Octanoate Research Articles

Acid-Catalyzed Solvolysis of Softwood in Caprylyl Glycol to Produce Lignin Derivatives.

Glycol lignin (GL) is produced via the acid-catalyzed solvolysis of softwood meal using glycols such as polyethylene glycol. The physicochemical and thermal properties of GL are expected to be controllable by varying the glycol type. In this study, caprylyl glycol (CG), which is a biobased glycol derived from the caprylic acid component of coconut and palm oils, was used to investigate the effects on the acid-catalyzed solvolysis of softwood. The reactions were performed at 140, 150, and 160 °C for 30-120 min to obtain lignin derivatives (CG-lignin: CGL). The chemical and physical properties of CGLs were investigated. Two-dimensional heteronuclear single-quantum coherence nuclear magnetic resonance analysis suggested that CGL possesses an α-CG-β-O-4 structure as CG is grafted onto the lignin structure. CGLs prepared at higher reaction temperatures exhibited lower molecular weights. The thermomechanical analysis of CGL revealed a glass transition temperature of 89-96 °C and a viscous thermal flow temperature of 134-155 °C.

Efficacy of Octanoic Acid and Lauric Arginate, Individually and in Combination, against Listeria monocytogenes in Domiati Cheese

Efficacy of Octanoic Acid and Lauric Arginate, Individually and in Combination, against Listeria monocytogenes in Domiati Cheese

Volatile compounds of Croatian cheese in a lamb skin sack prepared from a mixture of goat's and cow's milk

Volatile aroma compounds are one of the main parameters in consumer choice and acceptance of cheese. The traditional way of making cheese, still preserved in Croatia, is the anaerobic ripening of curds in a lamb or goat sack. Cheeses produced in such a way have a specific aroma. The objective of this study was to determine the volatile compounds of Croatian cheese in a lamb skin sack prepared from a mixture of goat's and cow's milk and relate them with the aroma of this traditional cheese. The cheese extracts were obtained by headspace solid-phase microextraction (HS-SPME) and ultrasonic solvent extraction (USE) and analysed by gas chromatography-mass spectrometry (GCMS). HS-SPME was performed at different temperatures (40, 50 and 60°C) using 2 fibres, divinylbenzene/carboxen/polydimethylsiloxane (DVB/CAR/PDMS) fibre and carboxen/ polydimethylsiloxane (CAR/PDMS) fibre. Increasing the extraction temperature resulted in higher sorption of fatty acids on both fibres. A total of 28 volatile compounds were identified in the cheese samples including 13 acids, 10 esters, 2 alcohols, 2 hydrocarbons and 1 ketone. Results revealed that fatty acids were the predominant group of volatile compounds in all samples. In samples obtained by HS-SPME, the most abundant were hexanoic, octanoic, butanoic, acetic and decanoic acid while (Z)-octadec-9-enoic, hexadecanoic, decanoic and tetradecanoic acid were the most abundant in the sample obtained by USE.

Influence of supplemental choline on milk yield, fatty acid profile, and weight changes in postpartum ewes and their offspring.

The most intensive nutritional requirements occur during milk production's peak. Ewe milk contains more protein and fat than cow milk. The nutritional factors significantly determine the composition. The liver undergoes high stress during lactation but is relieved by essential nutrients. Choline acts metabolically as a lipotrope. This compound functions in cell structure construction, maintenance, and acetylcholine synthesis. The animal nutrition industry provides choline from various sources, such as synthetic and natural kinds. This study evaluated the influence of two distinct choline sources on dairy ewes' peripartum and postpartum milk production, composition, and offspring growth. Twenty-four Rambouillet ewes, each weighing around 63.7 ± 1.7 kg, aged three with two previous births, spent 30-day pre-partum and post-partum in individual pens (2 × 2 m). They were given different experimental treatments 30 days before and after birth according to a randomized design; no choline (a), 4 g/day rumen-protected choline (RPC) (b), or 4 g/day thiocholine (c). Milk samples for milk composition and long-chain fatty acid (FA) analysis were taken every 30 days during milk collection. Significant differences (p < 0.05) in ewe body weight, lamb birth weight, and 30-day-old lamb body weight were observed at lambing and on day 30 of lactation due to choline treatment. Milk yield was significantly higher (1.57 kg/day) compared to the control (1.02 kg/day) and RPC (1.39 kg/day), due to the herbal choline source. There was no significant difference in the milk's protein, lactose, fat, non-fat solids, and total milk solids content between the treatments. Herbal choline lowers (p < 0.05) the concentrations of caproic, caprylic, capric, lauric, and myristic acids while boosting (p < 0.05) those of oleic and cis-11-eicosenoic acid, the changes influencing long-chain FA levels (p < 0.05). Providing choline from both sources to ewes enhanced milk production and body weight at lambing and on 30-day post-lambing. The herbal choline supplement altered short-chain milk FAs, while representative concentration pathways affected medium-chain ones.

Maximizing Lipid Extraction from Chlorella pyrenoidosa: A Study on the Effectiveness of Cell Disruption Techniques

Microalgae are one of the most eco-friendly and promising raw material sources for the production of biofuel. Proteins, carbohydrates, lipids and nucleic acid are the major components of algal biomass depending upon the species. The present study aimed to determine the lipid extraction and transesterification from Chlorella pyrenoidosa microalgae. Different methods and solvents are used for the disruption of the cell-wall and extraction of lipid content. The methodology involved ultrasonication, microwave digestion, Soxhlet extraction and autoclave while using different solvents as methanol, chloroform, hexane, dichloromethane and heptane. We compared various cell disruption methods to improve lipid extraction yields and the highest lipid extraction yields were obtained using Soxhlet method with hexane. The obtained lipid converted into fatty acid methyl esters (FAMEs) through transesterification process. The identification of fatty acid was compared by retention time and individual pattern of use from caprylic acid (C8:0) to lignoceric acid (C24:0) in form of methyl ester. The Soxhlet method using methanol and chloroform and FAME analysis showed a highest percentage of palmitic acid (C16:0) and lowest percentage of myristic acid (C14:1).

Влияние состава гидроксамовых кислот на показатели флотации перовскита.

On a sample of perovskite-bearing ore of the testing of reagents-collectors from the class of hydroxamic acids, differing in the structure of the hydrocarbon radical, was carried out. The reagents based on octanoic acid and acids of vegetable oils — coconut and tall oil — were considered. It is shown that in the alkaline pH range the rough flotation is more active, and a considerable amount of gangue minerals is transferred to the froth product. Strong attachment of the collector on all minerals determines low efficiency of re-cleaning operations in alkaline conditions. The optimum pH of flotation is pH = 6.2–6.5. Increase in the length of hydrocarbon radical above 10 carbon atoms leads to a significant decrease in the selectivity of the collector action. Reagents based on coconut and tallic acids actively float both perovskite and gangue minerals. Of the reagents considered, octylhydroxamic acid is characterized by the most optimal flotation properties and provides obtaining perovskite concentrate with TiO2 ~49–50 %.

Changes of bacterial communities and bile acid metabolism reveal the potential “intestine-hepatopancreas axis” in shrimp

The interaction between the gut and the liver plays a significant role in individual health and diseases. Mounting evidence supports that bile acids are important metabolites in the bidirectional communication between the gut and the liver. Most of the current studies on the “gut-liver axis” have focused on higher vertebrates, however, few was reported on lower invertebrates such as shrimp with an open circulatory system. Here, microbiomic and metabolomic analyses were conducted to investigate the bacterial composition and bile acid metabolism in intestine, hemolymph and hepatopancreas of Penaeus vannamei fed diets supplemented with octanoic acid and oleic acid. After six days of feeding, the bacterial composition in intestine, hemolymph and hepatopancreas changed at different stages, with significant increases in the relative abundance of several genera such as Pseudomonas and Rheinheimera in intestine and hepatopancreas. Notably, there was a more similar bacterial composition in intestine and hepatopancreas at the genus level, which indicated the close communication between shrimp intestine and hepatopancreas. Meanwhile, higher content of some bile acids such as lithocholic acid (LCA) and α-muricholic acid (α-MCA) in intestine and lower content of some bile acids such as taurohyocholic acids (THCA) and isolithocholic acid (IsoLCA) in hepatopancreas were detected. Furthermore, Spearman correlation analysis revealed a significant correlation between bacterial composition and bile acid metabolism in intestine and hepatopancreas. The microbial source tracking analysis showed that there was a high proportion of intestine and hepatopancreas bacterial community as the source of each other. Collectively, these results showed a strong crosstalk between shrimp intestine and hepatopancreas, which suggests a unique potential “intestine-hepatopancreas axis” in lower invertebrate shrimp with an open circulatory system. Our finding contributed to the understanding of the interplay between shrimp intestine and hepatopancreas in the view of microecology and provided new ideas for shrimp farming and disease control.

Harnessing therapeutic deep eutectic solvents in self-emulsifying systems to improve CBD delivery

In this study, Cannabidiol crystals (CBD) were used as a BCS class II model drug to generate a novel therapeutic deep eutectic solvent (THEDES) with easy preparation using caprylic acid (CA). The hydrogen bonding interaction was confirmed by different techniques such as FT-IR and NMR, resulting in a hydrophobic system suitable for liquid formulations. The CBD-based THEDES, combined with a specific mixture of surfactants and co-surfactants, successfully formed a self-emulsifying drug delivery system (SEDDS) that generated uniform nano-sized droplets once dispersed in water. Hence, the THEDES showed compatibility with the self-emulsifying approach, offering an alternative method to load drugs at their therapeutic dosage. Physical stability concerns regarding the unconventional oily phase were addressed through stress tests using multiple and dynamic light scattering, demonstrating the robustness of the system. In addition, the formulated SEDDS proved effective in protecting CBD from the harsh acidic gastric environment for up to 2 h at pH 1.2. Furthermore, in vitro studies have confirmed the safety of the formulation and the ability of CBD to permeate Caco-2 cells when formulated. This investigation highlights the potential incorporation of THEDES in lipid-based formulations like SEDDS, expanding the avenues for innovative oral drug delivery approaches.

Study of the experimental and microscopic mechanism of the removal of phenolic compounds from wastewater based on hydrophobic deep eutectic solvents

Dephenolisation has been a key environmental concern; therefore, separating and recycling phenolic compounds from wastewater can reduce environmental harm and the consumption of resources, respectively. Herein, we selected three hydrogen bond acceptors (HBAs) and three hydrogen bond donors (HBDs) with excellent industrial prospects, which were widely sourced, and combined them as nine hydrophobic deep eutectic solvents (HDESs) to perform liquid–liquid extraction (LLE) experiments and molecular simulation studies on model wastewaters containing phenol and catechol. The preliminary screening of HDESs was carried out by conducted with quantum chemical simulations using σ-Profiles, and the microscopic mechanism of the extraction process using HDESs was analysed through molecular dynamics (MD) simulations based on radial distribution function, spatial distribution function, mean square displacement and interaction energy results. Guided by the above molecular simulation results, experimental studies on LLE using HDESs were further conducted to determine the optimal conditions of the experimental operation, including the types and ratios of HBAs and HBDs, feed ratios between the HDESs and model wastewater, and extraction temperatures. The experimental studies revealed that the extraction efficiency of octanoic acid − geraniol (molar ratio 1:3) on a 0.6 % (mass concentration) phenol and catechol model wastewater at 25℃ could reach > 96 %. Moreover, the results were consistent with that of MD simulation. The above methodologies provide a reliable basis for resolving similar problems.

Antibiotic Activity of a Newly Discovered Aspergillus Species Isolated from Sewage Dump Site

Infectious agents causing diseases are becoming resistant to drugs produced to manage them. This has continued to spur scientific investigations for newer and better antibiotics to aid and/or replace existing ones. Soil samples were collected from sewage dump sites with the sole aim of isolating and screening fungi species for antibacterial substances using the cultural method. A newly discovered fungi species of Aspergillus was used to produce crude antibiotic, fractionated by column chromatography and tested on clinical isolates – Staphylococcus aureus, Escherichia coli, Klebsiella pneumoniae, Candida albicans and Pseudomonas aeruginosa. The result of zones of inhibition was 45 mm, 47 mm, 48 mm, 49 mm and 47 mm in order of listing of organisms. Gas chromatography mass spectrometry analysis of the fractionated extract revealed the following compounds as being responsible for the observed inhibition – methylene chloride, heptanoic acid, octanoic acid, methyl hydrogen phthalate, 2,4-di-tert-butylphenol, dodecanoic acid, z-10-tetradecen-1-ol acetate, tetradecanoic acid, 2-tetradecyloxy-ethanol, n-hexadecanoic acid, hexadecanamide, octadecenamide and octadecanamide. A cocktail of organic compounds – fatty acids and amides that displayed strong antimicrobial ability, if well tapped, hold a future in the development of new antibiotics.

Separation and Detection of Catechins and Epicatechins in Shanxi Aged Vinegar Using Solid-Phase Extraction and Hydrophobic Deep Eutectic Solvents Combined with HPLC.

This research presents a new, eco-friendly, and swift method combining solid-phase extraction and hydrophobic deep eutectic solvents (DES) with high-performance liquid chromatography (SPE-DES-HPLC) for extracting and quantifying catechin and epicatechin in Shanxi aged vinegar (SAV). The parameters, such as the elution solvent type, the XAD-2 macroporous resin dosage, the DES ratio, the DES volume, the adsorption time, and the desorption time, were optimized via a one-way experiment. A central composite design using the Box-Behnken methodology was employed to investigate the effects of various factors, including 17 experimental runs and the construction of three-dimensional response surface plots to identify the optimal conditions. The results show that the optimal conditions were an HDES (tetraethylammonium chloride and octanoic acid) ratio of 1:3, an XAD-2 macroporous resin dosage of 188 mg, and an adsorption time of 11 min. Under these optimal conditions, the coefficients of determination of the method were greater than or equal to 0.9917, the precision was less than 5%, and the recoveries ranged from 98.8% to 118.8%. The environmentally friendly nature of the analytical process and sample preparation was assessed via the Analytical Eco-Scale and AGREE, demonstrating that this method is a practical and eco-friendly alternative to conventional determination techniques. In summary, this innovative approach offers a solid foundation for the assessment of flavanol compounds present in SAV samples.

Oxidative rearrangement of enaminones to α-keto amides in the presence of KI, TBHP and octanoic acid

A novel method for the direct conversion of enaminones to α-keto amides has been developed. This transformation involves an oxidative rearrangement of enaminones under free radical conditions. In the presence of KI, TBHP and octanoic acid, a series of α-keto amides were obtained in moderate to excellent yields. This reaction demonstrates excellent functional group compatibility, utilizes readily available materials, and is easy to perform. Additionally, when o-hydroxyphenyl enaminone was utilized as the substrate, the reaction yielded 3-iodochromone in a high yield.

Natural deep eutectic solvent-supported exfoliated graphite nanoplatelet-based electrochemical sensor for the determination of tyramine in fermented beverages

A novel electrochemical sensor was developed for the determination of tyramine. The sensor was constructed by modifying the surface of a glassy carbon electrode (GCE) with a film composed of exfoliated graphite nanoplatelets (xGnPs) dispersed in a natural deep eutectic solvent (NADES). The NADES was prepared by simply mixing equimolar amounts of caprylic acid and menthol and heating at 80 °C for 30 minutes. Characterization studies confirmed the formation of a NADES through the attenuated total reflectance-Fourier transform infrared spectroscopy technique, while transmission electron microscopy demonstrated the ability of the NADES to disperse the xGnPs. Electrochemical impedance spectroscopy data showed that the modified sensor exhibited lower resistivity than the unmodified electrode. By optimizing the parameters of square wave voltammetry and experimental conditions to obtain the highest peak current values for tyramine oxidation, a calibration curve was constructed in a 0.1 mol L−1 phosphate buffer (pH 7.0), obtaining detection and quantification limits of 0.06 and 0.20 mg L−1, respectively. Finally, the sensor was successfully applied to the determination of tyramine in fermented milk, beer, and non-alcoholic beer samples, with satisfactory recovery data.

Characterization and drug solubilization of arginine-based ionic liquids – Impact of counterions and stoichiometry

Ionic liquids (ILs) exhibit very diverse physicochemical properties, such as non-volatility, stability, and miscibility, which render them excellent candidate excipients for multi-purpose use. Six novel arginine (Arg)-based ILs were obtained using a one-step ultrasound method. Salt formation was confirmed by Fourier-transform infrared (FTIR), Raman, and nuclear magnetic resonance (NMR) spectroscopies. Moreover, the effects of anions and molar ratio on the molecular states and thermal properties of Arg-ILs were investigated. In addition, the solubilization of drugs with different pKa and LogP values was attempted using Arg-ILs consisting of asparagine, proline, octanoic acid, and malic acid, respectively, and a comparative study was performed. Furthermore, the interaction mode between the drugs and ILs was determined by FTIR and Raman spectroscopy. Presumably, partial interaction between the component of ILs and drugs such as ofloxacin and valsartan occurred, whereas flurbiprofen and isosorbide mononitrate were dispersed in the viscous IL. The development of strategies for the application of ILs as solubilizers or carriers of active pharmaceutical ingredients is an extremely promising and wide avenue of research.

Almond fixed oil from Syagrus coronata (Mart.) Becc. has antinociceptive and anti-inflammatory potential, without showing oral toxicity in mice

Ethnopharmacological relevanceSyagrus coronata, a palm tree found in northeastern Brazil, popularly known as licuri, has socioeconomic importance for the production of vegetable oil rich in fatty acids with nutritional and pharmacological effects. Licuri oil is used in traditional medicine to treat inflammation, wound healing, mycosis, back discomfort, eye irritation, and other conditions. Aim of the studyThe study aimed to evaluate the antinociceptive, anti-inflammatory, and antipyretic effects of treatment with Syagrus coronata fixed oil (ScFO), as well as to determine the safety of use in mice. Materials and methodsInitially, the chemical characterization was performed by gas chromatography-mass spectrometry. Acute single-dose oral toxicity was evaluated in mice at a dose of 2000 mg/kg. Antinociceptive activity was evaluated through abdominal writhing, formalin, and tail dipping tests, and the anti-inflammatory potential was evaluated through the model of acute inflammation of ear edema, peritonitis, and fever at concentrations of 25, 50, and 100 mg/kg from ScFO. ResultsIn the chemical analysis of ScFO, lauric (43.64%), caprylic (11.7%), and capric (7.2%) acids were detected as major. No mortality or behavioral abnormalities in the mice were evidenced over the 14 days of observation in the acute toxicity test. ScFO treatment decreased abdominal writhing by 27.07, 28.23, and 51.78% at 25, 50, and 100 mg/kg. ScFO demonstrated central and peripheral action in the formalin test, possibly via opioidergic and muscarinic systems. In the tail dipping test, ScFO showed action from the first hour after treatment at all concentrations. ScFO (100 mg/kg) reduced ear edema by 63.76% and leukocyte and neutrophil migration and IL-1β and TNF-α production in the peritonitis test. ConclusionMice treated with ScFO had a reduction in fever after 60 min at all concentrations regardless of dose. Therefore, the fixed oil of S. coronata has the potential for the development of new pharmaceutical formulations for the treatment of pain, inflammation, and fever.

Semi‐continuous non‐sterile production of medium chain‐length polyhydroxyalkanoates from fatty acids

AbstractMedium chain‐length polyhydroxyalkanoates (mcl‐PHAs) are efficiently synthesized from fatty acids. It was hypothesized that under non‐axenic conditions, the anti‐microbial properties of fatty acids would reduce growth of microbial competitors and allow Pseudomonas putida LS46 to dominate the population resulting in non‐sterile mcl‐PHA production. Non‐sterile batch and fed‐batch cultures produced similar final mcl‐PHA content, monomer composition, and productivity during 24–27 h cultivations when compared to sterile control cultures for initial octanoic acid concentrations ranging from 5 to 40 mM at an initial pH of 6.5. In the absence of a P. putida inoculum, growth was eventually observed in non‐sterile medium after a lag period of up to 120 h, the length of which was dependent on the octanoic acid concentration. The efficacy of prolonged non‐sterile cultivation was tested using a sequential batch reactor (SBR). After 28 days (672 h), 1.62 g L−1 of total biomass was observed, of which the mcl‐PHA content was 47%. This resulted in a PHA titer of 0.77 g L−1, and a volumetric PHA productivity of 32 mg L−1 h−1. The polymer composition remained stable throughout at 87.0 ± 2.7% C8 monomers, and short‐chain length (scl‐) monomers were not detected. This study is the first of its kind to report that purely mcl‐PHAs were produced after prolonged periods in a non‐sterile environment and demonstrate that medium chain‐length fatty acids exert a strong selective pressure toward organisms that synthesize mcl‐PHA. This suggests an opportunity for mcl‐PHA production in open continuous cultivation, which could reduce both fixed and operating costs.

STUDY OF THE INHIBITORY EFFECTS OF VITAMIN E DERIVATIVES ON MITOCHONDRIAL COMPLEX II SUBUNIT USING MOLECULAR DOCKING

Objective: The goal of this study was to create vitamin E derivatives and explore their potential anticancer properties using a computational approach. Methods: The Steglich method was used for the synthesis of the vitamin E-fatty acid (pentanoic acid, heptanoic acid, and octanoic acid) derivatives, with N,N'-dicyclohexylcarbodiimide (DCC) and 4-dimethylaminopyridine (DMAP) as the catalysts. The structure of the synthesized products was determined by ultraviolet-visible (UV-Vis) spectroscopy, fourier transform infrared (FTIR) spectroscopy, and liquid chromatography-mass spectrometry (LC-MS). Molecular docking was carried out on the succinate dehydrogenase (SDH) enzyme using AutoDockTools. Results: α–Tocopherol pentanoate (α–TP), α–tocopherol heptanoate (α–TH), and α–tocopherol octanoate (α–TO) were the three vitamin E derivatives synthesized in this study. Based on the results of molecular docking, the novel compounds (α–TP, α–TH, and α–TO) generated bond energies of-10.57,-9.61, and-9.20 kcal/mol, respectively. Conclusion: All newly synthesized compounds exhibited lower binding affinity values than α–tocopherol (α–T). This confirms that these compounds might not provide greater advantages than α-tocopherol in terms of inhibitory effects on mitochondrial complex II (CII).

PSIII-2 Evaluation of medium-chain fatty acids on just-weaned piglet performance and diarrhea scores: A nursery trial

Abstract Weaning is one of the most stressful events for commercial pigs. The transition from mother’s milk (animal proteins) to a solid diet based on plant proteins, the reduction in lactose intake and the decline in HCl secretion by the digestive system of the piglet result in a sudden and significant increase in stomach pH as well as an increased risk of post-weaning diarrhea. The aim of this trial was to evaluate whether the use of a blend of medium-chain fatty acids (MCFAs) on top-off conventional nursery diets would improve zootechnical performance and intestinal problems in just-weaned piglets. Piglets [n = 624, 21-d of age, 6.5 kg body weight (BW), (♂ Fast Duroc x ♀ Fast 275)] were housed in 26 pens of an experimental nursery. Each pen (24 pigs/pen, with a starting density of 3.0 ft2/pig) was equipped with a height-adjustable water sucker, a water bowl and fitted with a single feeder-bin. Females and males were allocated to each pen, according to 3 BW categories (heavy, medium, and light). During a 46-d period of trial, the piglets (13 replicated pens per treatment) were allotted to a conventional 5 phases feeding program with 2 kg/MT of chlortetracycline (22%) and 400 g/MT of tiamuline (1.78%; CON). These basal diets contained 2,500 ppm Zn in Phases #1, 2, and only 2,000 ppm Zn in phase #3. Phases #1 to 3 were also supplemented with Ca-butyrate (1 kg/MT) and a blend of protected acidifiers (1 kg/MT). The treated group consisted to the basal diet (CON) supplemented with a blend of medium-chain fatty acids (MCFAs) at 1.0 or 0.75 kg/MT for Phases #1, 2,3 and Phases #4, 5, respectively and supplying of a proprietary blend of caprylic, capric, and lauric acids. Daily feed consumption, weekly pig pen BW, dead and removed pigs and daily diarrhea evaluation index were completed. Data are analyzed by an ANOVA model including treatment and pen as fixed and random effects, respectively. Pairwise comparisons were completed with a Chi-square test. The overall results are presented in Table 1. At the end of wk 2 and 3, animals receiving MCFAs had a better average daily gain (ADG; P &amp;lt; 0.05) than CON. Therefore, at wk 2, 3 and 4, MCFAs animals BW were heavier than CON ones (P &amp;lt; 0.05). Average daily feed intake (ADFI) was not significantly different for the overall duration of the trial (P &amp;gt; 0.05). However, at weeks 2 and 3, MCFAs piglets had a greater ADFI than CON ones (P &amp;lt; 0.05). The daily diarrhea index of the MCFAs group was less than CON at wk 3 (P &amp;lt; 0.05). In this trial, the significant improvement of diarrhea index on just-weaned MCFAs treated piglets could explain the significant better growth during the first 3 wk of nursery.

Abstract PO5-08-06: Metabolic shift to serine pathway induced by lipids confers oncogenic properties in non-transformed breast cells

Abstract Introduction. Oncogenic factors that are local/in-breast are of great interest as they may be more specifically targetable for breast cancer prevention than systemic factors. We have identified a lipid metabolism gene signature that is enriched in breast tissue at risk for estrogen negative breast cancer (ER- BC). Utilizing the medium chain fatty acid Octanoic acid (OA) to probe lipid metabolism in non-transformed breast epithelial cells, we observed increased flux through several metabolic reactions and altered histone methylation with consequent changes in gene expression (e.g. neural genes). Neuronal signaling and regulatory circuits are observed in cancer cells of multiple origins, not just ones with ontological relationships to neurons. We hypothesize that the first and rate limiting step in the de novo serine pathway, which is catalyzed by Phosphoglycerate Dehydrogenase (PHGDH) is key to these observations. In the forward direction, PHGDH participates in the serine, one-carbon, glycine (SOG) and methionine pathways that produce the methyl donor S-adenosylmethionine (SAM) and in the reverse direction produces the oncometabolite 2-Hydroxyglycerate (2-HG). Methods. Non-transformed MCF-10A cells exposed to OA were utilized for U13C-glucose tracing. SAM and 2-HG concentrations following treatment with OA ± PHGDH inhibitor were measured by liquid chromatography. CUT&amp;RUN for H3K4me3 was performed and genes affected by OA (PMID: 28263391) were compared with OA-responsive peaks. Single cell RNA-sequencing was carried out using breast microstructures derived from reduction mammoplasty tissue exposed to vehicle or OA. Microstructures were dissociated into single cells and sequenced using the 10x Genomics platform. The digital expression matrix file containing UMIs were analyzed with Seurat. Alkaline comet assay was performed to detect DNA breaks. Results. U13C-glucose tracing in presence of OA revealed that one-carbon-THF was redirected to the methionine cycle increasing flux to methylation. Concentrations of SAM and 2-HG increased after 15- and 30-min OA exposure, respectively; PHGDH inhibitor blocked these increases. H3K4me3 CUT&amp;RUN revealed 661 differential peaks (FDR &amp;lt; 0.05) comparing OA to control. 73% of H3K4me3 OA-associated peaks were in regulatory regions of OA-induced genes (FDR &amp;lt; 0.01), these genes are involved in neural pathways, EMT and ER- BC. Motif analysis revealed an overrepresentation of binding sites for transcription factors ATF3/4 (p &amp;lt; 0.05), which are regulators of the serine pathway. Single cell RNA-sequencing revealed OA not only affected the distribution of cell subpopulations but also modulated the expression of many genes within each subcluster. The percentage of luminal progenitor subcluster 3 increased upon OA from less than 1% to about 13%. Within basal subcluster 3, OA drives the expression of ATF3, along with two of the enzymes in the de novo serine pathway: PHGDH and PSAT1. Alkaline comet assay showed DNA breaks in OA- and control 2-HG- treated cells. Conclusions. Metabolism of OA in preference to glucose and glutamine results in a metabolic shift toward the serine pathway increasing the production of SAM and 2-HG, with implications for oncogenesis: 1. SAM production results in epigenetic fostered plasticity leading to reprogramming/selecting cells that express genes consistent with a neural/neural crest-like state. These co-opted neuronal regulatory mechanisms can make critical contributions to the acquired functional capabilities that drive cancer development. 2. 2-HG exposure results in appearance of DNA breaks, which are likely consequent to the inhibition of the alpha-ketoglutarate-dependent dioxygenases KDM 4A/B by 2-HG. Their catalytic activity is required for homologous recombination repair; inhibition results in metabolic “BRCAness”. Citation Format: Mariana Bustamante Eduardo, Gannon Cottone, Shiyu Liu, Maria Paula Zappia, Elizaveta V. Benevolenskaya, Abul Bashar Mir Md. Khademul Islam, Maxim V. Frolov, Seema Khan, Susan Clare. Metabolic shift to serine pathway induced by lipids confers oncogenic properties in non-transformed breast cells [abstract]. In: Proceedings of the 2023 San Antonio Breast Cancer Symposium; 2023 Dec 5-9; San Antonio, TX. Philadelphia (PA): AACR; Cancer Res 2024;84(9 Suppl):Abstract nr PO5-08-06.

Gas chromatography-mass spectrometry and non-targeted metabolomics analysis reveals the flavor and nutritional metabolic differences of cow's milk fermented by Lactiplantibacillus plantarum with different phenotypic

This study comprehensively evaluated the effects of Lactiplantibacillus plantarum T1 and CSK (ropy and non-ropy phenotypes), on flavour, and nutrient metabolites of fermented milks using gas chromatography-mass spectrometry and non-targeted metabolomics. The microrheological analysis showed that the protein gelation time of CSK fermented milk was earlier (5.2 h) than that of T1 (7.0 h), while the fermented milk by T1 had higher elastic modulus. Fermentation by both strains significantly enhanced the antioxidant activity of the fermented milk, including scavenging capabilities against ABTS, DPPH, and hydroxyl radicals. Meanwhile, fermentation by two strains produced various volatile flavor compounds (hexanoic acid, caprylic acid, capric acid, nonanal, decanal, 2-heptanone and 2-nonanone, etc.), and L. plantarum CSK displayed more stronger acid production capacity. In addition, a total of 397 shared metabolites and 81 unique metabolites were identified by untargeted metabolomics analysis of the two groups of fermented milks, mainly including lipids and lipid-like molecules (66, 27.27%), organic heterocyclic compounds (40, 16.53%), phenylketones and polyketones (23, 9.5%), and organic acids and their derivatives (49, 20.25%). Furthermore, both strains significantly elevated the amino acid nutritional levels in the fermented milk, conferred an abundance of active metabolites such as niacin and nicotinamide. During the fermentation, L. plantarum CSK notably produced antioxidant fumaric acid and exhibited higher fatty acid metabolism compared to L. plantarum T1. Overall, this study provides some practical basis for the development of fermented cow's milk with good antioxidant activity and high nutritional quality using different phenotypes of L. plantarum.