Biological Activity of Selected Compounds from Annona muricata Seed as Antibreast Cancer Agents: Theoretical Study
Joint Authors
Oyebamiji, Abel Kolawole
Tolufashe, Gideon Femi
Oyawoye, Olubukola Monisola
Oyedepo, Temitope A.
Semire, Banjo
Source
Issue
Vol. 2020, Issue 2020 (31 Dec. 2020), pp.1-10, 10 p.
Publisher
Hindawi Publishing Corporation
Publication Date
2020-11-09
Country of Publication
Egypt
No. of Pages
10
Main Subjects
Abstract EN
Several natural products have been of help to humans, and its effect is noticeable in the medicinal world.
Soursop with botanical name Annona muricata L.
possesses antidiarrhea, anticold fever, antirheumatism, and antineuralgia properties.
In this work, five selected molecular compounds were studied against type 3 of 3α-hydroxysteroid dehydrogenase (3α-HSD).
Its anticancer activity was investigated using the quantum chemical method via Spartan 14 software, molecular docking via Discovery studio 2017, AutoDock Tool 1.5.6, AutoDock Vina 1.1.2, and PyMol 1.7.4.4 and the molecular dynamic simulation method via AMBER14 molecular dynamics package.
Many descriptors (EHOMO, ELUMO, dipole moment, energy bandgap, area, volume, polarizability, polar surface area, Log P, hydrogen bond donor, and hydrogen bond acceptor) which describe the anticancer activity of the studied compounds were obtained.
Also, the docking study revealed the inhibiting ability of the studied compound, and it was observed that compound C possesses a greater ability to inhibit than other studied compounds as well as the standard (5FU).
American Psychological Association (APA)
Oyebamiji, Abel Kolawole& Tolufashe, Gideon Femi& Oyawoye, Olubukola Monisola& Oyedepo, Temitope A.& Semire, Banjo. 2020. Biological Activity of Selected Compounds from Annona muricata Seed as Antibreast Cancer Agents: Theoretical Study. Journal of Chemistry،Vol. 2020, no. 2020, pp.1-10.
https://search.emarefa.net/detail/BIM-1182077
Modern Language Association (MLA)
Oyebamiji, Abel Kolawole…[et al.]. Biological Activity of Selected Compounds from Annona muricata Seed as Antibreast Cancer Agents: Theoretical Study. Journal of Chemistry No. 2020 (2020), pp.1-10.
https://search.emarefa.net/detail/BIM-1182077
American Medical Association (AMA)
Oyebamiji, Abel Kolawole& Tolufashe, Gideon Femi& Oyawoye, Olubukola Monisola& Oyedepo, Temitope A.& Semire, Banjo. Biological Activity of Selected Compounds from Annona muricata Seed as Antibreast Cancer Agents: Theoretical Study. Journal of Chemistry. 2020. Vol. 2020, no. 2020, pp.1-10.
https://search.emarefa.net/detail/BIM-1182077
Data Type
Journal Articles
Language
English
Notes
Includes bibliographical references
Record ID
BIM-1182077