Most electrospray based ambient ionization techniques, e.g., laser ablation electrospray ionization (LAESI), utilize a fixed spray solution composition. Complex samples often contain compounds of different polarity that exhibit a wide range of solubilities in the electrospray solvent. Thus, the fixed spray solution composition limits the molecular coverage of these approaches. Two-barrel theta ...

High performance liquid chromatography (HPLC) stationary phases can be segregated by their ability to separate either polar on nonpolar compounds, that is, reversed-phase materials (C18, C8) strongly retain nonpolar solutes with polar solutes eluting at or near the void volume, and hydrophilic interaction chromatography (HILIC) and normal phase columns strongly retain polar analytes with nonpol...

Insect social life is governed by chemicals. A great number of studies have demonstrated that the blend of hydrocarbons present on the cuticle (CHCs) plays a pivotal role in intra- and inter-specific communication. It is not surprising, therefore, that social parasites, specialized in exploiting the costly parental care provided by host workers, exploit the host chemical communication system to...

The coupling of liquid chromatography and mass spectrometry (LC/MS) has been established as one of the most powerful tools in analytical chemistry and has resulted in important advances especially in biomedical and biochemical research. The predominantly used interfaces are electrospray ionization (ESI) and atmospheric pressure chemical ionization (APCI). Non-polar compounds, however, are diffi...

Many microbes reduce the nitro substituents of 2,4,6-trinitrotoluene (TNT), producing aminodinitrotoluenes (ADNTs). These compounds are recalcitrant to further breakdown and are acutely toxic. In a search for organisms capable of metabolizing ADNTs, a bacterial strain was isolated for the ability to use 2-aminobenzoate (anthranilate) as sole C-source. This isolate, Pseudomonas aeruginosa MAO1, ...

Motivation. It is important to determine whether a candidate molecule is capable of penetrating the blood-brain barrier in drug discovery and development. The aim of this paper is to establish a predictive model for blood-brain barrier penetration only using two simple descriptors, molecular volume and polar surface area. Method. A dataset of 111 compounds is divided into a training set of 86 c...

Paracoccidioides is the agent of paracoccidioidomycosis. Malate synthase plays a crucial role in the pathogenicity and virulence of various fungi, such as those that are human pathogens. Thus, an inhibitor of this enzyme may be used as a powerful antifungal without side effects in patients once these enzymes are absent in humans. Here, we searched for compounds with inhibitory capacity against ...

Hydrophilic interaction liquid chromatography (HILIC) provides an alternative approach to effectively separate small polar compounds on polar stationary phases. The purpose of this work was to review the options for the characterization of HILIC stationary phases and their applications for separations of polar compounds in complex matrices. The characteristics of the hydrophilic stationary phas...

Recent exploratory syntheses of polar intermetallic compounds containing gold have established gold’s tremendous ability to stabilize new phases with diverse and fascinating structural motifs. In particular, Au-rich polar intermetallics contain Au atoms condensed into tetrahedra and diamond-like three-dimensional frameworks. In Au-poor intermetallics, on the other hand, Au atoms tend to segrega...

the oxidation of lipids change organoleptical properties, nutritional value and shelf life of oils, and produce undesirable compounds that are not safe for customer”s health. there is many methods for prevention of oxidation such synthetic antioxidants, (bha, bht, tbhq, gallatester).synthetic antioxidants, have undesirable effects such cancer, motation in human body, therefore it was removed fr...