Np mrd loader

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What is the NMR predictor?

The 13C NMR predictor is a machine learning-based predictor for small molecules. The predictor accepts the molecular structure and returns the predicted 13C chemical shift values in ppm in D2O, CDCL3, DMSO or CD3OD solvent. Add the structure of your natural product by pasting a SMILES or InChI string into the MarvinJS structure drawing applet below. Alternatively, you can use the applet to draw your structure or to upload an '.sdf' file. To learn how to draw a structure in MarvinJS, click on MarvinJS Tutorials

Input form for 13C Chemical Shift Prediction