Developments in computational omics technologies have provided new means to access
the hidden diversity of natural products, unearthing new potential for drug discovery. In …

Natural products and their structural analogues have historically made a major contribution
to pharmacotherapy, especially for cancer and infectious diseases. Nevertheless, natural …

Metabolomics using nontargeted tandem mass spectrometry can detect thousands of
molecules in a biological sample. However, structural molecule annotation is limited to …

Abstract Global Natural Product Social Molecular Networking (GNPS) is an interactive online
small molecule–focused tandem mass spectrometry (MS2) data curation and analysis …

Indole alkaloids represent a large subset of natural products, with more than 4100 known
compounds. The majority of these alkaloids are biologically active, with some exhibiting …

Covering: up to the end of 2020 Recently introduced computational metabolome mining
tools have started to positively impact the chemical and biological interpretation of …

Natural product synthesis remains one of the most vibrant and intellectually rewarding areas
of chemistry, although the justifications for pursuing it have evolved over time. In the early …

Microbial biochemistry is central to the pathophysiology of inflammatory bowel diseases
(IBD). Improved knowledge of microbial metabolites and their immunomodulatory roles is …

Under the guidance of the approach which integrates molecular networking,
MolNetEnhancer and Network Annotation Propagation (NAP), daphnaltaicanoids A and B (1 …

Molecular networking of non-targeted tandem mass spectrometry data connects structurally
related molecules based on similar fragmentation spectra. Here, we report the Chem ical …