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In this article, we introduced a modern and innovative web interface for the management of a secondary metabolite database.
#Chemdoodle isotopes password
The SistematX homepage allows the user to log into the data management area using a login name and password and gain access to administration pages.
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The SistematX ( ) interface is implemented considering the following aspects: (a) the ability to search by structure, SMILES (Simplified Molecular-Input Line-Entry System) code, compound name and species (b) the ability to save chemical structures found by searching (c) compound data results include important characteristics for natural products chemistry and (d) the user can find specific information for taxonomic rank (from family to species) of the plant from which the compound was isolated, the searched-for molecule, and the bibliographic reference and Global Positioning System (GPS) coordinates. The large amounts of data already produced and the science of metabolomics reveal new questions: Are these compounds known or new? How fast can this information be obtained? To answer these and other relevant questions, an appropriate procedure to correctly store information on the data retrieved from the discovered metabolites is necessary. However, along this long scientific path, much information is lost or restricted to a specific niche. The traditional work of a natural products researcher consists in large part of time-consuming experimental work, collecting biota to prepare and analyze extracts and to identify innovative metabolites.