This study evaluates the potential of Chlorella vulgaris sp. extracts as eco-friendly corrosion inhibitors for API 5L 42 Steel in a 1M HCl acidic environment, offering sustainable alternatives for industrial applications. Two corrosion inhibitors were obtained through solvent extraction methods: M1 (methanol) and M2 (methanol/chloroform). The extracts were characterized using infrared spectroscopy, the analysis revealed hydroxyl, methyl and vinyl groups as the most representative. The effect of corrosion inhibition was study by electrochemical impedance spectroscopy (EIS) and potentiodynamic polarization. The results show significant reductions in corrosion current density and increases in charge transfer resistance, with M2 achieving the highest protection efficiency of 91.20 % and a charge transfer resistance of 501.80 Ω at a 120 ppm concentration, while M1 reached 88.22 % efficiency with a charge transfer resistance of 102.30 Ω. Uv–Vis measurements were performed to determine the electronic transitions of the metal-inhibitor system for each of the extracts. ANOVA highlighted the significant influence of biomass concentration on corrosion resistance. The adsorption of M1 and M2 extracts on the carbon steel surface obeyed the Langmuir isotherm and Gibbs free energy calculations indicated a physisorption mechanism for both extracts. Surface morphology analysis by Scanning electron microscope (SEM) revealed less pitting and reduced surface roughness as inhibitor concentration increased. These findings underscore the potential of Chlorella vulgaris extracts, particularly M2 at 120 ppm, as effective and sustainable corrosion inhibitors for steel in acidic environments.

Chagas and leishmaniasis are two neglected diseases considered as public health problems worldwide, for which there is no effective, low-cost, and low-toxicity treatment for the host. Naphthoquinones are ligands with redox properties involved in oxidative biological processes with a wide variety of activities, including antiparasitic. In this work, in silico methods of quantitative structure–activity relationship (QSAR), molecular docking, and calculation of ADME (absorption, distribution, metabolism, and excretion) properties were used to evaluate naphthoquinone derivatives with unknown antiprotozoal activity. QSAR models were developed for predicting antiparasitic activity against Trypanosoma cruzi, Leishmania amazonensis, and Leishmania infatum, as well as the QSAR model for toxicity activity. Most of the evaluated ligands presented high antiparasitic activity. According to the docking results, the family of triazole derivatives presented the best affinity with the different macromolecular targets. The ADME results showed that most of the evaluated compounds present adequate conditions to be administered orally. Naphthoquinone derivatives show good biological activity results, depending on the substituents attached to the quinone ring, and perhaps the potential to be converted into drugs or starting molecules.

Natural coumarins are present in remarkable amounts as secondary metabolites in edible and medicinal plants, where they display interesting bioactivities. Considering the wide enzymatic arsenal of filamentous fungi, studies on the biotransformation of coumarins using these microorganisms have great importance in green chemical derivatization. Several reports on the biotransformation of coumarins using fungi have highlighted the achievement of chemical analogs with high selectivity by using mild and ecofriendly conditions. Prompted by the enormous pharmacological, alimentary, and chemical interest in coumarin-like compounds, this study evaluated the biotransformation of nine coumarin scaffolds using Cunninghamella elegans ATCC 10028b and Aspergillus brasiliensis ATCC 16404. The chemical reactions which were catalyzed by the microorganisms were highly selective. Among the nine studied coumarins, only two of them were biotransformed. One of the coumarins, 7-hydroxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one, was biotransformed into the new 7,9-dihydroxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one, which was generated by selective hydroxylation in an unactivated carbon. Our results highlight some chemical features of coumarin cores that are important to biotransformation using filamentous fungi.