Accelerating metabolite identification in natural product research: toward an ideal combination of LC-HRMS/MS and NMR profiling, in silico databases and chemometrics
Jean-Luc Wolfender Jean-Marc Nuzillard Justin J. J. van der Hooft Jean-Hugues Renault Samuel Bertrand
ORCID: 0000-0002-5934-7012
HPLC Profiling with At-line Microdilution Assay for the Early Identification of Anti-fungal Compounds in Plants from French Polynesia 10.1002/pca.2473
Sample Preparation Issues in NMR-based Plant Metabolomics: Optimisation for Vitis Wood Samples 10.1002/pca.2497
Cancer chemopreventive diterpenes from Salvia corrugata 10.1016/j.phytochem.2013.09.011
Metabolite induction via microorganism co-culture: A potential way to enhance chemical diversity for drug discovery 10.1016/j.biotechadv.2014.03.001
Production of Fusaric Acid by Fusarium spp. in Pure Culture and in Solid Medium Co-Cultures 10.3390/molecules21030370
Time Dependency of Chemodiversity and Biosynthetic Pathways: An LC-MS Metabolomic Study of Marine-Sourced Penicillium 10.3390/md14050103
Combining ANOVA-PCA with POCHEMON to analyse micro-organism development in a polymicrobial environment 10.1016/j.aca.2017.01.064
Pro-Angiogenic Effects of Low Dose Ethoxidine in a Murine Model of Ischemic Hindlimb: Correlation between Ethoxidine Levels and Increased Activation of the Nitric Oxide Pathway 10.3390/molecules22040627
Successes and Pitfalls in Automated Dereplication Strategy Using Mass Spectrometry Data: a CASMI Experience 10.2174/2213235x04666160622074357
Successes and pitfalls in automated dereplication strategy using liquid chromatography coupled to mass spectrometry data: A CASMI 2016 experience 10.1016/j.phytol.2016.12.025
Passive Sampling and High Resolution Mass Spectrometry for Chemical Profiling of French Coastal Areas with a Focus on Marine Biotoxins 10.1021/acs.est.6b02081
Normal phase HPLC-based activity profiling of non-polar crude plant extracts – acetylcholinesterase inhibiting guttiferones from Montrouziera cauliflora as a case study 10.1080/14786419.2016.1154054
Statistical Correlations between HPLC Activity-Based Profiling Results and NMR/MS Microfraction Data to Deconvolute Bioactive Compounds in Mixtures 10.3390/molecules21030259
Lipid Composition, Fatty Acids and Sterols in the Seaweeds Ulva armoricana, and Solieria chordalis from Brittany (France): An Analysis from Nutritional, Chemotaxonomic, and Antiproliferative Activity Perspectives 10.3390/md13095606
The Marine-Derived Fungus Clonostachys rosea, Source of a Rare Conjugated 4-Me-6E,8E-hexadecadienoic Acid Reducing Viability of MCF-7 Breast Cancer Cells and Gene Expression of Lipogenic Enzymes 10.3390/md13084935
Projected Orthogonalized CHemical Encounter MONitoring (POCHEMON) for microbial interactions in co-culture 10.1007/s11306-014-0748-5
Multi-well fungal co-culture for de novo metabolite-induction in time-series studies based on untargeted metabolomics 10.1039/c4mb00223g
Current approaches and challenges for the metabolite profiling of complex natural extracts 10.1016/j.chroma.2014.10.091
De NovoProduction of Metabolites by Fungal Co-culture ofTrichophyton rubrumandBionectria ochroleuca 10.1021/np400258f
Hydroxamate, a Key Pharmacophore Exhibiting a Wide Range of Biological Activities 10.2174/13895575113139990007
Accelerating Metabolite Identification in Natural Product Research: Toward an Ideal Combination of Liquid Chromatography–High-Resolution Tandem Mass Spectrometry and NMR Profiling, in Silico Databases, and Chemometrics 10.1021/acs.analchem.8b05112
Targeting bioactive compounds in natural extracts - Development of a comprehensive workflow combining chemical and biological data 10.1016/j.aca.2019.04.038
Steroids from Marine-Derived Fungi: Evaluation of Antiproliferative and Antimicrobial Activities of Eburicol 10.3390/md17060372
Toxin content of Ostreopsis cf. ovata depends on bloom phases, depth and macroalgal substrate in the NW Mediterranean Sea 10.1016/j.hal.2019.101727
Expanding the chemical diversity through microorganisms co-culture: Current status and outlook 10.1016/j.biotechadv.2020.107521
Reproducible Molecular Networking Of Untargeted Mass Spectrometry Data Using GNPS. 10.26434/chemrxiv.9333212.v1
The secreted polyketide boydone A is responsible for the anti-Staphylococcus aureus activity of Scedosporium boydii 10.1093/femsle/fnx223
Sugar Induced Modification in Glycolipid Production in Acremonium sp. Revealed by LC-MS Lipidomic Approach 10.2174/2211550105666160922130029
Reproducible molecular networking of untargeted mass spectrometry data using GNPS 10.1038/s41596-020-0317-5
Detection of metabolite induction in fungal co-cultures on solid media by high-throughput differential ultra-high pressure liquid chromatography-time-of-flight mass spectrometry fingerprinting. 10.1016/j.chroma.2013.01.098
N-alpha-methyl coprogen B, a potential marker of the airway colonization by Scedosporium apiospermum in patients with cystic fibrosis 10.3109/13693786.2010.503972
Synthesis of the trans-fusarinine scaffold 10.1016/j.tetlet.2010.02.058
Hydroxamate siderophores of Scedosporium apiospermum 10.1007/s10534-009-9253-0
Justin van der Hooft
van der Hooft Justin / Justin J.J. van der Hooft
ORCID: 0000-0002-9340-5511
Structural elucidation of low abundant metabolites in complex sample matrices 10.1007/s11306-013-0519-8
Non-smoky GLYCOSYLTRANSFERASE1 prevents the release of smoky aroma from tomato fruit 10.1105/tpc.113.114231
Automatic chemical structure annotation of an LC-MSn based metabolic profile from green tea 10.1021/ac400861a
Substructure-based annotation of high-resolution multistage MSn spectral trees 10.1002/rcm.6364
Structural annotation and elucidation of conjugated phenolic compounds in black, green, and white tea extracts 10.1021/jf300297y
Structural elucidation and quantification of phenolic conjugates present in human urine after tea intake 10.1021/ac3017339
Spectral trees as a robust annotation tool in LC-MS based metabolomics 10.1007/s11306-011-0363-7
Metabolite identification using automated comparison of high-resolution multistage mass spectral trees 10.1021/ac2034216
Inhibitory activity of plumbagin produced by Drosera intermedia on food spoilage fungi 10.1002/jsfa.5522
A strategy for fast structural elucidation of metabolites in small volume plant extracts using automated MS-guided LC-MS-SPE-NMR 10.1002/mrc.2833
Thermal diffusivity of periderm from tomatoes of different maturity stages as determined by the concept of the frequency-domain open photoacoustic cell 10.1063/1.3530735
Polyphenol identification based on systematic and robust high-resolution accurate mass spectrometry fragmentation 10.1021/ac102546x
Iridoid and caffeoyl phenylethanoid glycosides of the endangered carnivorous plant Pinguicula lusitanica L. (Lentibulariaceae) 10.1016/j.bse.2009.05.003
Topic modeling for untargeted substructure exploration in metabolomics 10.1073/pnas.1608041113
Propagating annotations of molecular networks using in silico fragmentation 10.1371/journal.pcbi.1006089
Did a plant-herbivore arms race drive chemical diversity in Euphorbia? 10.1101/323014
Automatic Compound Annotation from Mass Spectrometry Data Using MAGMa. 10.5702/massspectrometry.S0033
Interactions of blacktea polyphenols with human gut microbiota: implications for gut and cardiovascular health 10.3945/ajcn.113.058263
Identification of a drimenol synthase and drimenol oxidase from Persicaria hydropiper, involved in the biosynthesis of insect deterrent drimanes 10.1111/tpj.13527
Enhanced Acylcarnitine Annotation in High-Resolution Mass Spectrometry Data: Fragmentation Analysis for the Classification and Annotation of Acylcarnitines 10.3389/fbioe.2015.00026
Rapid and sustained systemic circulation of conjugated gut microbiol catabolites after single-dose black tea extract consumption 10.1021/pr5001253
In Silico Prediction and Automatic LC–MSn Annotation of Green Tea Metabolites in Urine 10.1021/ac403875b
Unexpected differential metabolic responses of Campylobacter jejuni to the abundant presence of glutamate and fucose 10.1007/s11306-018-1438-5
Comprehensive mass spectrometry-guided plant specialized metabolite phenotyping reveals metabolic diversity in the cosmopolitan plant family Rhamnaceae 10.1101/463620
Deciphering complex metabolite mixtures by unsupervised and supervised substructure discovery and semi-automated annotation from MS/MS spectra 10.1101/491506
Accelerating metabolite identification in natural product research: toward an ideal combination of LC-HRMS/MS and NMR profiling, in silico databases and chemometrics 10.1021/acs.analchem.8b05112
Untargeted Mass Spectrometry-Based Metabolomics Tracks Molecular Changes in Raw and Processed Foods and Beverages 10.1101/347716
Absorption, metabolism, distribution and excretion of (−)-epicatechin: A review of recent findings
Metabolite Identification in Complex Mixtures Using Nuclear Magnetic Resonance Spectroscopy 10.1007/978-3-319-28275-6_6-2 web-based topic modelling for substructure discovery in mass spectrometry 10.1093/bioinformatics/btx582
A comprehensive evaluation of the [2-14C](–)-epicatechin metabolome in rats
The food metabolome: a window over dietary exposure 10.3945/ajcn.113.076133
Human studies on the absorption, distribution, metabolism, and excretion of tea polyphenols 10.3945/ajcn.113.058958
Unsupervised Discovery and Comparison of Structural Families Across Multiple Samples in Untargeted Metabolomics 10.1021/acs.analchem.7b01391
A community-driven paired data platform to accelerate natural product mining by combining structural information from genomes and metabolomes 10.18174/FAIRdata2018.16286
Implementations of the chemical structural and compositional similarity metric in R and Python 10.1101/546150
Comprehensive mass spectrometry-guided phenotyping of plant specialized metabolites reveals metabolic diversity in the cosmopolitan plant family Rhamnaceae 10.1111/tpj.14292
A genetical metabolomics approach for bioprospecting plant biosynthetic gene clusters 10.1186/s13104-019-4222-3
The Metabolomics Society—Current State of the Membership and Future Directions 10.3390/metabo9050089
Deciphering complex metabolite mixtures by unsupervised and supervised substructure discovery and semi-automated annotation from MS/MS spectra 10.1039/C8FD00235E
MolNetEnhancer: enhanced molecular networks by integrating metabolome mining and annotation tools 10.1101/654459
Substantial extracellular metabolic differences found between phylogenetically closely related probiotic and pathogenic strains of Escherichia coli 10.3389/fmicb.2019.00252
Assessing specialized metabolite diversity in the cosmopolitan plant genus Euphorbia l. 10.3389/fpls.2019.00846
Molnetenhancer: Enhanced molecular networks by integrating metabolome mining and annotation tools 10.3390/metabo9070144
In Silico Optimization of Mass Spectrometry Fragmentation Strategies in Metabolomics 10.3390/metabo9100219
MIBiG 2.0: a repository for biosynthetic gene clusters of known function 10.1093/nar/gkz882
Untargeted mass spectrometry-based metabolomics approach unveils molecular changes in raw and processed foods and beverages 10.1016/j.foodchem.2019.125290
The Natural Products Atlas: An Open Access Knowledge Base for Microbial Natural Products Discovery 10.1021/acscentsci.9b00806
Mass spectrometry searches using MASST 10.1038/s41587-019-0375-9
Assessing specialized metabolite diversity of Alnus species by a digitized LC–MS/MS data analysis workflow 10.1016/j.phytochem.2020.112292
Microbiome-derived carnitine mimics as previously unknown mediators of gut-brain axis communication 10.1126/sciadv.aax6328
Chemically-informed Analyses of Metabolomics Mass Spectrometry Data with Qemistree 10.1101/2020.05.04.077636
Linking genomics and metabolomics to chart specialized metabolic diversity 10.1039/D0CS00162G
Reproducible molecular networking of untargeted mass spectrometry data using GNPS 10.1038/s41596-020-0317-5
Decomposing metabolite set activity levels with PALS 10.1101/2020.06.07.138974
Ranking microbial metabolomic and genomic links in the NPLinker framework using complementary scoring functions 10.1101/2020.06.12.148205
Phenylpropane as an Alternative Dearomatizing Unit of Indoles: Discovery of Inaequalisines A and B Using Substructure-Informed Molecular Networking 10.1021/acs.orglett.0c02153
matchms - processing and similarity evaluation of mass spectrometry data 10.1101/2020.08.06.239244
Spec2Vec: Improved mass spectral similarity scoring through learning of structural relationships 10.1101/2020.08.11.245928
BiG-SLiCE: A Highly Scalable Tool Maps the Diversity of 1.2 Million Biosynthetic Gene Clusters 10.1101/2020.08.17.240838
matchms - processing and similarity evaluation of mass spectrometry data. 10.21105/joss.02411
ReDU: a framework to find and reanalyze public mass spectrometry data 10.1038/s41592-020-0916-7
Feature-based molecular networking in the GNPS analysis environment 10.1038/s41592-020-0933-6
Rapid Development of Improved Data-dependent Acquisition Strategies 10.1101/2020.09.11.293092
Chemically informed analyses of metabolomics mass spectrometry data with Qemistree 10.1038/s41589-020-00677-3
Auto-deconvolution and molecular networking of gas chromatography–mass spectrometry data 10.1038/s41587-020-0700-3
The ant fungus garden acts as an external digestive system 10.1101/2020.11.18.389361
BiG-MAP: an automated pipeline to profile metabolic gene cluster abundance and expression in microbiomes 10.1101/2020.12.14.422671
BiG-SLiCE: A highly scalable tool maps the diversity of 1.2 million biosynthetic gene clusters 10.1093/gigascience/giaa154
Veterinary trypanocidal benzoxaboroles are peptidase-activated prodrugs 10.1371/journal.ppat.1008932
Comparative Metabologenomics Analysis of Polar Actinomycetes 10.3390/md19020103
Ranking Metabolite Sets by Their Activity Levels 10.3390/metabo11020103
Spec2Vec: Improved mass spectral similarity scoring through learning of structural relationships 10.1371/journal.pcbi.1008724
Rapid Development of Improved Data-Dependent Acquisition Strategies 10.1021/acs.analchem.0c03895
MS2DeepScore - a novel deep learning similarity measure for mass fragmentation spectrum comparisons 10.1101/2021.04.18.440324
Ranking microbial metabolomic and genomic links in the NPLinker framework using complementary scoring functions 10.1371/journal.pcbi.1008920
Metabolomics-Guided Elucidation of Plant Abiotic Stress Responses in the 4IR Era: An Overview 10.3390/metabo11070445
Chemical Gradients of Plant Substrates in an Atta texana Fungus Garden 10.1128/mSystems.00601-21
Comprehensive Large-Scale Integrative Analysis of Omics Data To Accelerate Specialized Metabolite Discovery 10.1128/mSystems.00726-21
Jean-Luc Wolfender
Wolfender Jean-Luc
ORCID: 0000-0002-0125-952X
Dynamics of Metabolite Induction in Fungal Co-cultures by Metabolomics at Both Volatile and Non-volatile Levels 10.3389/fmicb.2018.00072
Lung Cancer Chemopreventive Activity of Patulin Isolated from Penicillium vulpinum 10.3390/molecules23030636
Structural design, synthesis and substituent effect of hydrazone-N-acylhydrazones reveal potent immunomodulatory agents 10.1016/j.bmc.2018.02.047
Survey on medicinal plants traditionally used in Senegal for the treatment of tuberculosis (TB) and assessment of their antimycobacterial activity 10.1016/j.jep.2017.12.037
Zebrafish-based identification of the antiseizure nucleoside inosine from the marine diatom Skeletonema marinoi 10.1371/journal.pone.0196195
Amphimedonoic acid and psammaplysene E, novel brominated alkaloids from Amphimedon sp 10.1016/j.tetlet.2017.08.072
Antioxidant and antibacterial activities and polyphenolic constituents of Helianthemum sessiliflorum Pers 10.1080/14786419.2016.1209669
Bioactive Natural Products Prioritization Using Massive Multi-informational Molecular Networks 10.1021/acschembio.7b00413
Combining ANOVA-PCA with POCHEMON to analyse micro-organism development in a polymicrobial environment 10.1016/j.aca.2017.01.064
Cytotoxic Prenylated Stilbenes Isolated from Macaranga tanarius 10.1021/acs.jnatprod.7b00409
Deep metabolome annotation in natural products research: towards a virtuous cycle in metabolite identification 10.1016/j.cbpa.2016.12.022
Dibenzofurans and Pseudodepsidones from the Lichen Stereocaulon paschale Collected in Northern Quebec 10.1021/acs.jnatprod.6b00831
Gastroprotective effects of hydroethanolic root extract of Arrabidaea brachypoda: Evidences of cytoprotection and isolation of unusual glycosylated polyphenols 10.1016/j.phytochem.2016.12.002
Generation of Antifungal Stilbenes Using the Enzymatic Secretome of Botrytis cinerea 10.1021/acs.jnatprod.6b00760
Identification and Mode of Action of a Plant Natural Product Targeting Human Fungal Pathogens 10.1128/aac.00829-17
Identification of Triterpenoids from Schefflera systyla, Odontadenia puncticulosa and Conostegia speciosa and In Depth Investigation of Their in vitro and in vivo Antifungal Activities 10.21577/0103-5053.20160271
In Vitro Pro-apoptotic and Anti-migratory Effects of Ficus deltoidea L. Plant Extracts on the Human Prostate Cancer Cell Lines PC3 10.3389/fphar.2017.00895
Involvement of Opioid System, TRPM8, and ASIC Receptors in Antinociceptive Effect of Arrabidaea brachypoda (DC) Bureau 10.3390/ijms18112304
New tetraacetylated iridoid glycosides from Sambucus ebulus L. leaves 10.1016/j.phytol.2017.01.003
Passive Intestinal Absorption of Representative Plant Secondary Metabolites: A Physicochemical Study 10.1055/s-0043-101915
Peptidomic and transcriptomic profiling of four distinct spider venoms 10.1371/journal.pone.0172966
Targeted Isolation of Monoterpene Indole Alkaloids from Palicourea sessilis 10.1021/acs.jnatprod.7b00681
The key role of analytical sciences in the discovery and characterization of bioactives from food and nutraceuticals 10.1016/j.bcp.2017.06.087
UHPLC-MS-based HDAC Assay Applied to Bioguided Microfractionation of Fungal Extracts 10.1002/pca.2652
Unguiculin A and Ptilomycalins E-H, Antimalarial Guanidine Alkaloids from the Marine Sponge Monanchora unguiculata 10.1021/acs.jnatprod.6b01079
A UHPLC/MS-MS-based HDAC assay applied to bio-guided microfractionation of fungi extracts 10.1055/s-0036-1596682
Advanced technologies for exploring the chemical and functional properties of bioactive constituents in food 10.1055/s-0036-1596178
Advances in venomics 10.1039/c6mb00516k
Anticonvulsant agents from Boswellia sacra identified by zebrafish bioassay-guided fractionation 10.1055/s-0036-1596567
Antifungal Quinoline Alkaloids from Waltheria indica 10.1021/acs.jnatprod.5b00896
Antioxidants, quinone reductase inducers and acetylcholinesterase inhibitors from Spondias tuberosa fruits 10.1016/j.jff.2015.12.009
Bioguided isolation of anticonvulsant principles from Helleborus cyclophyllus using the zebrafish epilepsy model 10.1055/s-0036-1596568
Boosting the antifungal drug discovery by halogenating plant extracts to obtain bioactive 'unnatural' natural products 10.1055/s-0036-1596750
Can molecular networking be a powerful tool to target specific bioactive scaffolds? Case study of New Caledonian Euphorbiaceae species 10.1055/s-0036-1596108
Cell-based bioreporter assay coupled to HPLC micro-fractionation in the evaluation of antimicrobial properties of the basidiomycete fungus Pycnoporus cinnabarinus 10.3109/13880209.2015.1103754
Chemical profile of Justicia gendarussa a medicinal plant used for male contraception 10.1055/s-0036-1596380
Comprehensive investigation of the secondary metabolites from the roots of Galianthe thalictroides (Rubiaceae) 10.1055/s-0036-1596461
Conjugation of N-acylhydrazone and 1,2,4-oxadiazole leads to the identification of active antimalarial agents 10.1016/j.bmc.2016.09.013
Current and Future Perspectives on the Structural Identification of Small Molecules in Biological Systems 10.3390/metabo6040046
De novo metabolite production through co-cultivation of different fungal species on solid media 10.1055/s-0036-1596677
Detection and dynamics of volatile/non-volatile metabolite induction in fungal co-culture through a miniaturised MS-based metabolomic approach 10.1055/s-0036-1596198
Differentiation of plants used in TCM as antitussive agent by UHPLC-HRMS based metabolomics: the case of Stemona species 10.1055/s-0036-1596207
Flash chromatography MS-targeted isolation of natural products under normal phase conditions 10.1055/s-0036-1596260
Highly localized and persistent induction of Bx1-dependent herbivore resistance factors in maize 10.1111/tpj.13308
Identification of antimycobacterial ellagitannins from the aqueous extract of Combretum aculeatum 10.1055/s-0036-1596371
Improving the detection of plant bioactive compounds by coupling a semi-preparative 2D-LCxLC system to an HTS platform 10.1055/s-0036-1596282
Integration of molecular networking & in-silico MS/MS fragmentation: a novel dereplication strategy in natural products chemistry 10.1055/s-0036-1596110
Integration of Molecular Networking and In-Silico MS/MS Fragmentation for Natural Products Dereplication 10.1021/acs.analchem.5b04804
Integration of molecular networking and in-silico MS/MS fragmentation for sensitive high throughput natural products dereplication 10.1055/s-0036-1596176
Investigation of an edible TCM bitter melon (Momordica charantia): metabolite profiling, differentiation and characterization 10.1055/s-0036-1596193
Investigation of the anti-obesity effect of Pueraria montana var. lobata 10.1055/s-0036-1596891
Isolation and identification of new secondary metabolites from the marine sponge Monanchora unguiculata 10.1055/s-0036-1596641
Massive multi-informative molecular networks to mine New-Caledonian chemodiversity for antiviral compounds 10.1055/s-0036-1596223
Metabolite profiling and targeted isolation of markers for a comprehensive standardisation of a multi-herb TCM formula to treat atopic dermatitis 10.1055/s-0036-1596134
Metabolomic differentiation of varieties from Ficus deltoidea, a plant used for management of diabetes in Malaysia 10.1055/s-0036-1596194
Modern tools to analyse museum samples of curare and psychoactive preparations used by Amazonian tribes 10.1055/s-0036-1596293
Molecular networking approach to detect new analogues of prenylated stilbenes from Macaranga spp 10.1055/s-0036-1596249
Nauclea latifolia: biological activity and alkaloid phytochemistry of a West African tree 10.1039/c6np00039h
Normal phase HPLC-based activity profiling of non-polar crude plant extracts -acetylcholinesterase inhibiting guttiferones from Montrouziera cauliflora as a case study 10.1080/14786419.2016.1154054
Phytochemical analysis of the decoction from leaves of cultivated specimens of Myracrodruon urundeuva ("aroeira-do-sertao") 10.1055/s-0036-1596381
Prediction of the Passive Intestinal Absorption of Medicinal Plant Extract Constituents with the Parallel Artificial Membrane Permeability Assay (PAMPA) 10.1055/s-0042-101247
Preparative Scale MS-Guided Isolation of Bioactive Compounds Using High-Resolution Flash Chromatography: Antifungals from Chiloscyphus polyanthos as a Case Study 10.1055/s-0042-108207
Production of Fusaric Acid by Fusarium spp. in Pure Culture and in Solid Medium Co-Cultures 10.3390/molecules21030370
Special Issue dedicated to Prof. Dr. Dres. h. c. mult. Kurt Hostettmann 10.1055/s-0042-108469
Standardized LCxLC-ELSD Fractionation Procedure for the Identification of Minor Bioactives via the Enzymatic Screening of Natural Extracts 10.1021/acs.jnatprod.6b00628
Statistical Correlations between HPLC Activity-Based Profiling Results and NMR/MS Microfraction Data to Deconvolute Bioactive Compounds in Mixtures 10.3390/molecules21030259
Targeted Isolation of Indolopyridoquinazoline Alkaloids from Conchocarpus fontanesianus Based on Molecular Networks 10.1021/acs.jnatprod.6b00379
Towards an efficient and targeted isolation of valuable natural products only 10.1055/s-0036-1596117
A Physiological and Behavioral Mechanism for Leaf Herbivore-Induced Systemic Root Resistance 10.1104/pp.15.00759
Axial and Radial Oxylipin Transport 10.1104/pp.15.01104
Biomimetic synthesis of Tramadol 10.1039/c5cc05948h
Current approaches and challenges for the metabolite profiling of complex natural extracts 10.1016/j.chroma.2014.10.091
Integrating metabolomic data from multiple analytical platforms for a comprehensive characterisation of lemon essential oils 10.1002/ffj.3230
LC-MS/MS Quantitative Determination of Tetrapterys mucronata Alkaloids, a Plant Occasionally used in Ayahuasca Preparation 10.1002/pca.2548
Maize Domestication and Anti-Herbivore Defences: Leaf-Specific Dynamics during Early Ontogeny of Maize and Its Wild Ancestors 10.1371/journal.pone.0135722
Phospholipidosis effect of drugs by adsorption into lipid monolayers 10.1016/j.colsurfb.2015.09.003
Projected Orthogonalized CHemical Encounter MONitoring (POCHEMON) for microbial interactions in co-culture 10.1007/s11306-014-0748-5
Rational and Efficient Preparative Isolation of Natural Products by MPLC-UV-ELSD based on HPLC to MPLC Gradient Transfer 10.1055/s-0035-1545912
The pharmaceutical industry and natural products: historical status and new trends 10.1007/s11101-014-9367-z
Transcriptome diversity among rice root types during asymbiosis and interaction with arbuscular mycorrhizal fungi 10.1073/pnas.1504142112
Within-plant distribution of 1,4-benzoxazin-3-ones contributes to herbivore niche differentiation in maize 10.1111/pce.12464
3-beta-D-Glucopyranosyl-6-methoxy-2-benzoxazolinone (MBOA-N-Glc) is an insect detoxification product of maize 1,4-benzoxazin-3-ones 10.1016/j.phytochem.2014.03.018
Antifungals and acetylcholinesterase inhibitors from the stem bark of Croton heliotropiifolius 10.1016/j.phytol.2014.08.013
Chemical Composition of the Bark of Tetrapterys mucronata and Identification of Acetylcholinesterase Inhibitory Constituents 10.1021/np401003p
Comparison of UHPLC-ESI-MS and Hadamard Transform Atmospheric Pressure Ion Mobility-ESI-MS for Rapid Profiling of Isomeric Flavonoids 10.2533/chimia.2014.135
Comprehensive approach for the detection of antifungal compounds using a susceptible strain of Candida albicans and confirmation of in vivo activity with the Galleria mellonella model 10.1016/j.phytochem.2014.06.004
Comprehensive profiling and marker identification in non-volatile citrus oil residues by mass spectrometry and nuclear magnetic resonance 10.1016/j.foodchem.2013.10.103
Computational Studies on Sirtuins from Trypanosoma cruzi: Structures, Conformations and Interactions with Phytochemicals 10.1371/journal.pntd.0002689
Differentiation of lemon essential oil based on volatile and non-volatile fractions with various analytical techniques: a metabolomic approach 10.1016/j.foodchem.2013.07.125
Dimeric Flavonoids from Arrabidaea brachypoda and Assessment of Their Anti-Trypanosoma cruzi Activity 10.1021/np401060j
HPLC Profiling with At-line Microdilution Assay for the Early Identification of Anti-fungal Compounds in Plants from French Polynesia 10.1002/pca.2473
Metabolite identification: are you sure? And how do your peers gauge your confidence? 10.1007/s11306-014-0656-8
Metabolite induction via microorganism co-culture: A potential way to enhance chemical diversity for drug discovery 10.1016/j.biotechadv.2014.03.001
Microphynolides A and B, new spiro-g-lactone glycosides from Thymelaea Microphylla (vol 28, pg 1732, 2014) 10.1080/14786419.2014.957028
Microphynolides A and B, new spiro-gamma-lactone glycosides from Thymelaea microphylla 10.1080/14786419.2014.942662
Multi-well fungal co-culture for de novo metabolite-induction in time-series studies based on untargeted metabolomics 10.1039/c4mb00223g
Retention time prediction for dereplication of natural products (CxHyOz) in LC-MS metabolite profiling 10.1016/j.phytochem.2014.10.005
Sample Preparation Issues in NMR-based Plant Metabolomics: Optimisation for Vitis Wood Samples 10.1002/pca.2497
Study of Leaf Metabolome Modifications Induced by UV-C Radiations in Representative Vitis, Cissus and Cannabis Species by LC-MS Based Metabolomics and Antioxidant Assays 10.3390/molecules190914004
The rise of operon-like gene clusters in plants 10.1016/j.tplants.2014.01.013
Zebrafish Bioassay-Guided Microfractionation Identifies Anticonvulsant Steroid Glycosides from the Philippine Medicinal Plant Solanum torvum 10.1021/cn5001342
Anti-inflammatory, antimicrobial and antioxidant activities of Diospyros bipindensis (Gurke) extracts and its main constituents 10.1016/j.jep.2012.12.041
Cancer chemopreventive diterpenes from Salvia corrugata 10.1016/j.phytochem.2013.09.011
De Novo Production of Metabolites by Fungal Co-culture of Trichophyton rubrum and Bionectria ochroleuca 10.1021/np400258f
Detection of metabolite induction in fungal co-cultures on solid media by high-throughput differential ultra-high pressure liquid chromatography-time-of-flight mass spectrometry fingerprinting 10.1016/j.chroma.2013.01.098
Extensive phytochemical investigation of the polar constituents of Diospyros bipindensis Giirke traditionally used by Baka pygmies 10.1016/j.phytochem.2013.09.005
Four 13-lipoxygenases contribute to rapid jasmonate synthesis in wounded Arabidopsis thaliana leaves: a role for lipoxygenase 6 in responses to long-distance wound signals 10.1111/nph.12029
Integration of Microfractionation, qNMR and Zebrafish Screening for the In Vivo Bioassay-Guided Isolation and Quantitative Bioactivity Analysis of Natural Products 10.1371/journal.pone.0064006
Latest Developments in Assessing Antifungal Activity Using TLC-Bioautography: A Review 10.5740/jaoacint.SGEFavre-Godal
LC-DAD-MS-based metabolite profiling of three species of Justicia (Acanthaceae) 10.1080/14786419.2012.738207
Metabolomics reveals herbivore-induced metabolites of resistance and susceptibility in maize leaves and roots 10.1111/pce.12002
Occurrence of the Synthetic Analgesic Tramadol in an African Medicinal Plant 10.1002/anie.201305697
Peltogynoids and 2-Phenoxychromones from Peltophorum pterocarpum and Evaluation of Their Estrogenic Activity 10.1055/s-0032-1328299
Salvia officinalis for Hot Flushes: Towards Determination of Mechanism of Activity and Active Principles 10.1055/s-0032-1328552
Structural insights of SIR2rp3 proteins as promising biotargets to fight against Chagas disease and leishmaniasis 10.1039/c3mb70180h
Ultra-high pressure liquid chromatography-mass spectrometry for plant metabolomics: A systematic comparison of high-resolution quadrupole-time-of-flight and single stage Orbitrap mass spectrometers 10.1016/j.chroma.2012.12.009
Vitis vinifera Canes, a New Source of Antifungal Compounds against Plasmopara viticola, Erysiphe necator, and Botrytis cinerea 10.1021/jf4010252
Acylated pregnane glycosides from Caralluma sinaica 10.1016/j.phytochem.2012.04.003
High resolution ultra high pressure liquid chromatography-time-of-flight mass spectrometry dereplication strategy for the metabolite profiling of Brazilian Lippia species 10.1016/j.chroma.2012.03.069
Identification of Infectious Agents in Onychomycoses by PCR-Terminal Restriction Fragment Length Polymorphism 10.1128/jcm.05164-11
New Approaches for Studying the Chemical Diversity of Natural Resources and the Bioactivity of their Constituents 10.2533/chimia.2012.324
Peak capacity optimisation for high resolution peptide profiling in complex mixtures by liquid chromatography coupled to time-of-flight mass spectrometry: Application to the Conus consors cone snail venom 10.1016/j.chroma.2012.05.033
Polyketide Skeletons from the Marine Alga-Derived Fungus Coniothyrium cereale 10.1002/ejoc.201200700
Preussianone, a New Flavanone-Chromone Biflavonoid from Garcinia preussii Engl 10.3390/molecules17056114
Ultraviolet induction of antifungal activity in plants 10.1111/j.1439-0507.2012.02192.x
Zebrafish Bioassay-guided Microfractionation for the Rapid in vivo Identification of Pharmacologically Active Natural Products 10.2533/chimia.2012.229
Advanced Methods for Natural Product Drug Discovery in the Field of Nutraceuticals 10.2533/chimia.2011.400
Induction and detoxification of maize 1,4-benzoxazin-3-ones by insect herbivores 10.1111/j.1365-313X.2011.04740.x
Mass spectrometry for the evaluation of cardiovascular diseases based on proteomics and lipidomics 10.1160/th10-12-0812
Advances in LC platforms for drug discovery 10.1517/17460441003733874
Advances in Techniques for Profiling Crude Extracts and for the Rapid Identification of Natural Products: Dereplication, Quality Control and Metabolomics 10.2174/138527210792927645
High-Throughput Phospholipidic Fingerprinting by Online Desorption of Dried Spots and Quadrupole-Linear Ion Trap Mass Spectrometry: Evaluation of Atherosclerosis Biomarkers in Mouse Plasma 10.1021/ac101421b
Mass Spectrometry-based Metabolomics Oriented by Correlation Analysis for Wound-induced Molecule Discovery: Identification of a Novel Jasmonate Glucoside 10.1002/pca.1155
Standard machine learning algorithms applied to UPLC-TOF/MS metabolic fingerprinting for the discovery of wound biomarkers in Arabidopsis thaliana 10.1016/j.chemolab.2010.03.003
Differential Analysis of Mycoalexins in Confrontation Zones of Grapevine Fungal Pathogens by Ultrahigh Pressure Liquid Chromatography/Time-of-Flight Mass Spectrometry and Capillary Nuclear Magnetic Resonance 10.1021/jf8033539
HPLC in Natural Product Analysis: The Detection Issue 10.1055/s-0028-1088393
Metabolite profiling of plant extracts by ultra-high-pressure liquid chromatography at elevated temperature coupled to time-of-flight mass spectrometry 10.1016/j.chroma.2009.05.069
Modern Approaches in the Search for New Lead Antiparasitic Compounds from Higher Plants 10.2174/138945009787581113
Some solutions to obtain very efficient separations in isocratic and gradient modes using small particles size and ultra-high pressure 10.1016/j.chroma.2009.02.032
Velocity Estimates for Signal Propagation Leading to Systemic Jasmonic Acid Accumulation in Wounded Arabidopsis 10.1074/jbc.M109.061432
High-resolution profiling of oxylipin-containing galactolipids in Arabidopsis extracts by ultra-performance liquid chromatography/time-of-flight mass spectrometry 10.1002/rcm.3716
Optimized liquid chromatography-mass spectrometry approach for the isolation of minor stress biomarkers in plant extracts and their identification by capillary nuclear magnetic resonance 10.1016/j.chroma.2007.12.021
Screening for wound-induced oxylipins in Arabidopsis thaliana by differential HPLC-APCI/MS profiling of crude leaf extracts and subsequent characterisation by capillary-scale NMR 10.1002/pca.1051
Spatial and temporal dynamics of jasmonate synthesis and accumulation in Arabidopsis in response to wounding 10.1074/jbc.M801760200
UPLC-TOF-MS for plant metabolomics: A sequential approach for wound marker analysis in Arabidopsis thaliana 10.1016/j.jchromb.2008.04.021
Development of a two-step screening ESI-TOF-MS method for rapid determination of significant stress-induced metabolome modifications in plant leaf extracts: The wound response in Arabidopsis thaliana as a case study 10.1002/jssc.200700143
Identification of natural products using HPLC-SPE combined with CapNMR 10.1021/ac0616963
Multivariate data analysis of rapid LC-TOF/MS experiments from Arabidopsis thaliana stressed by wounding 10.1016/j.chemolab.2006.06.004
The importance of hyphenated techniques in the discovery of new lead compounds from nature 10.1517/17460441.1.3.237
Flavonoids from the stem of Eriophorum scheuchzeri 10.1021/np0580107
On-line identification of unstable iridoids from Jamesbrittenia fodina by HPLC-MS and HPLC-NMR 10.1002/pca.866
Phytochemistry in the microgram domain - a LC-NMR perspective 10.1002/mrc.1631
Strategy in the search for new lead compounds and drugs from plants 10.2533/000942905777676326
Synergy at the 'Ecole de Pharmacie Geneve-Lausannel': Methodology developments for the treatment of complex metabolomic datasets with data mining 10.2533/000942905777676425
ent-Labdane glycosides from the aquatic plant Potamogeton lucens and analytical evaluation of the lipophilic extract constituents of various Potamogeton species 10.1016/j.phytonchem.2004.01.018
HPLC-UV/PAD and HPLC-MSn analyses of leaf and root extracts of Vismia guineensis and isolation and identification of two new bianthrones 10.1002/pca.788
Identification of the polar constituents of Potamogeton species by HPLC-UV with post-column derivatization, HPLGMS(n) and HPLC-NMR, and isolation of a new ent-labdane diglycoside 10.1016/j.phytochem.2004.06.031
Rapid analysis of nucleotide-activated sugars by high-performance liquid chromatography coupled with diode-array detection, electrospray ionization mass spectrometry and nuclear magnetic resonance 10.1016/j.chroma.2004.02.023
Determination of the absolute configuration of 6-alkylated alpha-pyrones from Ravensara crassifolia by LC-NMR 10.1002/pca.684
ent-Labdane diterpenes from the aquatic plant Potamogeton pectinatus 10.1016/j.phytochem.2003.08.014
Liquid chromatography with ultraviolet absorbance-mass spectrometric detection and with nuclear magnetic resonance spectroscopy: a powerful combination for the on-line structural investigation of plant metabolites 10.1016/s0021-9673(03)00303-0
On-line identification of tropane alkaloids from Erythroxylum vacciniifolium by liquid chromatography-UV detection-multiple mass spectrometry and liquid chromatography-nuclear magnetic resonance spectrometry 10.1016/j.chroma.2003.08.052
On-line identification of unstable catalpol derivatives from Jamesbrittenia fodina by LC-MS and LC-NMR 10.1002/pca.689
Structural investigations of isomeric oxidised forms of hyperforin by HPLC-NMR and HPLG-MSn 10.1002/pca718
Liquid chromatography-atmospheric pressure chemical ionisation/mass spectrometry: A rapid and selective method for the quantitative determination of ginkgolides and bilobalide in Ginkgo leaf extracts and phytopharmaceuticals 10.1002/pca.614
On-line identification of the antifungal constituents of Erythrina vogelii by liquid chromatography with tandem mass spectrometry, ultraviolet absorbance detection and nuclear magnetic resonance spectrometry combined with liquid chromatographic micro-fractionation 10.1016/s0021-9673(02)01224-4
Evaluation of quadrupole time-of-flight tandem mass spectrometry and ion-trap multiple-stage mass spectrometry for the differentiation of C-glycosidic flavonoid isomers 10.1016/s0021-9673(01)00806-8
Modern screening techniques for plant extracts 10.1076/phbi.
Natural and synthetic xanthones as monoamine oxidase inhibitors: Biological assay and 3D-QSAR 10.1002/1522-2675(20010321)84:3<552::aid-hlca552>;2-x
New antifungal 'quinone methide' diterpenes from Bobgunnia madagascariensis and study of their interconversion by LC/NMR 10.1002/1522-2675(20010131)84:1<222::aid-hlca222>;2-r
The potential of LC-NMR in phytochemical analysis 10.1002/1099-1565(200101/02)12:1<2::aid-pca552>;2-k
A liquid chromatography-thermospray ionisation-mass spectrometry guided isolation of a new sesquiterpene aryl ester from Armillaria novae-zelandiae 10.1039/b001980l
Application of high performance liquid chromatography coupled with ultraviolet spectroscopy and electrospray mass spectrometry to the characterisation of ellagitannins from Terminalia macroptera roots 10.1023/a:1007598922712
Benzophenone glycosides from Gnidia involucrata 10.1016/s0031-9422(00)00046-7
Determination of trace amounts of ginkgolic acids in Ginkgo biloba L. leaf extracts and phytopharmaceuticals by liquid chromatography-electrospray mass spectrometry 10.1016/s0378-4347(00)00316-9
Evaluation of Q-TOF-MS/MS and multiple stage IT-MSn for the dereplication of flavonoids and related compounds in crude plant extracts 10.1051/analusis:2000280895
The importance of LC-MS and LC-NMR in the discovery of new lead compounds from plants 10.1076/phbi.
The potential of African plants as a source of drugs 10.2174/1385272003375923
Xanthones in cell cultures of Hypericum androsaemum 10.1055/s-2000-8542
Determination of pyrrolizidine alkaloids in Senecio species by liquid chromatography/thermospray-mass spectrometry and liquid chromatography/nuclear magnetic resonance spectroscopy 10.1055/s-1999-14027
Electrospray liquid chromatography mass spectrometry of the leaf extract of Rhamnus prinoides 10.1002/(sici)1099-1565(199903/04)10:2<69::aid-pca447>;2-w
Identification of two isomeric meroterpenoid naphthoquinones from Cordia linnaei by liquid chromatography mass spectrometry and liquid chromatography-nuclear magnetic resonance spectroscopy 10.1002/(sici)1099-1565(199905/06)10:3<137::aid-pca445>;2-u
Identification of tyrosine sulfation in Conus pennaceus conotoxins alpha-PnIA and alpha-PnIB: Further investigation of labile sulfo- and phosphopeptides by electrospray, matrix-assisted laser desorption/ionization (MALDI) and atmospheric pressure MALDI mass spectrometry 10.1002/(sici)1096-9888(199904)34:4<447::aid-jms801>;2-1
LC/ES-MS analysis of triterpene glycosides: Rapid estimation of the saponin content of dried berries of Phytolacca dodecandra 10.1002/(sici)1099-1565(199909/10)10:5<272::aid-pca470>;2-z
Mono- and sesquiterpenes and antifungal constituents from Artemisia species 10.1055/s-1999-13965
Xanthine oxidase inhibitors from Brandisia hancei 10.1055/s-2006-960854
A naphthoquinone from Newbouldia laevis roots 10.1016/s0031-9422(97)00502-5
Analysis of cannabinoids by liquid chromatography - Thermospray mass spectrometry and liquid chromatography - Tandem mass spectrometry 10.1007/bf02466788
Antifungal alkaloids and limonoid derivatives from Dictamnus dasycarpus 10.1016/s0031-9422(97)00541-4
Diterpenes and sterols from Neoboutonia melleri 10.1016/s0031-9422(97)00786-3
Liquid chromatography coupled to mass spectrometry and nuclear magnetic resonance spectroscopy for the screening of plant constituents 10.1016/s0021-9673(97)00939-4
Monoterpene dimers from Lisianthius seemannii 10.1002/hlca.19980810548
Phenols, acetylenes, and sesquiterpene lactones from Inulanthera nuda 10.1002/(sici)1522-2675(19981111)81:11<2062::aid-hlca2062>;2-8
Prenylated flavanones from Monotes engleri: On-line structure elucidation by LC/UV/NMR 10.1002/hlca.19980810325
Sesquiterpene glycosides from Dictamnus dasycarpus 10.1016/s0031-9422(97)00542-6
Use of on-flow LC/H-1 NMR for the study of an antioxidant fraction from Orophea enneandra and isolation of a polyacetylene, lignans, and a tocopherol derivative 10.1021/np980203p
Xanthones, triterpenes and a biphenyl from Kielmeyera coriacea 10.1016/s0031-9422(97)00731-0
Isolation of polyphenols from Polygala gazensis and liquid chromatography mass spectrometry of related African Polygala species 10.1002/(sici)1099-1565(199701)8:1<32::aid-pca327>;2-7
Liquid chromatography ultra violet mass spectrometric and liquid chromatography nuclear magnetic resonance spectroscopic analysis of crude extracts of Gentianaceae species 10.1002/(sici)1099-1565(199705)8:3<97::aid-pca350>;2-q
Phenylpropanoid glycosides from Newbouldia laevis roots 10.1016/s0031-9422(96)00611-5
Rapid detection and subsequent isolation of bioactive constituents of crude plant extracts 10.1055/s-2006-957592
The search for biologically active secondary metabolites 10.1002/(sici)1096-9063(199712)51:4<471::aid-ps662>;2-s
Triterpenes and triterpenoid saponins from Mussaenda pubescens 10.1016/s0031-9422(97)00089-7
Two new secoiridoid glycosides from Gentiana algida 10.1055/s-2006-957770
Acyl secoiridoids and antifungal constituents from gentiana macrophylla 10.1016/0031-9422(96)00149-5
Antifungal and antibacterial chalcones from Myrica serrata 10.1055/s-2006-957804
Antifungal and antibacterial naphthoquinones from Newbouldia laevis roots 10.1016/0031-9422(96)00135-5
Corniculoside, a new biosidic ester secoiridoid from Halenia corniculata 10.1002/hlca.19960790205
Isolation of antifungal valepotriates from Valeriana capense and the search for valepotriates in crude Valerianaceae extracts 10.1002/(sici)1099-1565(199603)7:2<76::aid-pca288>;2-l
Secoiridoids and antifungal aromatic acids from Gentiana algida 10.1016/0031-9422(95)00599-4
XANTHONES FROM CHIRONIA-KREBSII 10.1016/0031-9422(91)80080-k
The plant pathogen Pseudomonas aeruginosa triggers a DELLA-dependent seed germination arrest in Arabidopsis 10.7554/eLife.37082
Pharmacognosy in the digital era: shifting to contextualized metabolomics 10.1016/j.copbio.2018.02.010
Accelerating Metabolite Identification in Natural Product Research: Toward an Ideal Combination of Liquid Chromatography–High-Resolution Tandem Mass Spectrometry and NMR Profiling, in Silico Databases, and Chemometrics 10.1021/acs.analchem.8b05112
Antileishmanial Activity of Dimeric Flavonoids Isolated from Arrabidaea brachypoda 10.3390/molecules24010001
Chemo-Diversification of Plant Extracts Using a Generic Bromination Reaction and Monitoring by Metabolite Profiling 10.1021/acscombsci.8b00132
Characterization, Diversity, and Structure-Activity Relationship Study of Lipoamino Acids from Pantoea sp. and Synthetic Analogues 10.3390/ijms20051083
Differentiation of Ficus deltoidea varieties and chemical marker determination by UHPLC-TOFMS metabolomics for establishing quality control criteria of this popular Malaysian medicinal herb 10.1007/s11306-019-1489-2
Chemical Constituents of Anacardium occidentale as Inhibitors of Trypanosoma cruzi Sirtuins 10.3390/molecules24071299
Structural Identification of Antibacterial Lipids from Amazonian Palm Tree Endophytes through the Molecular Network Approach 10.3390/ijms20082006
Innovative omics-based approaches for prioritisation and targeted isolation of natural products – new strategies for drug discovery 10.1039/C9NP00004F
Identification of chemotypes in bitter melon by metabolomics: a plant with potential benefit for management of diabetes in traditional Chinese medicine 10.1007/s11306-019-1565-7
Can biochemical phenotype, obtained from herbarium samples, help taxonomic decisions? – A case study using Gentianaceae 10.1002/tax.12120
Chemical Composition, Antioxidant, and Anti-inflammatory Activities of Whole Parts of Onobrychis crista-galli (L.) Lam 10.2174/2210315510666191218094623
Wound‐ and mechanostimulated electrical signals control hormone responses 10.1111/nph.16646
Rutamarin: Efficient Liquid–Liquid Chromatographic Isolation from Ruta graveolens L. and Evaluation of Its In Vitro and In Silico MAO-B Inhibitory Activity 10.3390/molecules25112678
Metabolomics of Myrcia bella Populations in Brazilian Savanna Reveals Strong Influence of Environmental Factors on Its Specialized Metabolism 10.3390/molecules25122954
Phosphatidylcholines from Pieris brassicae eggs activate an immune response in Arabidopsis 10.7554/eLife.60293
Paecilosetin Derivatives as Potent Antimicrobial Agents from Isaria farinosa 10.1021/acs.jnatprod.0c00444
In Vitro Anti-Inflammatory Activity in Arthritic Synoviocytes of A. brachypoda Root Extracts and Its Unusual Dimeric Flavonoids 10.3390/molecules25215219
Tackling Pseudomonas aeruginosa Virulence by Mulinane-Like Diterpenoids from Azorella atacamensis 10.3390/biom10121626
A Cytotoxic Porphyrin from North Pacific Brittle Star Ophiura sarsii 10.3390/md19010011
Spatial and evolutionary predictability of phytochemical diversity 10.1073/pnas.2013344118
Targeted Isolation of Photoactive Pigments from Mushrooms Yielded a Highly Potent New Photosensitizer: 7,7’-Biphyscion 10.26434/chemrxiv.13721770.v1
Targeted Isolation of Photoactive Pigments from Mushrooms Yielded a Highly Potent New Photosensitizer: 7,7’-Biphyscion 10.26434/chemrxiv.13721770
Coumarins from Seseli devenyense Simonk.: Isolation by Liquid–Liquid Chromatography and Potential Anxiolytic Activity Using an In Vivo Zebrafish Larvae Model 10.3390/ijms22041829
Feature-Based Molecular Network-Guided Dereplication of Natural Bioactive Products from Leaves of Stryphnodendron pulcherrimum (Willd.) Hochr 10.3390/metabo11050281
Constituents of Chamaecrista diphylla (L.) Greene Leaves with Potent Antioxidant Capacity: A Feature-Based Molecular Network Dereplication Approach 10.3390/pharmaceutics13050681
Molecular and Functional Analysis of Sunitinib-Resistance Induction in Human Renal Cell Carcinoma Cells 10.3390/ijms22126467
Drug Repurposing to Identify a Synergistic High-Order Drug Combination to Treat Sunitinib-Resistant Renal Cell Carcinoma 10.3390/cancers13163978
Using Porcine Jejunum Ex Vivo to Study Absorption and Biotransformation of Natural Products in Plant Extracts: Pueraria lobata as a Case Study 10.3390/metabo11080541
Jean-Marc Nuzillard
Nuzillard Jean-Marc
ORCID: 0000-0002-5120-2556
"Connectivist" approach to organic structure determination Lsd-program assisted Nmr analysis of the insect antifeedant Azadirachtin 10.1016/S0040-4020(01)89576-4
Chrysopentamine, an Antiplasmodial Anhydronium Base from Strychnos usambarensis Leaves 10.1055/s-2004-815461
Chapter 3 Solvent systems 10.1016/S0166-526X(02)80006-X
Pilot-scale ion-exchange centrifugal partition chromatography: Purification of sinalbin from white mustard seeds 10.1002/jssc.200800651
Asymmetric homogeneous reduction of dehydropeptides 10.1016/S0040-4020(01)87539-6
Diffusion Coefficient of CO2 Molecules as Determined by 13C NMR in Various Carbonated Beverages 10.1021/jf034693p
Computer-aided spectral assignment in nuclear magnetic resonance spectroscopy 10.1016/0003-2670(91)87045-9
A simple scheme for the design of solvent-suppression pulses 10.1016/S1090-7807(02)00003-4
Correlation Spectroscopy with Two Simultaneous Soft Pulses (TSETSE) 10.1006/jmra.1995.1011
Alkaloids from stem bark and leaves of Peschiera buchtieni 10.1016/0031-9422(95)00050-H
Limonoid derivatives from Astrotrichilia voamatata 10.1016/S0031-9422(99)00488-4
In Vitro Dermo-Cosmetic Evaluation of Bark Extracts from Common Temperate Trees 10.1055/s-0042-110180
Ring dihedral principal component analysis of furanose conformation 10.1039/9781849739986-00378
Metabolomics reveals simultaneous influences of plant defence system and fungal growth in Botrytis cinerea-infected Vitis vinifera cv. Chardonnay berries 10.1093/jxb/ers228
Alkaloids from root bark of Strychnos panganensis 10.1016/0031-9422(96)00362-7
Synthesis of 3-trialkylsilyl pyrazoles from β-oxo acylsilanes 10.1016/S0040-4039(00)01724-X
Use of magnetic resonance spectroscopy for the investigation of the CO 2 dissolved in champagne and sparkling wines: A nondestructive and unintrusive method 10.1016/j.aca.2004.11.054
Eremophilenolides from Hertia cheirifolia 10.1016/0031-9422(90)83039-4
Two-dimensional extensions of 1D HOHAHA experiments 10.1016/0022-2364(91)90200-D
Hydrolysis of wheat bran and straw by an endoxylanase: Production and structural characterization of cinnamoyl-oligosaccharides 10.1016/S0008-6215(99)00110-X
D:A-friedo-oleanane triterpenes from the stem bark of Phyllobotryon spathulatum 10.1016/S0031-9422(00)90818-5
NMR metabolomics to revisit the tobacco mosaic virus infection in Nicotiana tabacum leaves 10.1021/np050535b
HMQC Experiment with Single Scan per t1 Value and without Field Gradient Pulses 10.1006/jmra.1993.1191
Highly Viscous Binary Solvents: DMSO-d6/Glycerol and DMSO-d6/Glycerol-d8 for Polar and Apolar Mixture Analysis by NMR 10.1021/acs.analchem.6b00481
Diastereoselective hydrogenation of monodehydro enkephalins controlled by chiral rhodium catalysts 10.1016/S0957-4166(00)82083-2
Extreme direction analysis for blind separation of nonnegative signals 10.1016/j.sigpro.2016.07.016
A DISCO Approach to the Measurement of Heteronuclear Long-Range Coupling Constants 10.1006/jmrb.1994.1042
Fractionation of low-molecular-mass heparin by centrifugal partition chromatography in the ion-exchange displacement mode 10.1016/S0021-9673(01)00743-9
Antibacterial Polyketide Heterodimers from Pyrenacantha kaurabassana Tubers 10.1021/np5003252
Synthesis of new 4-(1-ethylthio-2,2,2-trifluoroethyl)-6-methylpyridazin- 3(2H)-ones starting from S-ethyl 4-oxo-2-(pentafluoroethyl)pentanethiolate and hydrazines 10.1016/j.jfluchem.2005.11.001
High-resolution and high-sensitivity 2D homonuclear J-resolved NMR spectroscopy 10.1002/mrc.2850
Use of the NEO strategy (Nucleophilic addition/Epoxide Opening) for the synthesis of a new C-galactoside ester analogue of KRN 7000 10.1016/j.bmcl.2011.02.044
Two bis-indole alkaloids from leaves of Ervatamia polyneura 10.1016/0031-9422(95)00392-K
The structural elucidation of a novel iridoid derivative from Tachiadenus longiflorus (Gentianaceae) using the LSD programme and quantum chemical computations 10.1002/pca.890
An alternative scheme for the multiplexed acquisition of 1D and 2D NMR spectra 10.1016/j.jmr.2010.06.005
16-epi-silicine, an alkaloid of the ervatamine-type from Pandaca caducifolia 10.1016/0031-9422(95)00271-8
Glycerol and glycerol carbonate as ultraviscous solvents for mixture analysis by NMR 10.1016/j.jmr.2011.06.021
Bipendensin, an Unusual Phenolic Acetal from Afzeua Bipendensis 10.1080/10575639308043880
Fast identification of radical scavengers from Securigera varia by combining <sup>13</sup>C-NMR-based Dereplication to Bioactivity-Guided Fractionation 10.3390/molecules200814970
Automatic first-order multiplet analysis in liquid-state NMR 10.1016/j.crci.2005.05.012
Two cyclopeptide alkaloids from Zizyphus lotus 10.1016/0031-9422(93)85186-U
Cembranolides from the stem bark of the southern African medicinal plant, Croton gratissimus (Euphorbiaceae) 10.1016/j.phytochem.2010.05.014
Clean Selective Excitation of Heteronuclear Spin Systems 10.1006/jmra.1993.1212
Identification of natural metabolites in mixture: A pattern recognition strategy based on 13C NMR 10.1021/ac403223f
Automatic identification of terpenoid skeletons by feed-forward neural networks 10.1016/j.aca.2006.07.023
Computer‐assisted elucidation of structures of natural products 10.1002/pca.2800030403
Band-Selective Pulses Designed to Accommodate Relaxation 10.1006/jmra.1994.1056
Erratum: Quantification of chitinase and thaumatin-like proteins in grape juices and wines (Analytical and Bioanalytical Chemistry DOI: 10.1007/s00216-011-4912-8) 10.1007/s00216-011-5053-9
Oversampling in Two-Dimensional NMR 10.1006/jmra.1994.1213
A New Route to Long-Range 13C-H Couplings 10.1006/jmra.1994.1215
Application of blind source separation to 1-D and 2-D nuclear magnetic resonance spectroscopy 10.1109/97.704974
Simplification of Complex Proton NMR Spectra 10.1016/0040-4039(93)85104-5
Ion-exchange centrifugal partition chromatography: A methodological approach for peptide separation 10.1016/j.chroma.2012.03.010
Recent advances in the structure elucidation of small organic molecules by the LSD software 10.1002/mrc.3965
Origin of Chiral Induction in Radical Reactions with the Diastereoisomers (5R)- and (5S)-5-l-Menthyloxyfuran-2[5H]-one 10.1021/jo030292x
Anion-exchange displacement centrifugal partition chromatography 10.1021/ac049499w
Strong ion-exchange centrifugal partition chromatography as an efficient method for the large-scale purification of glucosinolates 10.1016/j.chroma.2007.09.004
S3EPY: A Sparky extension for determination of small scalar couplings from spin-state-selective excitation NMR experiments 10.1007/s10858-009-9392-1
Stepwise elution of a three-phase solvent system in centrifugal partition extraction: A new strategy for the fractionation and phytochemical screening of a crude bark extract 10.1002/pca.2418
The debranching enzyme complex missing in glycogen accumulating mutants of Chlamydomonas reinhardtii displays an isoamylase-type specificity 10.1016/S0168-9452(00)00256-9
New entries into the indolizino[8,7-b]indole ring system 10.1016/S0040-4020(99)00537-2
Human developmental anatomy: Microscopic magnetic resonance imaging (μMRI) of four human embryos (from Carnegie Stage 10 to 20) 10.1016/j.aanat.2014.07.004
Gnetulin, a dimer of 3′,4,5′-trihydroxy-3-methoxystilbene from gnetum ula 10.1016/S0040-4020(01)80565-2
Unveiling the interplay between diffusing CO2 and ethanol molecules in champagne wines by classical molecular dynamics and 13c nmr spectroscopy 10.1021/jz502025e
Purification of antibiotics from the biocontrol agent Streptomyces anulatus S37 by centrifugal partition chromatography 10.1016/j.jchromb.2013.11.008
Quantification of chitinase and thaumatin-like proteins in grape juices and wines 10.1007/s00216-011-4912-8
Bioactivity-guided identification of antimicrobial metabolites in Alnus glutinosa bark and optimization of oregonin purification by Centrifugal Partition Chromatography 10.1016/j.jchromb.2016.07.021
Alternative partial synthesis of bisindole alkaloids 10.1016/0040-4039(90)80173-J
Spectral aliasing: A super zoom for 2DNMR spectra. Principles and applications 10.2533/chimia.2010.235
Alkaloids fromAlstonia undulata 10.1016/0031-9422(90)80211-X
A geometric approach to blind separation of nonnegative and dependent source signals 10.1016/j.sigpro.2012.05.019
Encapsulation of contrast imaging agents by polypropyleneimine-based dendrimers 10.1002/jbm.a.34359
Nuclear magnetic resonance monitoring of centrifugal partition chromatography in pH-zone-refining mode 10.1016/S0021-9673(96)01038-2
A theoretical study of the biselective double pulsed field gradient spin-echo NMR experiment 10.1080/00268970701530975
Clerodane diterpenoids and an ursane triterpenoid from Salvia haenkei. Computer-assisted structural elucidation 10.1016/S0040-4020(97)00943-5
(l)- or (d)-Valine tert-butylamide grafted on permethylated β-cyclodextrin derivatives as new mixed binary chiral selectors. Versatile tools for capillary gas chromatographic enantioseparation 10.1016/j.chroma.2009.02.090
Alkaloids from alstonia undulifolia 10.1016/0031-9422(92)80085-S
Glucosinolate Diversity in Bretschneidera sinensis of Chinese Origin 10.1021/acs.jnatprod.5b00338
Sapelenins A, B and C, acyclic triterpenoids from the stem bark of Entandrophragma cylindricum 10.1016/S0031-9422(00)90854-9
Application of biselective refocusing soft pulses to the simplification of heteronuclear correlation spectra 10.1016/j.jmr.2007.11.011
Exploiting the Complementarity between Dereplication and Computer-Assisted Structure Elucidation for the Chemical Profiling of Natural Cosmetic Ingredients: Tephrosia purpurea as a Case Study 10.1021/acs.jnatprod.5b00174
A New Form of Correlation Spectroscopy 10.1006/jmra.1994.1077
Determination and prediction of the average polymerization degree of alkyl polyglucosides 10.1016/S0003-2670(01)01066-2
Preparative isolation of glucosinolates from various edible plants by strong ion-exchange centrifugal partition chromatography 10.1016/j.seppur.2011.07.001
The Antitumor Properties of the α3(IV)-(185-203) Peptide from the NC1 Domain of Type IV Collagen (Tumstatin) Are Conformation-dependent 10.1074/jbc.M307736200
Second-order blind source separation in the Fourier space of data 10.1016/S0165-1684(02)00447-4
Inferential Signal Processing Applied to NMR Spectroscopy 10.1006/jmra.1995.0747
Synthesis of a protected monodehydro Leu-enkephalin and its hydrogenation catalyzed by chiral rhodium complexes 10.1016/S0040-4039(00)84699-7
Structure verification through computer-assisted spectral assignment of NMR spectra 10.1002/mrc.3908
Application of the quiral program to the challenge of myoinositol synthesis 10.1021/ci700148g
Alkaloid from leaves and stems of Vallesia glabra 10.1055/s-2006-958014
quiral: a computer program for the synthesis of chiral molecules from sugars 10.1016/j.tetlet.2007.02.001
Improvement of HSQC and HMBC experiments by J-modulation, t1-noise reduction and spectral domain selection. Application to the study of nosiheptide 10.1002/(SICI)1097-458X(199603)34:3<185::AID-OMR866>3.0.CO;2-6
Multiple dual-mode centrifugal partition chromatography, a semi-continuous development mode for routine laboratory-scale purifications 10.1016/j.chroma.2006.05.069
Enhancement of F1-Selective HMQC and HSQC Experiments by Field-Gradient Pulses 10.1006/jmra.1994.1119
Prediction of proton NMR couplings in flexible ring systems: Application to the stereochemical analysis of synthetic β-substituted tryptophans 10.1002/mrc.1207
Purification of rosmarinic acid by strong ion-exchange centrifugal partition chromatography 10.1081/JLC-200063599
Rational improvement of centrifugal partition chromatographic settings for the production of 5-n-alkylresorcinols from wheat bran lipid extract: I. Flooding conditions - Optimizing the injection step 10.1016/S0021-9673(03)00879-3
(+)-7′,7′-Dimethyl-5-hydroxy-2R,3S-trans-pubeschin from Entandrophragma cylindricum 10.1016/0031-9422(94)85093-3
Computer-assisted structural elucidation. Alkaloids with a novel diaza- adamantane skeleton from the seeds of Acosmium panamense (Fabaceae) 10.1016/S0040-4020(99)00661-4
Dereplication strategies in natural product research: How many tools and methodologies behind the same concept? 10.1007/s11101-015-9448-7
Chemical compounds from Eperua falcata and Eperua grandiflora heartwood and their biological activities against wood destroying fungus (Coriolus versicolor) 10.1007/s00107-006-0120-1
Biselective refocusing pulses and the SERF experiment 10.1016/j.jmr.2007.05.001
Blind source separation of positive and partially correlated data 10.1016/j.sigpro.2005.03.006
Delevoyin C, a tetranortriterpenoid from Entandrophragma delevoyi 10.1016/S0031-9422(99)00546-4
Isolation of indole alkaloids from Catharanthus roseus by centrifugal partition chromatography in the pH-zone refining mode 10.1016/S0021-9673(99)00495-1
Logic for structure determination 10.1016/S0040-4020(01)80878-4
Selective HMBC Experiments Using Soft Inversion Pulses 10.1006/jmrb.1994.1011
An unexpected rearrangement giving a new thiosubstituted carbohydrate 10.1016/j.carres.2010.03.024
Dereplication of depsides from the lichen Pseudevernia furfuracea by centrifugal partition chromatography combined to 13C nuclear magnetic resonance pattern recognition 10.1016/j.aca.2014.07.009
Strychnohexamine from Strychnos icaja, a naturally occurring trimeric indolomonoterpenic alkaloid 10.1016/S0040-4039(02)00476-8
Temperature dependence of CO2 and ethanol diffusion in champagne wines: a joint molecular dynamics and 13C NMR study 10.1021/bk-2015-1203.ch005
Indolomonoterpenic alkaloids from Strychnos icaja roots 10.1016/S0031-9422(02)00612-X
Preparative isolation of huperzines A and B from Huperzia serrata by displacement centrifugal partition chromatography 10.1016/j.chroma.2006.11.065
Synthesis and biological evaluation of new penta- and heptacyclic indolo- and quinolinocarbazole ring systems obtained via Pd0 catalysed reductive N-heteroannulation 10.1039/c0ob00149j
Structural and Antitumor Properties of the YSNSG Cyclopeptide Derived from Tumstatin 10.1016/j.chembiol.2006.10.007
Novel seco-dibenzopyrrocoline alkaloid from Cryptocarya oubatchensis 10.1021/ol061435f
New and old NMR experiments for the resonance assignment of complex oligosaccharides-application to a cyclodextrin derivative 10.1002/mrc.2828
Moandaensine, a dimeric indole alkaloid from Strychnos moandaensis (Loganiaceae) 10.1016/j.phytol.2010.02.005
Limonoid derivatives from Cedrelopsis grevei 10.1016/S0040-4020(99)00653-5
Alkaloids from leaves and stem bark of Ervatamia peduncularis 10.1016/0031-9422(95)00152-W
Stereoselective triplet-sensitised radical reactions of furanone derivatives 10.1002/chem.200903045
Proton NMR spectroscopy assignment of D-glucose residues in highly acetylated starch 10.1016/S0008-6215(96)00314-X
A new synthesis of α,β-unsaturated aldehydes 10.1016/S0040-4039(01)80653-5
Anti-Cancer Activity of Resveratrol and Derivatives Produced by Grapevine Cell Suspensions in a 14 L Stirred Bioreactor 10.3390/molecules22030474
Small Molecule Mixture Analysis by Heteronuclear NMR under Spin Diffusion Conditions in Viscous DMSO-Water Solvent 10.1002/chem.201700636
Computer-aided Dereplication and Structure Elucidation of Natural Products at the University of Reims 10.1002/minf.201700027
Tutorial for the structure elucidation of small molecules by means of the LSD software 10.1002/mrc.4612
New oleanane saponins from the roots of Dendrobangia boliviana identified by LC-SPE-NMR 10.1002/mrc.4619
Two new bis-iridoids isolated from Scabiosa stellata and their antibacterial, antioxidant, anti-tyrosinase and cytotoxic activities 10.1016/j.fitote.2017.12.018
Reconstruction of HMBC Correlation Networks: A Novel NMR-Based Contribution to Metabolite Mixture Analysis 10.1021/acs.jcim.7b00653
Advanced NMR-Based Structural Investigation of Glucosinolates and Desulfoglucosinolates 10.1021/acs.jnatprod.7b00776
GABA and GABA-Alanine from the Red Microalgae Rhodosorus marinus Exhibit a Significant Neuro-Soothing Activity through Inhibition of Neuro-Inflammation Mediators and Positive Regulation of TRPV1-Related Skin Sensitization 10.3390/md16030096
NMReDATA, a standard to report the NMR assignment and parameters of organic compounds 10.1002/mrc.4737
Bioactive metabolites from the leaves of Withania adpressa 10.1080/13880209.2018.1499781
Accelerating Metabolite Identification in Natural Product Research: Toward an Ideal Combination of Liquid Chromatography–High-Resolution Tandem Mass Spectrometry and NMR Profiling, in Silico Databases, and Chemometrics 10.1021/acs.analchem.8b05112
Polar mixture analysis by NMR under spin diffusion conditions in viscous sucrose solution and agarose gel 10.1039/C8FD00226F
Glucosinolates of Lepidium graminifolium L. (Brassicaceae) from Croatia 10.1080/14786419.2019.1633643
Mixture Analysis in Viscous Solvents by NMR Spin Diffusion Spectroscopy: ViscY. Application to High- and Low-Polarity Organic Compounds Dissolved in Sulfolane/Water and Sulfolane/DMSO-d6 Blends 10.1021/acs.analchem.9b05725
Multiple solvent signal presaturation in <sup>13</sup>C NMR 10.5194/mr-2020-6
Abundant Extractable Metabolites from Temperate Tree Barks: The Specific Antimicrobial Activity of Prunus Avium Extracts 10.3390/antibiotics9030111
Response to referees #1 and #2 10.5194/mr-2020-6-AC1
New title for manuscript mr-2020-6 10.5194/mr-2020-6-AC2
The Zebra Mussel (Dreissena polymorpha) as a Model Organism for Ecotoxicological Studies: A Prior 1H NMR Spectrum Interpretation of a Whole Body Extract for Metabolism Monitoring 10.3390/metabo10060256
Multiple solvent signal presaturation and decoupling artifact removal in <sup>13</sup>C{<sup>1</sup>H} nuclear magnetic resonance 10.5194/mr-1-155-2020
Dereplication of Natural Extracts Diluted in Glycerin: Physical Suppression of Glycerin by Centrifugal Partition Chromatography Combined with Presaturation of Solvent Signals in 13C-Nuclear Magnetic Resonance Spectroscopy 10.3390/molecules25215061
1H-NMR metabolomics profiling of zebra mussel (Dreissena polymorpha): A field-scale monitoring tool in ecotoxicological studies 10.1016/j.envpol.2020.116048
Dereplication of Natural Extracts Diluted in Propylene Glycol, 1,3-Propanediol and Glycerin. Comparison of Leontopodium alpinum Cass. (Edelweiss) Extracts as a Case Study 10.3390/cosmetics8010010
The Three Pillars of Natural Product Dereplication. Alkaloids from the Bulbs of Urceolina peruviana (C. Presl) J.F. Macbr. as a Preliminary Test Case 10.3390/molecules26030637
NMReDATA: Tools and applications 10.1002/mrc.5146
Taxonomy-focused Natural Product Databases for Carbon-13 NMR-based Dereplication 10.20944/preprints202105.0701.v1
Virtual decoupling to break the Simplification Versus Resolution Trade Off in NMR of Complex Metabolic Mixtures 10.5194/mr-2021-48
Supplementary material to "Virtual decoupling to break the Simplification Versus Resolution Trade Off in NMR of Complex Metabolic Mixtures" 10.5194/mr-2021-48-supplement
Taxonomy-Focused Natural Product Databases for Carbon-13 NMR-Based Dereplication 10.3390/analytica2030006
ViscY NMR experiments in phosphoric acid as a viscous solvent for individualization of small molecules within mixtures by spin diffusion 10.1039/D1AN00899D
Virtual decoupling to break the simplification versus resolution trade-off in nuclear magnetic resonance of complex metabolic mixtures 10.5194/mr-2-619-2021