatives
title_full_unstemmed Synthesis, α-glucosidase inhibition and molecular docking study of coumarin based derivatives
title_sort Synthesis, α-glucosidase inhibition and molecular docking study of coumarin based derivatives
publishDate 2018
container_title Bioorganic Chemistry
container_volume 77
container_issue
doi_str_mv 10.1016/j.bioorg.2018.01.033
url https://www.scopus.com/inward/record.uri?eid=2-s2.0-85042298379&doi=10.1016%2fj.bioorg.2018.01.033&partnerID=40&md5=5c35beb970165c041387e80b318fdd17
description We have synthesized seventeen Coumarin based derivatives (1–17), characterized by 1HNMR, 13CNMR and EI-MS and evaluated for α-glucosidase inhibitory potential. Among the series, all derivatives exhibited outstanding α-glucosidase inhibition with IC50 values ranging between 1.10 ± 0.01 and 36.46 ± 0.70 μM when compared with the standard inhibitor acarbose having IC50 value 39.45 ± 0.10 μM. The most potent derivative among the series is derivative 3 having IC50 value 1.10 ± 0.01 μM, which are many folds better than the standard acarbose. The structure activity relationship (SAR) was mainly based upon by bring about difference of substituent's on phenyl part. Molecular docking studies were carried out to understand the binding interaction of the most active compounds. © 2018 Elsevier Inc.
publisher Academic Press Inc.
issn 452068
language English
format Article
accesstype
record_format scopus
collection Scopus
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