Chemical profiling, cytotoxic activities through apoptosis induction in MCF-7 cells and molecular docking of Phyllostachys heterocycla bark nonpolar extract was written by Abdelhameed, Reda F. A.;Habib, Eman S.;Ibrahim, Ahmed K.;Yamada, Koji;Abdel-Kader, Maged S.;Ibrahim, Amany K.;Ahmed, Safwat A.;Badr, Jihan M.;Nafie, Mohamed S.. And the article was included in Journal of Biomolecular Structure and Dynamics.Computed Properties of C12H22O4 This article mentions the following:
The chem. constituents of the nonpolar fractions of the bamboo shoot skin Phyllostachys heterocycla were extensively studied. The phytochem. study was divided into two parts: the first deals with isolation of the chem. constituents using different chromatog. techniques that resulted in isolation of four compounds The chem. structures of the pure isolated compounds were elucidated using different spectroscopic data. The second part deals with identification of the rest of the constituents using the GC technique. Addnl., both crude extract and the pure isolated compounds were investigated for cytotoxic activity. One of the isolated compounds; namely glyceryl 1-monopalmitate showed highly promising effect against the MCF-7 cells with (IC50 = 19.78 μM) compared to 5-FU (26.98 μM), and it remarkably stimulated apoptotic breast cancer cell death with 31.6-fold (16.13% compared to 0.51 for the control) at pre-G1 and G2/M-phase cell cycle arrest and blocked the progression of MCF-7 cells. Moreover, the identified compounds especially were found to have high binding affinity towards both TPK and VEGFR-2 through the mol. docking studies which highlight its mode of action. HighlightsChem. profiling of Phyllostachys heterocycla bark nonpolar extract was fully identified. Glyceryl 1-monopalmitate showed highly promising effect against the MCF-7 cells with (IC50 = 19.78 μM) compared to 5-FU (26.98 μM). Glyceryl 1-monopalmitate significantly stimulated apoptotic breast cancer cell death with 31.6-fold by arresting cell cycle at G2/M and preG1 phases. Mol. docking simulation showed good binding affinities towards TPK and VEGFR-2 proteins. In the experiment, the researchers used many compounds, for example, Dimethyl decanedioate (cas: 106-79-6Computed Properties of C12H22O4).
Dimethyl decanedioate (cas: 106-79-6) belongs to esters. Esters are widespread in nature and are widely used in industry. In nature, fats are in general triesters derived from glycerol and fatty acids. Esters are responsible for the aroma of many fruits, including apples, durians, pears, bananas, pineapples, and strawberries. Acyl chlorides and acid anhydrides alcoholysis is another way to produce esters. Acyl chlorides and acid anhydrides react with alcohols to produce esters. Anydrous conditions are recommended since both acyl chlorides and acid anhydrides react with water.Computed Properties of C12H22O4
Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics