AKTIVITAS ANTIDIABETES SENYAWA AKTIF DARI Tithonia diversifolia, PREDIKSI ABSORPSI, DISTRIBUSI, METABOLISME, DAN EKSKRESI, SERTA PREDIKSI TOKSISITAS SECARA IN SILICO

ANGGRAENI, ERLIN (2020) AKTIVITAS ANTIDIABETES SENYAWA AKTIF DARI Tithonia diversifolia, PREDIKSI ABSORPSI, DISTRIBUSI, METABOLISME, DAN EKSKRESI, SERTA PREDIKSI TOKSISITAS SECARA IN SILICO. S1 thesis, UNIVERSITAS MUHAMMADIYAH PURWOKERTO.

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Abstract

Diabetes mellitus is a metabolic disease with characteristic hyperglycemia that occurs due to abnormalities of insulin secretion, insulin work or both. Currently, diabetes treatment leads to lifestyle changes and pharmacotherapy treatment consisting of oral antidiabetic drugs and/or insulin. However, oral antidiabetic medications can cause side effects. One of the tropical plants used as a traditional medicine used as an empirical anti-diabetes in the community is a moon flower plant, with the species name Tithonia diversifolia. Based on previous research obtained information that there are 36 compounds that can be identified include the research done by Lin, (2012), Lawal et al, (2012), and Zhao et al, (2012) which is not yet known to which compounds are specific acts of antidiabetes. From 36 compounds after screening carried out compounds based on results data in vitro, in vivo, and kemirian structures with ligands, only 26 compounds would be performed docking molecular. These compounds include α-pinene, β-pinene, P-cymene, limonene, Linalool, trans-pinocarveol, Trans-Verbenol, Pinocarvone, Terpinen-4-ol, α-terpineol, myrtenal, Verbenone, Trans-Carveol, (Z)-3-hexenyl tiglate, Cyclosativene, α-copaene, β-caryophyllene, cis-nerolidol, caryophyllene oxide, humulene oxide, Tagitinin C, Tagitinin A, Tagitinin I, Tagitinin G, Tirotundin, 1-hydroxydiversifolin-3-O-methyl ether, and 1-hydroxytirotundin-3-O-methyl ether. These compounds will be adpied as ligands on this research. Research is conducted by predicting the result of test ligands with PPAR-γ receptors with molecular docking using PyRx-Vina software, predicting ADME using swissADME and toxicity using Toxtree. From research produced compounds that have the lowest affinity binding rate are the C tagitinin with good ADME predictions but have a high level of toxicity.

Item Type: Thesis (S1)
Uncontrolled Keywords: Doking Molekuler, PyRx-vina, SwissADME, Toxtree
Subjects: R Medicine > RS Pharmacy and materia medica
Divisions: Fakultas Farmasi > Farmasi S1
Depositing User: wulan
Date Deposited: 30 Aug 2022 06:59
Last Modified: 30 Aug 2022 06:59
URI: https://repository.ump.ac.id:80/id/eprint/13831

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