NP-MRD Statistics
Natural Product Statistics
| Description | Count |
|---|---|
| Total Number of Compounds in NP-MRD | 281,859 |
| Number of Compounds from HMDB | 879 |
| Number of Compounds from BMRB | 284 |
| Number of Compounds from JEOL CH-NMR-NP | 19,025 |
| Number of Compounds from NPATLAS | 20,468 |
| Number of Compounds from NP-MRD Team Backfilling | 185 |
| Number of Compounds deposited via NPN-Dep | 3,303 |
| Number of Compounds with Experimental Spectra | 3,672 |
| Number of Compounds with Experimental NMR Assignments | 22,491 |
| Number of Compounds with Simulated NMR Spectra | 22,491 |
| Number of Compounds with Predicted NMR Spectra | 251,536 |
Spectra Statistics
| Description | Count |
|---|---|
| Total Number of Experimental NMR Spectra | 19,045 |
| Number of Experimental 1D NMR Spectra | 18,259 |
| Number of Experimental 2D NMR Spectra | 786 |
| Number of Experimental 1D 1H NMR Spectra | 13,395 |
| Number of Experimental 1D 13C NMR Spectra | 4,864 |
| Total Number of Simulated NMR Spectra | 416,405 |
| Number of Simulated 1D 1H NMR Spectra | 208,252 |
| Number of Simulated 1D 13C NMR Spectra | 208,153 |
| Total Number of Predicted NMR Spectra | 5,043,694 |
| Number of Predicted 1D 1H NMR Spectra | 2,521,829 |
| Number of Predicted 1D 13C NMR Spectra | 2,521,865 |
| Total Number of Spectra (experimental, simulated and predicted) | 5,479,144 |