Development of casein-based nanoencapsulation systems for delivery of epigallocatechin gallate and folic acid.

In this work, binding characteristics of two hydrophilic nutraceutical models, namely epigallocatechin gallate (EGCG) and folic acid (FA), to sodium caseinate were studied by fluorimetry technique. EGCG-loaded casein molecules were then converted to either re-combined casein micelles (r-CMs) or casein nanoparticles (CNPs). Binding stoichiometry of EGCG and FA was 0.

Vibrational spectra, normal coordinate analysis, and hydrogen bond investigation of pyridinium perchlorate.

The IR and Raman spectra of pyridine perchlorate salt (PyHClO) have been recorded in the 4000-300 and 3200-200cm regions, respectively. The structure and vibrational spectra of pyridine salt have been investigated by means of ab initio and density functional theory (DFT) calculations. To examine the efficiency of basis sets in predicting the vibrational spectra of ClO ion, several basis sets were used with the B3LYP and B2PLYP levels of theory.

Efficient delivery of quercetin after binding to beta-lactoglobulin followed by formation soft-condensed core-shell nanostructures.

Nature-made inherent transporting property of beta-lactoglobulin (BLG) was exploited to develop delivery systems for quercetin. After binding to BLG, quercetin was nanoencapsulated within soft-condensed nanostructures of BLG and sodium alginate (ALG). Fluorimetry results revealed that quercetin could bind to BLG even at acidic conditions.

Vibrational assignment and structure of trifluorobenzoylacetone. A density functional theoretical study.

Molecular structure and vibrational frequencies of 4,4,4-trifluoro-1-phenyl-1,3-butanedione, known as trifluorobenzoylacetone (TFBA), have been investigated by means of density functional theory (DFT) calculations. The results were compared with those of benzoylacetone (BA), acetylacetone (AA), and trifluoroacetylacetone (TFAA). Comparing the calculated and experimental band frequencies and intensities suggests coexisting of both stable cis-enol conformers in comparable proportions in the sample.