Journal Description
Compounds
Compounds
is an international, peer-reviewed, open access journal on chemical compounds published quarterly online by MDPI.
- Open Access— free for readers, with article processing charges (APC) paid by authors or their institutions.
- High Visibility: indexed within ESCI (Web of Science), Scopus and other databases.
- Rapid Publication: manuscripts are peer-reviewed and a first decision is provided to authors approximately 32.5 days after submission; acceptance to publication is undertaken in 6.6 days (median values for papers published in this journal in the second half of 2024).
- Recognition of Reviewers: APC discount vouchers, optional signed peer review, and reviewer names published annually in the journal.
- Compounds is a companion journal of Metals.
Latest Articles
Laccase from Melanocarpus albomyces: Molecular Docking Analysis with First-Generation Tetracyclines Through a Mechanistic Approach
Compounds 2025, 5(2), 17; https://doi.org/10.3390/compounds5020017 - 1 May 2025
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Laccases are versatile enzymes capable of oxidizing a wide variety of antibiotics. In this study, the mechanism of catalytic oxidation of first-generation tetracyclines, namely, oxytetracycline, tetracycline, and chlortetracycline, by the Melanocarpus albomyces laccase enzyme was investigated using molecular docking and DFT calculations. Molecular
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Laccases are versatile enzymes capable of oxidizing a wide variety of antibiotics. In this study, the mechanism of catalytic oxidation of first-generation tetracyclines, namely, oxytetracycline, tetracycline, and chlortetracycline, by the Melanocarpus albomyces laccase enzyme was investigated using molecular docking and DFT calculations. Molecular docking studies revealed that all three substrates exhibit negative interaction energies, indicating stable enzyme–substrate complexes, with tetracycline and chlortetracycline showing the highest binding affinities. Global reactivity indices obtained by DFT confirmed the high electrophilicity of the enzyme active site, particularly the aminoacidic residues Glu235 and His508, favoring electron transfer from the substrates. In addition, NBO analysis allowed quantification of the energy of hydrogen bonds in enzyme–substrate interactions, evidencing their key role in the stabilization of the complex. Proton transfer analysis suggested two possible mechanisms: (1) a direct concerted transfer and (2) a process mediated by water molecules. The results provide insights into the thermodynamics, electronic structure, and nature of intermolecular interactions governing the oxidation of tetracyclines by the enzyme, highlighting their potential in bioremediation strategies for antibiotic degradation.
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Open AccessArticle
Synthesis, Structure, and Anticancer Activity of a Dinuclear Organoplatinum(IV) Complex Stabilized by Adenine
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Alisha M. O’Brien, Kraig A. Wheeler and William A. Howard
Compounds 2025, 5(2), 16; https://doi.org/10.3390/compounds5020016 - 1 May 2025
Abstract
The dinuclear platinum(IV) compound {Pt(CH3)3}2(μ-I)2(μ-adenine) (abbreviated Pt2ad), obtained by treating cubic [PtIV(CH3)3(μ3-I)]4 with two equivalents of adenine, was isolated and structurally characterized by single
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The dinuclear platinum(IV) compound {Pt(CH3)3}2(μ-I)2(μ-adenine) (abbreviated Pt2ad), obtained by treating cubic [PtIV(CH3)3(μ3-I)]4 with two equivalents of adenine, was isolated and structurally characterized by single crystal X-ray diffraction. The National Cancer Institute Developmental Therapeutics Program’s in vitro sulforhodamine B assays showed Pt2ad to be particularly cytotoxic against the central nervous system cancer cell line SF-539, and the human renal carcinoma cell line RXF-393. Furthermore, Pt2ad displayed some degree of cytotoxicity against non-small cell lung cancer (NCI-H522), colon cancer (HCC-2998, HCT-116, HT29, and SW-620), melanoma (LOX-IMVI, Malme-3M, M14, MDA-MB-435, SK-MEL-28, and UACC-62), ovarian cancer (OVCAR-5), renal carcinoma (A498), and triple negative breast cancer (BT-549, MDA-MB-231, and MDA-MB-468) cells. Although anticancer studies involving some adenine platinum(II) compounds have been reported, this study marks the first assessment of the anticancer activity of an adenine platinum(IV) complex.
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(This article belongs to the Special Issue Organic Compounds with Biological Activity)
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Open AccessArticle
Biogenic Synthesis of Copper and Zinc Oxide from Eucalyptus dunnii Leaves for Pinus elliottii Wood Preservation
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Nathalia V. V. de Nunes, Sarah K. S. da Silva, Marlon B. B. Rodrigues, Nidria D. Cruz, Augusto S. do Nascimento, Ester S. M. Kegles, Rafael Beltrame, Darci A. Gatto, Rafael A. Delucis and André L. Missio
Compounds 2025, 5(2), 15; https://doi.org/10.3390/compounds5020015 - 1 May 2025
Abstract
The present study aims to evaluate the mechanical properties, colorimetric characteristics, and decay resistance of Pinus elliottii woods treated with oxides synthesized via green chemistry. For this purpose, an aqueous extract from Eucalyptus dunnii leaves was used to synthesize particles based on copper-
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The present study aims to evaluate the mechanical properties, colorimetric characteristics, and decay resistance of Pinus elliottii woods treated with oxides synthesized via green chemistry. For this purpose, an aqueous extract from Eucalyptus dunnii leaves was used to synthesize particles based on copper- and zinc-based oxides, as well as a binary oxide system (CuO/ZnO). Sodium polyacrylate was employed as a dispersant, impregnating the oxides into the wood through a horizontal autoclave using a modified Bethell process, assisted by a compressor, applying a pressure of 0.8 MPa for 30 min. The exposure to weathering aging did not significantly alter the mechanical properties of the samples, but it caused the leaching of particles from the treated wood surface, as shown by colorimetric results. Regarding the decay resistance, the copper-based oxide proved to be the most effective treatment against Trametes versicolor (a white-rot fungus), reducing mass loss down to 1.2%. The CuO/ZnO formulation reduced the mass loss caused by Gloeophyllum trabeum to 1.1%, while the zinc oxide showed minimal efficacy. Thus, oxides synthesized via green chemistry using aqueous leaf extracts and mild thermal conditions for synthesis and calcination proved effective in enhancing the wood resistance against biotic deterioration agents.
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(This article belongs to the Special Issue Feature Papers in Compounds (2025))
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Synthesis, Investigation, Biological Evaluation, and Application of Coordination Compounds with Schiff Base—A Review
by
Petya Emilova Marinova and Kristina Dimova Tamahkyarova
Compounds 2025, 5(2), 14; https://doi.org/10.3390/compounds5020014 - 26 Apr 2025
Abstract
Coordination compounds, characterized by the coordination of metal ions with ligands, represent a pivotal area of research in chemistry due to their diverse structures and versatile applications. This review delves into the synthesis, characterization, biological evaluation, and practical applications of these compounds. A
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Coordination compounds, characterized by the coordination of metal ions with ligands, represent a pivotal area of research in chemistry due to their diverse structures and versatile applications. This review delves into the synthesis, characterization, biological evaluation, and practical applications of these compounds. A variety of synthetic methodologies (traditional solution-based techniques) are discussed to highlight advancements in the field. Investigations into the structural, electronic, and spectral properties of coordination compounds are emphasized to provide insights into their functional attributes. The biological evaluation section focuses on their roles in antimicrobial, anticancer, and enzyme-inhibitory activities, underscoring their potential in therapeutic development. Attention is paid to nanoparticles, which are increasingly used for the treatment of oncological diseases. The metal complexes have been shown to have antibacterial, antifungal, antiviral, antioxidant, and antiproliferative properties. Additionally, the review explores their applications across domains such as catalysis, illustrating their multifaceted utility. By synthesizing recent findings and trends, this article aims to bridge the gap between fundamental chemistry and applied sciences, paving the way for innovative uses of coordination compounds in both biological and industrial contexts.
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(This article belongs to the Special Issue Feature Papers in Compounds (2024))
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Mechanical Response and Elastocaloric Performance of Ni-Ti Shape Memory Alloy Sheets Under Varying Strain Rates
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Gianmarco Bizzarri, Girolamo Costanza, Ilaria Porroni and Maria Elisa Tata
Compounds 2025, 5(2), 13; https://doi.org/10.3390/compounds5020013 - 25 Apr 2025
Abstract
The optimization of elastocaloric cooling systems based on Shape Memory Alloys (SMAs) faces significant challenges in practical implementation. Despite promising thermomechanical properties, the development of efficient and compact cooling devices is hindered by incomplete understanding of strain rate effects on transformation behavior and
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The optimization of elastocaloric cooling systems based on Shape Memory Alloys (SMAs) faces significant challenges in practical implementation. Despite promising thermomechanical properties, the development of efficient and compact cooling devices is hindered by incomplete understanding of strain rate effects on transformation behavior and energy conversion efficiency. While previous research has broadly characterized general SMAs’ thermomechanical behavior, the specific relationship between strain rate and elastocaloric performance in Ni-Ti sheets requires systematic investigation to overcome these barriers. This study investigates the strain rate dependence of Ni-Ti sheets’ properties through systematic mechanical characterization across strain rates ranging from to . Commercial Ni-Ti sheets underwent Shape Setting heat treatment and were characterized at eight different deformation levels using a universal testing machine equipped with a 50 kN load cell. Each deformation level was investigated through tests performed at four different crosshead speeds (1–24 mm/min), while monitoring stress-strain behavior and energy parameters. Results suggest distinct rate-dependent patterns in transformation stresses and energy dissipation characteristics across different strain rates. The analysis indicates that mechanical response and transformation behavior vary significantly between lower and higher strain rates, with implications for practical cooling applications. These findings aim to establish guidelines for optimizing elastocaloric performance by identifying suitable operating conditions for specific application requirements, considering factors such as energy conversion efficiency and cycling frequency.
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(This article belongs to the Special Issue Feature Papers in Compounds (2025))
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Open AccessArticle
Bioencapsulation of Hesperidinase from Penicillium sp. Toward Biocompounds with Enhanced Bioactivity
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Diogo F. Ribeiro, Ana Catarina Severo and Maria H. L. Ribeiro
Compounds 2025, 5(2), 12; https://doi.org/10.3390/compounds5020012 - 14 Apr 2025
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Natural polyphenols, especially the ones in their glycosylated form like hesperidin, rutin, and anthocyanins, are the most abundant phenolic compounds in citric fruits, apples, and red fruits, respectively. They stand out for their high nutraceutical potential, with various reported properties, like antioxidant, anti-inflammatory,
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Natural polyphenols, especially the ones in their glycosylated form like hesperidin, rutin, and anthocyanins, are the most abundant phenolic compounds in citric fruits, apples, and red fruits, respectively. They stand out for their high nutraceutical potential, with various reported properties, like antioxidant, anti-inflammatory, anticarcinogenic, and cardioprotective. Nevertheless, these compounds have low bioavailability and are rapidly excreted and released by the organism. Therefore, the main goal of this work was to obtain polyphenols with increased bioactivity by functionalizing biocompounds in fruit juices, namely, orange, apple, and red fruits. This modification was achieved via hesperidinase, an enzyme that catalyzes the hydrolysis of several natural bioactive compounds. Hesperidinase was produced with Penicillium sp. The activity and stability of the produced enzyme, in its free and immobilized form, using the sol–gel method, were assessed, as well as the bioactivity of the bioprocessed juices. Moreover, after immobilizing hesperidinase in sol–gel lens-shaped particles, the activity and operational stability of the bioencapsulates were evaluated by measuring the residual activity over several runs. Using the specific substrate p-NPG, β-D-glucosidase retained 31% of its activity in the second run, 22.6% in the third, and 35% in the fourth. For α-L-rhamnosidase, using the substrate p-NPR, residual activity was 31.1% in both the fourth and fifth runs. In fruit juices, the bioencapsulates exhibited residual activities around 100% in the second run, approximately 81% in the third, and around 90% in the fourth. The antioxidant and anti-inflammatory activities of the bioprocessed juices were evaluated, and an increase in the anti-inflammatory activity was observed when compared with the non-processed juices.
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Open AccessCommunication
Hybrid Crown Ether Ligands with Disiloxane Units and Their Complexes with Small s-Block Ions
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Roman-Malte Richter, Daniel James Stauf, Anna Lena Rauchel, Lutz Ruppach, Kevin Bania, Annalena Duncker and Carsten von Hänisch
Compounds 2025, 5(2), 11; https://doi.org/10.3390/compounds5020011 - 11 Apr 2025
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Herein, we present hybrid crown ether ligands with siloxane and ethylene oxide units and their coordination with the cations Li+, Na+, Mg2+ and Ca2+. The compounds prepared are (SiMe2O)2(C2H4
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Herein, we present hybrid crown ether ligands with siloxane and ethylene oxide units and their coordination with the cations Li+, Na+, Mg2+ and Ca2+. The compounds prepared are (SiMe2O)2(C2H4O)3 (1, TrEGDS = Triethylenglycoldisiloxane) and (SiMe2O)2(C2H4O)4 (2, TeEGDS = Tetraethylenglycoldisiloxane)), as well as the metal complexes [Li(TrEGDS][GaI4] (3), [Na(TeEGDS)][GaI4] (4), [Mg(TrEGDS)][GaI4]2 (5) and [Ca(TeEGDS)][GaI4]2 (6). Single-crystal X-ray diffraction was used to study the prepared complexes and coordination modes in the solid state.
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(This article belongs to the Special Issue Feature Papers in Compounds (2025))
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Novel Alumina–Copper Electrode Composites: Toward Efficient Glutamate and H2O2 Detection
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Tatjana Novaković, Dejan Pjević, Nadica Abazović and Zorica Mojović
Compounds 2025, 5(2), 10; https://doi.org/10.3390/compounds5020010 - 10 Apr 2025
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Alumina is a well-known catalyst and catalyst support. The electrochemical properties of alumina have recently gained attention. The electrochemical response of alumina greatly depends on the type and number of surface groups present in different alumina types. The surfaces of two types of
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Alumina is a well-known catalyst and catalyst support. The electrochemical properties of alumina have recently gained attention. The electrochemical response of alumina greatly depends on the type and number of surface groups present in different alumina types. The surfaces of two types of alumina, anhydrous (A) and trihydrate (T) alumina, were modified by copper through an ion-exchange procedure. The samples were characterized by diffuse reflectance UV–Vis spectroscopy. The obtained samples were used as modifiers of carbon paste electrodes. The electrochemical characterization of the samples was performed using cyclic voltammetry and two redox probes. The electrochemical behavior of samples was investigated in the alkaline and neutral media. The electroanalytical performance of the synthesized composites was tested on glutamate and hydrogen peroxide by linear sweep voltammetry. The functionalization of alumina with copper by ion exchange offered a fast and cost-effective procedure for obtaining a composite with enhanced electrochemical properties for sensing biologically important analytes.
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(This article belongs to the Special Issue Feature Papers in Compounds (2025))
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Identification of Constituents and Evaluation of Biological Activity of Piptadenia stipulacea (Benth.) Ducke Ethanol Extract
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Stéphanie Aguiar de Negreiros Matos Silva, Ayslan Batista Barros, Jessica Maria Teles Souza, Rodrigo Ferreira Santiago, Evaldo dos Santos Monção Filho, Andréa Felinto Moura, Alyne Rodrigues de Araújo, Durcilene Alves da Silva, Mariana Helena Chaves, Ana Jérsia Araújo and José Delano Barreto Marinho Filho
Compounds 2025, 5(2), 9; https://doi.org/10.3390/compounds5020009 - 29 Mar 2025
Abstract
Secondary metabolites such as flavonoids bring a range of biological properties to natural products, making them potential candidates for the pharmaceutical industry. Piptadenia stipulacea (Benth.) Ducke is well known in Brazil as Jurema Branca, and yet few studies have investigated its biological and
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Secondary metabolites such as flavonoids bring a range of biological properties to natural products, making them potential candidates for the pharmaceutical industry. Piptadenia stipulacea (Benth.) Ducke is well known in Brazil as Jurema Branca, and yet few studies have investigated its biological and phytochemical properties. This study aimed to characterize and evaluate the biological properties of ethanolic extract obtained from the bark of Jurema Branca. Characterization was performed by qualitative phytochemistry, HPLC, and mass spectroscopy. The antibacterial properties were investigated by microdilution method, cytotoxicity by MTT method, biocompatibility testing with human erythrocytes was performed, and antioxidant properties were investigated using DPPH and ABTS radical scavenging. The phytochemical tests demonstrated that rhamnetin and luteolin were the main constituents of the extract. This is the first report of these compounds in this species. The extract presented activity against Staphylococcus aureus (MIC = 500 µg/mL) and demonstrated activity against human colorectal adenocarcinoma (HCT-116), prostate adenocarcinoma (PC-3), and acute myeloid leukemia (HL-60) cell lines with IC50 of 37.96, 37.6, and 27.82 µg/mL, respectively, for this Piptadenia genus. Additionally, the extract presented excellent biocompatibility and antioxidant activity (IC50 = 956.7 and 147.2 µg/mL in DPPH and ABTS methods, respectively). These results are novel for the Piptadenia genus and pave the way for further evaluations regarding the biological importance of this species.
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(This article belongs to the Special Issue Organic Compounds with Biological Activity)
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Open AccessReview
Fructooligosaccharides (FOSs): A Condensed Overview
by
Pedro Fernandes
Compounds 2025, 5(2), 8; https://doi.org/10.3390/compounds5020008 - 26 Mar 2025
Abstract
FOSs are short-chain fructose-based oligosaccharides with notable functional and health benefits. Naturally present in various fruits and vegetables, FOSs are primarily produced enzymatically or microbially from sucrose or long-chain fructans, namely, inulin. Enzymes such as fructosyltransferase, β-fructofuranosidase, and endoinulinase are typically involved in
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FOSs are short-chain fructose-based oligosaccharides with notable functional and health benefits. Naturally present in various fruits and vegetables, FOSs are primarily produced enzymatically or microbially from sucrose or long-chain fructans, namely, inulin. Enzymes such as fructosyltransferase, β-fructofuranosidase, and endoinulinase are typically involved in its production. The chemical structure of FOSs consists of an assembly of fructose residues combined with a glucose unit. The increasing consumer demand for healthy foods has driven the widespread use of FOSs in the functional food industry. Thus, FOSs have been incorporated into dairy products, beverages, snacks, and pet foods. Beyond food and feed applications, FOSs serve as a low-calorie sweetener for and are used in dietary supplements and pharmaceuticals. As a prebiotic, they enhance gut health by promoting the growth of beneficial bacteria, aid digestion, improve mineral absorption, and help regulate cholesterol and triglyceride levels. Generally recognized as safe (GRAS) and approved by global regulatory agencies, FOSs are a valuable ingredient for both food and health applications. This review provides an updated perspective on the natural sources and occurrence of FOSs, their structures, and physicochemical and physiological features, with some focus on and a critical assessment of their potential health benefits. Moreover, FOS production methods are concisely addressed, and forthcoming developments involving FOSs are suggested.
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(This article belongs to the Special Issue Feature Papers in Compounds (2025))
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Open AccessArticle
Atomic Many-Body Selectivity in Cubic CsPbI3 Solar Cell Memristor
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Luis Craco and Sabrina S. Carara
Compounds 2025, 5(1), 7; https://doi.org/10.3390/compounds5010007 - 19 Mar 2025
Abstract
Using DFT+DMFT, we show the importance of spin-orbit coupling together with multi-orbital interactions in prescribing the reconstructed electronic state of the cubic CsPbI3 crystal. Considering realistic Coulomb parameter values and Pb-spin-orbit interaction, we uncover relevant key features in the one-particle spectral functions
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Using DFT+DMFT, we show the importance of spin-orbit coupling together with multi-orbital interactions in prescribing the reconstructed electronic state of the cubic CsPbI3 crystal. Considering realistic Coulomb parameter values and Pb-spin-orbit interaction, we uncover relevant key features in the one-particle spectral functions for the Pb-6p and I-5p orbitals of semiconducting CsPbI3 bulk crystal and the role played by p and n doping relevant for band-selective metallicity and current-voltage characteristics. The implication of our study for cubic CsPbI3 is expected to be an important step to understanding the electronic structure of pure and doped broadband solar cell-based memristor materials for neuromorphic computing.
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(This article belongs to the Special Issue Feature Papers in Compounds (2025))
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Impact of Solvents on the Crystal Morphology of CL-20/TFAZ Cocrystals: A Predictive Study
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Yuanyuan Sun, Le Yu, Yichen Wang and Nian-Tzu Suen
Compounds 2025, 5(1), 6; https://doi.org/10.3390/compounds5010006 - 20 Feb 2025
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The cocrystallization technique has been widely applied in the fields of energetic materials (EMs) to settle the inherent trade-off between high energy and low sensitivity in current high-energy molecules. Despite its widespread application, the mechanistic understanding of cocrystals growing from solutions remains largely
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The cocrystallization technique has been widely applied in the fields of energetic materials (EMs) to settle the inherent trade-off between high energy and low sensitivity in current high-energy molecules. Despite its widespread application, the mechanistic understanding of cocrystals growing from solutions remains largely underexplored. This paper presents a mechanistic model grounded in the spiral growth mechanism to predict the crystal morphologies of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane (CL-20) and 7H-trifurazano [3,4-b:3′,4′-f:3″,4″-d]azepine (TFAZ) cocrystals. In this model, it was assumed that CL-20 and TFAZ molecules incorporated into the crystal lattice simultaneously from solution as preformed growth units. The binding energies between the CL-20 molecule and TFAZ molecule were calculated to determine the most potential growth units. The predicted morphologies closely align with the experimental determinations supporting the model’s validity. Furthermore, the study found that the crystal habits were significantly influenced by the choice of solvents, due to variations in interfacial energetics affecting the growth process.
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Open AccessEditorial
Compounds: Five Years of Serving the Dissemination of Chemistry
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Juan C. Mejuto
Compounds 2025, 5(1), 5; https://doi.org/10.3390/compounds5010005 - 14 Feb 2025
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Compounds has existed as a scientific publication in the field of chemistry for five years now [...]
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Open AccessReview
Natural Antioxidants: Advancing Stability and Performance in Sustainable Biobased and Biodegradable Plastics
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Norma Mallegni, Francesca Cicogna, Elisa Passaglia, Vito Gigante, Maria-Beatrice Coltelli and Serena Coiai
Compounds 2025, 5(1), 4; https://doi.org/10.3390/compounds5010004 - 3 Feb 2025
Cited by 1
Abstract
The depletion of fossil fuels and environmental concerns have driven the development of sustainable materials, including bio-based and biodegradable plastics, as alternatives to conventional plastics. Although these plastics aid in waste management and climate change mitigation, their vulnerability to oxidative degradation impacts their
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The depletion of fossil fuels and environmental concerns have driven the development of sustainable materials, including bio-based and biodegradable plastics, as alternatives to conventional plastics. Although these plastics aid in waste management and climate change mitigation, their vulnerability to oxidative degradation impacts their longevity, durability, and performance. Natural antioxidants such as tocopherols, flavonoids, and tannins, extracted from plants or agri-food waste, present a sustainable alternative to synthetic stabilizers by enhancing the oxidative thermal stability of polymers like poly(lactic acid) (PLA), poly(butylene succinate) (PBS), poly(butylene succinate-adipate) (PBSA), poly(butylene adipate-co-terephthalate) (PBAT), poly(hydroxyalkanoate) (PHA), and starch-based materials. This review highlights recent advances in bio-based plastics stabilized with natural antioxidants, their mechanisms of action, and their role in improving material properties for applications like packaging. Additionally, it explores their impact on recycling processes, advancements in composite production techniques, and future research directions. Bioplastics can achieve enhanced performance, reduce waste, and support a circular economy by incorporating natural antioxidants.
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(This article belongs to the Special Issue Feature Papers in Compounds (2024))
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Open AccessArticle
Volatile Constituents of Four Hypericum Species Native to Greece
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Eleni Kakouri, Dimitra Daferera, Aimilia Nalbanti, Panayiotis Trigas and Petros A. Tarantilis
Compounds 2025, 5(1), 3; https://doi.org/10.3390/compounds5010003 - 24 Jan 2025
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The genus Hypericum (Hypericaceae), comprising approximately 500 taxa classified into 22 sections, has remained largely unexplored in terms of its chemical composition, with existing studies on a limited number of species revealing significant chemical polymorphism. This study investigates the volatile profiles of four
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The genus Hypericum (Hypericaceae), comprising approximately 500 taxa classified into 22 sections, has remained largely unexplored in terms of its chemical composition, with existing studies on a limited number of species revealing significant chemical polymorphism. This study investigates the volatile profiles of four Hypericum species (H. rumeliacum subsp. apollinis, H. vesiculosum, H. delphicum, and H. olympicum) through GC-MS analysis. Hypericum rumeliacum subsp. apollinis, collected from Mt. Parnassos, exhibited a high abundance of sesquiterpenes hydrocarbons (32.5%) and oxygenated sesquiterpenes (29.7%). Hypericum vesiculosum collected from Mt. Chelmos was rich in oxygenated monoterpenes (33.5%), followed by benzyl derivatives (25.9%). Hypericum delphicum and H. olympicum, collected from the island of Evvia, showed a predominance of alkanes (35.8%) and oxygenated sesquiterpenes (31.9%) in H. delphicum and sesquiterpenes hydrocarbons (41.2%) and oxygenated sesquiterpenes (29.9%) in H. olympicum. Our findings provide new data on the volatile profile of H. vesiculosum and enhance existing information on other species, highlighting notable chemical diversity within the genus Hypericum.
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Open AccessReview
Therapeutic Capabilities of Triterpenes and Triterpenoids in Immune and Inflammatory Processes: A Review
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Martha Mantiniotou, Vassilis Athanasiadis, Dimitrios Kalompatsios, Eleni Bozinou and Stavros I. Lalas
Compounds 2025, 5(1), 2; https://doi.org/10.3390/compounds5010002 - 3 Jan 2025
Abstract
Plant-derived secondary metabolites such as triterpenes and triterpenoids are present in a wide range of plant species. These compounds are particularly attractive due to their extensive range of biological properties and potential applications as intermediates in the synthesis of novel pharmacologically promising medications.
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Plant-derived secondary metabolites such as triterpenes and triterpenoids are present in a wide range of plant species. These compounds are particularly attractive due to their extensive range of biological properties and potential applications as intermediates in the synthesis of novel pharmacologically promising medications. Saponins, which are glycosylated triterpenoids found in nature, exhibit the same properties. At this point, the effectiveness of saponins as an anti-inflammatory medication has been verified. This review article examines the primary connections between immune responses and anti-inflammatory activity, focusing specifically on the correlation between triterpenes and triterpenoids. These connections have been investigated in various cell models, as well as in vitro and in vivo studies. The present research provides a comprehensive overview of the current understanding of the therapeutic capabilities of triterpenes and triterpenoids in immune and inflammatory processes. It also highlights emerging standards and their potential utilization in pharmaceutical and clinical settings.
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(This article belongs to the Special Issue Organic Compounds with Biological Activity)
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Open AccessReview
A Review on Metal–Organic Frameworks as Technological Excipients: Synthesis, Characterization, Toxicity, and Application in Drug Delivery Systems
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Pedrita A. Sampaio, Emanuella C. V. Pereira, Pedro G. S. Sá, José Marcos T. Alencar Filho, Leslie R. M. Ferraz, Rodolfo H. V. Nishimura, Aline S. Ferreira, Pedro J. Rolim Neto, Evando S. Araújo and Larissa A. Rolim
Compounds 2025, 5(1), 1; https://doi.org/10.3390/compounds5010001 - 2 Jan 2025
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Metal–organic frameworks (MOFs) are also known as porous coordination polymers. This kind of material is constructed with inorganic nodes (metal ions or clusters) with organic linkers and has emerged as a promising class of materials with several unique properties. Well-known applications of MOFs
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Metal–organic frameworks (MOFs) are also known as porous coordination polymers. This kind of material is constructed with inorganic nodes (metal ions or clusters) with organic linkers and has emerged as a promising class of materials with several unique properties. Well-known applications of MOFs include their use as gas storage and in separation, catalysis, carbon dioxide capture, sensing, slender film gadgets, photodynamic therapy, malignancy biomarkers, treatment, and biomedical imaging. Over the past 15 years, an increasing amount of research has been directed to MOFs due to their advanced applications in fuel cells, supercapacitors, catalytic conversions, and drug delivery systems. Various synthesis methods have been proposed to achieve MOFs with nanometric size and increased surface area, controlled surface topology, and chemical activity for industrial use. In this context, the pharmaceutical industry has been watching the accelerated development of these materials with great attention. Thus, the objective of this work is to study the synthesis, characterization, and toxicity of MOFs as potential technological excipients for the development of drug carriers. This work highlights the use of MOFs not only as delivery systems (DDSs) but also in advanced diagnostics and therapies, such as photodynamic therapy and targeted delivery to tumors. Bibliometric analyses showed a growing interest in the topic, emphasizing its contemporary relevance.
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Open AccessReview
Bench to Any Side—The Pharmacology and Applications of Natural and Synthetic Alkylated Hydroxy Cinnamates and Cinnamides
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José C. J. M. D. S. Menezes and Vinícius R. Campos
Compounds 2024, 4(4), 729-776; https://doi.org/10.3390/compounds4040044 - 4 Dec 2024
Cited by 1
Abstract
Natural alkylated hydroxy cinnamates (AHCs) isolated from medicinal plants and the thereby designed and synthesized cinnamides are derivatives of hydroxy cinnamic acids such as p-coumaric, sinapic, ferulic, and caffeic acids, which are naturally derived from human dietary sources. The pharmacological properties displayed
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Natural alkylated hydroxy cinnamates (AHCs) isolated from medicinal plants and the thereby designed and synthesized cinnamides are derivatives of hydroxy cinnamic acids such as p-coumaric, sinapic, ferulic, and caffeic acids, which are naturally derived from human dietary sources. The pharmacological properties displayed by AHCs based on their inherent structure range include antioxidant, antimicrobial, antiplasmodial, anti-tyrosinase, Alzheimer’s and Parkinson’s disease therapy, anticancer therapy, metabolic disease therapy, and biopesticides, which have not been reviewed together. Based on their inherent antioxidant, antimicrobial, and UV absorption and their structure–activity relationships, these cinnamyl esters and amides can be used for food preservation in emulsions and oils, as sun-protective components of skin care formulations, and in many other multifunctional applications. In conclusion, the fine-tuning of the structural features such as the type of hydroxy cinnamic acid used, the length of alkyl chains for variable lipophilicity, conversion from cinnamic to propanoic for antioxidants, the increase in methoxy or the change to amino groups to increase the molar absorption coefficient and loss of absorption values, the substitution by halides or amino groups for potent biopesticides, and conversion from esters to amide bonds leads to different AHCs for biomedical, cosmetic, and agriculture applications as an emerging field of investigation that can overall provide natural, safe, biodegradable, and sustainable molecules.
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(This article belongs to the Topic Research on Natural Products of Medical Plants)
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Sustainable Enzymatic Production of Bioactive Compounds: From Designing to Bioavailability
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Raquel Neves and Maria H. L. Ribeiro
Compounds 2024, 4(4), 708-728; https://doi.org/10.3390/compounds4040043 - 25 Nov 2024
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This study evaluates the feasibility and effectiveness of using immobilized pectinase enzymes for juice processing to reduce cloudiness while preserving nutritional and bioactive properties. The research is driven by the increasing demand for innovative food products that offer enhanced functionality and health benefits.
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This study evaluates the feasibility and effectiveness of using immobilized pectinase enzymes for juice processing to reduce cloudiness while preserving nutritional and bioactive properties. The research is driven by the increasing demand for innovative food products that offer enhanced functionality and health benefits. It focuses on the development and application of immobilized biocatalysts in bioprocessing, specifically using pectinase encapsulated in a sol–gel matrix. Reaction parameters for the interaction between immobilized pectinase and its primary substrate, pectin, were optimized through systematic experimentation. Optimal conditions were established, achieving enhanced enzyme activity and stability with 0.15 g of lens-shaped capsules containing 10.0 mg/mL pectinase in 24-well microplates as microreactors. Kinetic studies indicated improved substrate affinity after immobilization (Km = 0.115 mg/mL), particularly when magnetized (Kmi = 0.041 mg/mL). Operational stability and reusability assessments demonstrated potential for extended use with magnetized pectinase capsules retaining higher residual activity after a fourth reuse cycle (155% > 75%). The application of immobilized pectinase in processing peach nectar successfully reduced cloudiness and increased the release of bioactive compounds, enhancing antioxidant and anti-inflammatory activities, as evaluated by the DPPH (2,2-diphenyl-1-picrylhydrazyl) assay and the albumin method, respectively. In vitro digestion studies revealed dynamic activity profile changes, highlighting the impact of juice bioprocessing on bioavailability.
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Open AccessEditor’s ChoiceArticle
Rheology of Cellulosic Microfiber Suspensions Under Oscillatory and Rotational Shear for Biocomposite Applications
by
Helena Cristina Vasconcelos, Henrique Carrêlo, Telmo Eleutério, Maria Gabriela Meirelles, Reşit Özmenteş and Roberto Amorim
Compounds 2024, 4(4), 688-707; https://doi.org/10.3390/compounds4040042 - 12 Nov 2024
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This study investigates the rheological behavior of cellulose microfiber suspensions derived from kahili ginger stems (Hedychium gardnerianum), an invasive species, in two adhesive matrices: a commercial water-based adhesive (Coplaseal®) and a casein-based adhesive made from non-food-grade milk, referred to
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This study investigates the rheological behavior of cellulose microfiber suspensions derived from kahili ginger stems (Hedychium gardnerianum), an invasive species, in two adhesive matrices: a commercial water-based adhesive (Coplaseal®) and a casein-based adhesive made from non-food-grade milk, referred to as K and S samples, respectively. Rheological analyses were performed using oscillatory and rotational shear tests conducted at 25 °C, 50 °C, and 75 °C to assess the materials’ viscoelastic properties more comprehensively. Oscillatory tests across a frequency range of 1–100 rad/s assessed the storage modulus (G′) and loss modulus (G″), while rotational shear tests evaluated apparent viscosity and shear stress across shear rates from 0.1 to 1000 s−1. Fiber-free samples consistently showed lower moduli than fiber-containing samples at all frequencies. The incorporation of fibers increased the dynamic moduli in both K and S samples, with a quasi-plateau observed at lower frequencies, suggesting solid-like behavior. This trend was consistent in all tested temperatures. As frequencies increased, the fiber network was disrupted, transitioning the samples to fluid-like behavior, with a marked increase in G′ and G″. This transition was more pronounced in K samples, especially above 10 rad/s at 25 °C and 50 °C, but less evident at 75 °C. This shift from solid-like to fluid-like behavior reflects the transition from percolation effects at low frequencies to matrix-dominated responses at high frequencies. In contrast, S samples displayed a wider frequency range for the quasi-plateau, with less pronounced moduli changes at higher frequencies. At 75 °C, the moduli of fiber-containing and fiber-free S samples nearly converged at higher frequencies, indicating similar effects of the fiber and matrix components. Both fiber-reinforced and non-reinforced suspensions exhibited pseudoplastic (shear-thinning) behavior. Fiber-containing samples exhibited higher initial viscosity, with K samples displaying greater differences between fiber-reinforced and non-reinforced systems compared to S samples, where the gap was narrower. Interestingly, S samples exhibited overall higher viscosity than K samples, implying a reduced influence of fibers on the viscosity in the S matrix. This preliminary study highlights the complex interactions between cellulosic fiber networks, adhesive matrices, and rheological conditions. The findings provide a foundation for optimizing the development of sustainable biocomposites, particularly in applications requiring precise tuning of rheological properties.
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