Here is a list of discoveries made by independent research groups using the SIRIUS software framework to enhance their metabolomics data analysis.
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These findings were neither conducted nor financed by our company. Findings are listed in random order.
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Novel method to study ozonation in water treatment plants to remove cyanobacterial toxins from drinking water.
Rougé et al. | Environ Sci Technol (2024)
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Decreased concentration of two carotenoids after UV filter explosion might be indicative of an alteration in the photosynthetic capacity of corals.
Clergeaud et al. | Metabolites (2023)
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Monophasic extraction with 400 nm beads and 60-minute on-bead protein digestion is the most reproducible, efficient, and cost-effective solution for in-house multiomics (metabolites, lipids, proteins) workflows in HepG2 cells.
Arnst et al. | Analytical and Bioanalytical Chemistry (2025)
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Multidimensional optimization of cell morphology increases the reproducibility of microbial metabolic footprints by 50% across different cultivation systems.
Lindig et al. | Scientific Reports (2026)
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SIRIUS compound classification reveals how maternal and environmental factors shape infant gut metabolism.
Kvitne et al. | Cell Host Microbe (2025)
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Multi-omic analysis reveals PHACTR1 as a master regulator of cell cycle, iron metabolism, and mitochondrial bioenergetics in human vascular cells.
Wolhuter et al. | Communications Biology (2026)
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Homologous series of previously overlooked polymerization byproducts detected near fluoropolymer production plant.
Dalmijn et al. | Environ Sci Technol (2025)
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Innovative approach to prioritise chemical profiling over exhaustive identification for analysing and comparing biomes.
Peets et al. | bioRxiv (2025)
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Decoding the crucial role of the gut microbiome in altering the chemical structure and efficacy of GPCR drugs.
Wu. et al. | Nat Chem (2025)
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Ash trees resistant to ash dieback could also help protect against emerald ash borer infestations.
Gossner et al. | New Phytologist (2023)
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Hybrid diversity in Baccharis is driven by secondary metabolites, while primary metabolism remains conserved.
Zafra-Delgado et al. | Plant J. (2025)
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Metabolomic profiles of three Ficus species to investigate phytochemistry, chemotaxonomy and potential medical use.
Bakry et al. | Journal of Pharmaceutical and Biomedical Analysis (2023)
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Climate and island residence time influence plant specialised chemical diversity.
Moreira et al. | Global Ecology and Biogeography (2025)
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Antioxidant-rich extract from Ceratonia siliqua pods with potential for a biocompatible topical therapy.
De Luca et al. | Antioxidants (2023)
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Lipophilic diterpenoids and retinoids in seaweed reduce rumen methane production by 30% while shifting fermentation patterns.
Curtasu et al. | Algal Research (2025)
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18 novel hop-acid analogues identified in brewery waste revealing its high antioxidant potential.
Scognamiglio et al. | Food Chemistry (2026)
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Microbiome of eelgrass produces broad-spectrum antibiotics with potent activity against waterborne pathogens.
Tasdemir et al. | Sci Total Environ (2024)
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Cell surface glycans and membrane lipids are influential drivers of adaptation to heat stress in rice coral hosting thermosensitive and thermotolerant symbionts.
Tortorelli et al. | ISME J (2025)
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155 new brown carbon chromophores identified in aqueous-phase reactions of α-dicarbonyls with ammonium or amines.
Yang et al. | Environ Sci Technol (2023)
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Marine prokaryotes hold vast potential for discovering new drug candidates.
Wei et al. | Microbiome (2023)
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Novel urinary biomarkers to distinguish giant panda pregnancy from pseudopregnancy as early as the first weeks of embryonic development.
Cools et al. | Scientific Reports (2025)
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MCheM chemical labeling provides structural information to constrain the molecular structure search space in SIRIUS and boost annotation accuracy.
Vitale et al. | Nature Communications (2025)
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Honey ia a bio-indicator for flame retardants in air.
Leung et al | Chemosphere (2023)
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Detailing the metabolic basis for the production of sesquiterpenoids in the medicinal mushroom Sanghuangporus.
Cho et al. | BMC Genomics (2025)
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Extremophilic fungi dissolve Martian-like hematite using a cocktail of siderophores and organic acids, creating stable chemical biosignatures detectable by future planetary missions.
dos Santos et al. | JACS Au (2026)
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New protocol to identify structurally related impurities in pesticides for assessing their environmental impact and risks.
Li et al. | Microchemical Journal (2023)
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Common and previously unreported parabens and plastic-related contaminants identified in human milk.
Chi et al. | Chemosphere 2025
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Significant differences in metabolite abundance and composition among microalgae Spirulina, Chlorella, and Amphora.
Hegazi et al. | Sci Rep (2024).
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Identification of 100 light-absorbing brown carbon molecules, 33 of which have never been reported before.
Xing et al. | JGR Atmospheres (2023)
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Tracing thousands of neuroactive metabolites from plant to pill: Vertigoheel retains characteristic constituents from its natural sources in all tested formulations.
Dunkel et al. | International Journal of Molecular Sciences (2026)
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Diurnal carbohydrate and metabolite production in sugarcane and energy-cane reveals differences in growth strategies.
Silva et al. | Industrial Crops and Products (2023)
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Selective cytotoxic activity of dinoflagellate Amphidinium eilatiense extracts against cancer cells is linked to a rich chemical diversity.
Osorio-Ramírez et al. | Toxins (2025)
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Strong interdependence and metabolic rewiring of the algal partner in radiolaria photosymbiosis, where the host extensively transforms algal metabolites and the algal cell membrane is significantly rearranged.
Nikitashina et al. | ISME J (2025)
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Plants tailor their defenses based on the presence of herbivores rather than herbivore identity.
Mezzomo et al. | Ecol Evol (2023)
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False daisies contain anti-inflammatory, antioxidant and anti-collagenase ingredients with anti-aging potential .
Le Cabec et al. | S. Afr J Bot (2023)
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Highly halogenated compounds are potential contributors to the high antibacterial activity in tetrasporophyte stage of red alga Asparagopsis armata.
Parchemin et al. | Marine Drugs (2023)
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Non-targeted approach uncovers plastic-related contaminants in liquor products, including three unanticipated compounds.
He et al. | Food Control (2024)
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The methanogenic archaeon Methanosarcina barkeri can reduce naturally occurring iron oxides in aquatic sediments' methanogenic zones.
Eliani-Russak et al. | Front Microbiol (2023)
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Arctic microbes eat fresh plants instead of old soil—keeping ancient carbon safely stored.
Ayala-Ortiz et al. | Front Mol Biosci. (2025)
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Previously undetected chemicals with potential estrogenic activity in drinking water from regions with high breast cancer incidence.
Black et al. | Environ Sci Technol. (2025)
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In ruminants, rutin is first degraded to quercetin by rumen microbes, which is then biotransformed into various phenolic compounds that ultimately result in 4-methylcatechol-1-sulfate and isorhamnetin-glucuronide sulfate as the main metabolites found in the blood
Aldian et al. | Journal of Animal Scienc (2025)
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Rust infection in common beans enriched metabolomic pathways, biosynthesis of secondary metabolites, protein processing in the endoplasmic reticulum, and purine metabolism among others.
Makhumbila et al. | BMC Plant Biol (2025)
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Environmental fate of formulation ingredients in commercial pesticides.
Ghosson et al. | Journal of Mass Spectrometry (2023)
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Annotating nitazine (high-potency synthetic opioid) metabolites and major markers for enhanced detection.
Magny et al. | Metabolites (2025)
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Ketamine distribution in the brain improves understanding on how ketamine traverses the blood-brain barrier.
Vallianatou et al. | ACS Chem Neurosci (2024)
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Microbial biocontrol agents lead to major metabolic re-programming in fungi
Fernando Devasahayam et al. | J Plant Dis Prot (2024)
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Metabolite from actinobacteria strain from Egyptian soil is a promising candidate as a multidrug efflux pump inhibitor.
Hamed et al. | Metabolites (2023)
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Plant extracts as reducing agents for the environmentally friendly synthesis of silver nanoparticles.
Salgado et al. | Surfaces and Interfaces (2023)
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Highly specific "Gold" markers in 14 yellow dye plants enable the precise botanical authentication of ancient textiles.
Mas-Normand et al. | Microchemical Journal (2025)
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Drug metabolites and drugrelated impurities in human plasma identified without reference standards and a priori knowledge of first- and second-pass drug metabolism.
Singh et al. | Exposome (2026)
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The antimicrobial agent trimethoprim influences chemical interactions between cystic fibrosis pathogens affecting virulence factors.
Jin et al. | CS Chem Biol (2025)
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Increase in released greenhouse gases in Northern peatlands is likely due to changes in metabolic activity rather than microbial community changes.
Duchesneau et al. | Nat Commun (2025)
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Phosphorous limitation led to the creation of new types of lipids in Desulfatibacillum alkenivorans as survival strategy.
Ding et al. | PNAs (2024)
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Metabolites from citrus juices improve herbal therapy against paracetamol-induced liver toxicity.
Shalaby et al. | ACS Omega (2023)
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Kakadu plum extracts shows antiproliferative effects against MCF7 breast adenocarcinoma cells.
Dissanayake et al. | Food Bioscience (2023)
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The microbial diversity and metabolite production of the tropical ascidian Eudistoma vannamei reveals its role as a holobiont rich in secondary metabolites.
Bauermeister et al. | Mar Environ Res (2024)
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Metabolomics study of black apples revealed the chemical diversity of fungus-produced secondary metabolites in black apple microbiomes.
Cowled et al. | Appl Environ Microbiol (2024)
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Mycobacteria use the MelH protein to neutralize toxic lipids, allowing them to survive in the host.
Chakraborti et al. | ACS Omega. (2025)
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Metabolome composition of mature and immature seeds from different cereal and leguminous plants.
Saied et al. | Food Chem (2023)
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Zinc anodes, used to protect against corrosion in marine environments, affect the metabolism of oysters.
Imbert-Auvray et al. | Metabolites (2023)
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Interplay between dietary patterns, plasma metabolites, and colorectal cancer risk
Bodén et al. | Sci Rep (2024)
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Biopesticide 6-PP is produced via the polyketide biosynthesis pathway in Trichoderma fungi.
Flatschacher et al. | Microb Cell Fact (2025)
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Endophytic bacteria aid in controlling fusarium wilt disease and enhancing tomato plant growth through bioactive secondary metabolites.
Sriwati et al. | Physiological and Molecular Plant Pathology (2023)
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New degradation metabolites and potential metabolic pathway of novel designer drug O-PCE identified.
Magny et al. | J Pharm Biomed Anal (2024)
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32-44% of polar chemicals in offshore oil discharges are persistent, in particular N-substituted aromatic ring structures.
Møller et al. | Environ Sci Technol (2025)
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Green solvents can effectively extract diverse bioactive compounds from lemon balm leaves.
Spaggiari et al. | Advances in Sample Preparation (2025)
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Potent antidiabetic compounds in cluster fig (Ficus racemosa) fruit extracts.
Suil et al. | LWT (2025)
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Microbial decomposition of human cadavers as data basis for a forensic tool to predict time since death.
Burcham et al. | Nat Microbiol (2024)
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Microtiter plate cultivation systems provide a robust platform for discovering novel bacterial natural products by enabling broader access to chemical diversity.
Lindig et al. | Biotechnol Bioeng (2025)
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DX protein enhances expression of specialized metabolic pathways in the Streptomyces genomes and might lead to the discovery of novel bioactive molecules.
Apel et al. | Front Cell Dev Biol (2023)
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Metabolites identified from A. absinthium extracts support the traditional use for stomach problems.
Boeing et al. | J Ethnopharmacol (2023)
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Different paths to chemical diversity in highland and lowland willow species.
Volf et al. | Ecology Letters (2023)
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Anti-viral compounds in Caesalpinia mimosoides help to inhibit influenza by targeting two critical viral proteins.
Klamrak et al. | Sci Rep (2025)
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White adipose tissue plays a crucial role in regulating metabolism throughout the hibernation cycle.
Heinis et al. | Front Physiol (2023)
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Deep-sea black yeasts adapt to extreme salinity by remodeling membranes and accumulating plant-like amino acids and novel aminocyclitols to maintain osmotic balance.
Camacho-López et al. | Communications Biology (2026)
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Neuroprotective effects of secondary metabolites in mulberry plant extracts on Alzheimer’s Disease.
Hegazi et al | Food Funct (2014)
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Identify and link microbial metabolites to their producers with microbeMASST and SIRIUS.
Zuffa et al. | Nat Microbiol (2024)
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Chemical composition and anti-inflammatory properties of prickly goldenfleece could be a valuable source of bioactive compounds for food and health applications.
Saber et al. | Food Chemistry (2023)
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Molecular explanation for the longer time needed to establish the low-compatibility interaction between the ectomycorrhizal fungus Tricholoma vaccinum and pine.
Ezediokpu et al. | Front Microbiol (2023)
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Upcycling by-products: Coffee waste is a rich source of hydrophilic antioxidants and lipophilic sterols.
Soontontaweesub et al. | Computational and Structural Biotechnology Journal (2025)
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Specific metabolites identified as potential selection traits to improve Fusarium resistance in maize.
Cao et al. | Front Plant Sci (2023)
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Domesticated common bean varieties exhibit reduced metabolic diversity and specialization compared to their wild counterparts.
de Souza et al. | Plant J (2023)
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Defense syndromes in willows result from a complex interplay of selection pressures and trade-offs.
Leong et al. | Oecologia (2024)
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48 antioxidation active metabolites identified in Ginger.
Wang et al. | Food Chem (2023)
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Key chemical cues for designing a biomaterial that mimics the chemical landscape of healthy reefs to enhance coral settlement.
Kundu et al. | Trends Biotechnol (2025)
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Glacial rivers deliver highly bioavailable aliphatic matter to Arctic fjords, which is rapidly transformed or diluted as it enters the marine carbon cycle.
Mostovaya et al. | Journal of Geophysical Research: Biogeosciences (2025)
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Grapevine root extracts rich in oligostilbenes show high antifungal activity against fungal plant pathogen that affects cereal crops.
Tardif et al. | J. Agric. Food Chem. (2024)
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Brazilian iron-cave bacteria produce rare cyclopeptides with significant cytotoxic activity against cancer cells.
Kato et al. | Chemistry & Biodiversity (2026)
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Nutritional components of coconut flesh.
Guo et al. | Metabolites (2023)
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Understanding the dynamics of thawing permafrost and its impact on climate change is essential for developing strategies to cope with its effects.
McGivern et al. | Nat Microbiol (2024)
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Potential to enhance the skin health: changes in the skin metabolome more pronounced than in microbial composition.
Li et al | Front Med (2023)
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Link between microbial community structure and chemical profile of the surface metabolome in Saccharina latissima.
Adouane et al. | FEMS Microbiology Ecology (2025)
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New chlorophylls in coastal halophyte plant that exhibit potent, selective toxicity against colorectal cancer cells.
Gu et al. | RSC Adv (2025)
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Major antihypertensive constituents of Kinkéliba decoction confirmed through high-resolution metabolite annotation.
Vuadens et al. | Frontiers in Natural Products (2026)
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Identification of fenozan in wastewater as a key biomarker for human exposure to synthetic phenolic antioxidants.
Meyer et al. | Environ Int. (2025)
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Metabolites altered up to 14 years before diagnosis enable the prediction of Crohn’s disease with high accuracy years before symptoms appear.
Lemser et al. | Clinical Gastroenterology and Hepatology (2026)
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Metabolites of Aspergillus niveus are promising leads for developing new potent cholinesterase inhibitors against Alzheimer's disease.
Hamed et al. | Molecules (2023)
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Oscillibacter species in the gut microbiome may help lower cholesterol levels, potentially benefiting heart health.
Li et al. | Cell (2024)
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37 unique secondary metabolites identified in the metabolome of the invasive Guinea grass.
Morrison et al. | Ecosphere (2023)
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Cortisol, sumatriptan, and glutamine are crucial metabolites associated with the treatment of migraines with triptans.
Kogelman et al. | Sci Rep (2023)
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33 emerging contaminants identified in global tap water — 25 for the first time.
Muñiz-Bustamante et al. | Environmental Pollution (2026)
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Stable isotope labeling serves as a detection strategy to distinguish biologically relevant features from background signals.
Favilli et al. | Anal Bioanal Chem (2023)
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Previously overlooked toxic drivers identified in the air, including 2-indanone and 2-vinylpyridine.
Sunyer-Caldú et al. | Environmental Science & Technology (2026)
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The International Space Station has a unique and extreme microbial and chemical environment with distinct signatures within each module.
Salido et al. | Cell (2025)
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New ecdysteroids with potential skin aging therapeutic benefits discovered in the Korean plant Ajuga spectabilis.
Park et al. | ACS Omega (2023)
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Biotransformation of levofloxacin in wastewater by basidiomycete fungal strains leads to decreased antibiotic activity.
Ayed et al. | Ecotoxicology and Environmental Safety (2024)
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Eccrine finger sweat analysis reveals healthy lifestyle shifts in children with overweight after long-term nutritional education and lifestyle intervention.
Wolf et al. | iScience (2025)
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Annotation of 80% of the previously unknown metabolite features of tall wheatgrass root exudates.
Couvillion et al. | Soil Biology and Biochemistry (2025)
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Method to reveal the chemical potential of marine microorganisms based on microbial extracts.
Loarer et al. | Microorganisms (2023)
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Multi-omics reveals coating-specific signatures—like ceramides and glucosinolates—that govern biofilm resilience.
Ferré et al. | Sci Rep (2026)
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Biochemical pathways and compounds of the unique stress response of liverworts with potential cytotoxicity against human cancer cell lines.
Blatt-Janmaat et al. | Metabolomics (2023)
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Chemical pollination syndrome: bird-syndrome nectar shows convergence on chemical traits distinct from bee-syndrome nectar.
MacNeill et al. | New Phytologist (2025)
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Blechnic acid B: novel lignan discovered in ferns of the Blechnaceae family.
Ufland et al. | Plant Biology (2025)
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Robust biomarker candidate identified for standardizing exhaled breath sample collection.
Schaar et al. | Analytica Chimica Acta (2025)
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Potential new UV-protective amino acids identified in Baltic flatfish eyes.
Hammerle et al. | Frontiers in Marine Science (2025)
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FODMAPs are influencing health-positive metabolites in plasma of irritable bowel syndrome patients.
Nordin et al. | Am J Physiol Regul Integr Comp Physiol (2023)
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Potentially allergenic transformation products of tattoo pigments identified in new online-LC-EC-MS approach.
Wolf et al. | Anal Bioanal Chem (2025)
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Testing different reversed-phase LC columns and mobile phase modifiers to improve coverage of intestinal lipids for non-targeted lipidomics.
Selmi et al. | J Chromatogr B Analyt Technol Biomed Life Sci (2024)
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Metabolic adaptations of a salt-tolerant willow are specific to the plant organ and the salt anion.
Sas et al. | Plant J. (2025)
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SIRIUS tentatively identified dadahol A in hemp roots, guiding the discovery of neolignans with cytotoxic activity against pediatric cancer cells.
Brownstein et al. | J Cannabis Res (2025)
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Matrix Method: Streamlined, automated method using barcoded tubes to extract both DNA and metabolites simultaneously from human and environmental samples.
Brennan et al. | Microbiology Spectrum (2025)
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Unique phytochemical fingerprints of Phragmites australis lineages suggest that metabolomic evenness may be a critical trait within plant species.
Salgado et al. | J Chem Ecol (2023)
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SIRIUS as part of a new screening platform to efficiently discover antifungal drugs from natural sources.
Brittin et al. | Molecules (2025)
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Mycobacteria use the MelH protein to neutralize toxic lipids, allowing them to survive in the host.
Chakraborti et al. | ACS Omega. (2025)
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Nitrogen source drives Microcystis (a primary driver of harmful freshwater algal blooms) exometabolome composition more than strain, with nitrate fueling peak chemical diversity.
Peck et al. | Environ Microbiol Rep. (2025)
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Metabolites in maize grown on sustainable push-pull fields that enhance its natural defense against pests.
Lang et al. | ACS Agric Sci Technol (2024)
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Terpenoids might contribute to the success of M. calvescens as an invasive species.
Clerissi et al. | Microorganisms (2023)
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Ethanol extraction for human faecal metabolomics is a valid, safer, and more economical alternative to the common methanol extraction.
Zuffa et al. | Anal Chem. (2025)
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Women with ovarian malignancies had significantly higher urinary levels of endocrine-disrupting chemicals.
Plešnik et al. | Environ Sci Technol (2025)
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Metabolite linked to dual-species biofilm pathogenesis in cystic fibrosis identified.
Uzi-Gavrilov et al. | Angewandte Chemie International Edition (2023)
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Unstable metabolites in neonatal dried blood spot should be carefully monitored in long-term storage.
Ottosson et al. | J Am Soc Mass Spectrom (2023)
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Accelerated photoaging and contact with water significantly increase the degradation and transformation rates of rubber-derived chemicals.
McMinn et al. | Environmental Science & Technology (2026)
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Females of the red-necked wasp moth have higher concentrations of potential defensive compounds than males.
Binns et al. | R Soc Open Sci (2025)
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Untargeted 2D chromtography MS/MS approach unravels the complex structures of depolymerized lignin to turn it into valuable biomaterials.
Tammekiviet al. | Anal Chim Acta (2024)
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