1H NMR Spectrum (1D, 1000 MHz, D2O, predicted) (NP0013985)
Spectrum Details
| NP-MRD ID: | NP0013985 |
|---|---|
| Compound name: | Epothilone B |
| Spectrum type: | 1H NMR Spectrum (1D, 1000 MHz, D2O, predicted) |
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| Peak Assignment Table | |||||||
|---|---|---|---|---|---|---|---|
| Row No. | Cluster Midpoint | No. Peaks | Coupling Type | No. H's | Atom No. | Peak Centers (ppm) | |
| 1 | 6.87 | 1 | s | 1 | 40 | 6.87 | |
| 2 | 6.51 | 6 | dq | 1 | 39 | 6.516.516.516.516.516.51 | |
| 3 | 4.05 | 5 | dd | 1 | 73 | 4.034.044.054.064.07 | |
| 4 | 3.89 | 11 | ddd | 1 | 44 | 3.873.883.883.883.893.893.893.903.903.903.91 | |
| 5 | 3.89 | 6 | dd | 1 | 47 | 3.883.893.893.893.893.90 | |
| 6 | 3.49 | 4 | dd | 1 | 61 | 3.483.493.493.50 | |
| 7 | 2.58 | 6 | td | 1 | 38 | 2.572.572.582.582.592.59 | |
| 8 | 2.58 | 28 | ddd | 1 | 51 | 2.552.562.562.562.562.572.572.572.572.572.572.582.582.582.582.582.582.592.592.592.592.592.592.602.602.602.602.61 | |
| 9 | 2.58 | 13 | ddd | 2 | 45 46 | 2.562.562.572.582.582.592.602.602.572.572.582.592.59 | |
| 10 | 2.34 | 1 | s | 3 | 41 42 43 | 2.34 | |
| 11 | 2.12 | 8 | dq | 1 | 63 | 2.112.112.112.122.122.132.132.13 | |
| 12 | 2.09 | 8 | dd | 2 | 75 76 | 2.072.092.092.112.082.092.092.10 | |
| 13 | 2.00 | 23 | m | 1 | 53 | 1.981.981.981.981.991.991.991.991.992.002.002.002.002.012.012.012.012.012.012.022.022.022.03 | |
| 14 | 2.00 | 34 | m | 1 | 56 | 1.981.981.981.981.981.981.991.991.991.991.992.002.002.002.002.002.002.002.002.002.002.002.012.012.012.012.012.012.022.022.022.022.022.02 | |
| 15 | 1.75 | 5 | dd | 2 | 36 37 | 1.761.741.741.761.76 | |
| 16 | 1.71 | 33 | ddd | 1 | 52 | 1.671.681.681.681.681.691.691.691.691.691.691.691.701.701.701.701.701.701.711.711.711.711.711.711.711.721.721.721.721.731.771.771.79 | |
| 17 | 1.47 | 32 | m | 1 | 54 | 1.441.441.451.451.451.451.451.461.461.461.461.461.471.471.471.471.471.471.471.471.471.481.481.481.481.491.491.491.491.491.501.50 | |
| 18 | 1.44 | 32 | m | 1 | 57 | 1.421.421.431.431.431.431.431.431.431.431.431.441.441.441.441.441.441.441.441.441.441.441.451.451.451.451.451.451.451.451.461.46 | |
| 19 | 1.30 | 1 | s | 2 | 48 49 | 1.30 | |
| 20 | 1.30 | 43 | m | 1 | 55 | 1.271.271.281.281.281.281.281.281.281.291.291.291.291.291.291.291.291.291.301.301.301.301.301.301.301.301.311.311.311.311.311.311.311.311.321.321.321.321.321.321.321.321.33 | |
| 21 | 1.15 | 1 | s | 4 | 67 68 70 71 | 1.15 | |
| 22 | 1.12 | 2 | d | 1 | 64 | 1.121.12 | |
| 23 | 1.12 | 2 | d | 2 | 65 66 | 1.121.12 | |
| 24 | 0.97 | 2 | d | 3 | 58 59 60 | 0.970.97 | |
Experimental Conditions
| Solvent: | D2O |
|---|---|
| Nucleus: | 1H |
| Frequency: | 1000 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 17 KB |
| Peak Assignments (TXT) | Download file | 1.19 KB |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 585 KB |
| JCAMP-DX File | Not Available | Not Available |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available