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Synthesis and biological evaluation of highly potent fungicidal deoxy-hygrophorones
Toni Ditfe, Eileen Bette, Haider N. Sultani, Alexander Otto, Ludger A. Wessjohann, Norbert Arnold, Bernhard Westermann
European Journal of Organic Chemistry 2021, DOI: 10.1002/ejoc.202100729.
Description
The dataset, prepared for publication under NFDI4Chem stewardship and published in RADAR, contains NMR and MS data in the instrument manufacturers formats as well as in open formats such as JCAMP-DX, NMReDATA (Mnova 14.1.1) for NMR data and mzML for MS data. Results from the bioassay are available as tabular files and as CSV. Additionally, all structures are provided as CTfiles and are listed, corresponding to their numbering in the publication, in a CSV also including IPB 3LC lab journal entries, SMILES structure codes and InChI and InChIKey identifiers. The corresponding scientific article references the dataset in the section on supporting information.
Links to datasets
curated by Tillmann G. Fischer (IPB/NFDI4Chem)
This list will be continuously updated with further publication dataset pairs.