1H NMR Spectrum (1D, 100 MHz, H2O, predicted) (NP0310363)
Spectrum Details
| NP-MRD ID: | NP0310363 |
|---|---|
| Compound name: | 3-{[(2s,3r,4s,5s,6r)-3-{[(2s,3r,4s,5r,6s)-3,4-dihydroxy-6-methyl-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one |
| Spectrum type: | 1H NMR Spectrum (1D, 100 MHz, H2O, 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 | 8.02 | 5 | ddd | 1 | 61 | 7.977.988.038.058.07 | |
| 2 | 8.00 | 5 | ddd | 1 | 65 | 7.957.977.998.048.05 | |
| 3 | 6.92 | 12 | ddd | 2 | 62 64 | 6.886.906.946.956.966.986.866.886.886.906.946.96 | |
| 4 | 6.43 | 2 | d | 1 | 66 | 6.426.44 | |
| 5 | 6.23 | 2 | d | 1 | 68 | 6.226.24 | |
| 6 | 5.90 | 2 | d | 1 | 58 | 5.885.92 | |
| 7 | 5.78 | 7 | m | 1 | 60 | 5.605.655.765.765.845.856.01 | |
| 8 | 5.30 | 2 | d | 1 | 83 | 5.265.34 | |
| 9 | 4.39 | 6 | dd | 1 | 80 | 4.324.344.374.414.434.46 | |
| 10 | 4.24 | 11 | dd | 1 | 59 | 4.114.124.154.204.214.224.264.294.304.354.44 | |
| 11 | 4.16 | 7 | dd | 1 | 78 | 4.054.084.154.174.204.224.25 | |
| 12 | 4.14 | 9 | m | 1 | 57 | 3.913.934.094.144.174.204.234.264.32 | |
| 13 | 4.11 | 7 | m | 2 | 71 72 | 4.024.074.274.024.074.074.24 | |
| 14 | 4.06 | 12 | dd | 1 | 76 | 3.923.933.974.014.024.054.064.094.104.114.164.27 | |
| 15 | 4.05 | 3 | t | 2 | 85 86 | 4.024.074.07 | |
| 16 | 3.87 | 8 | dd | 1 | 82 | 3.693.753.843.873.903.933.963.98 | |
| 17 | 3.85 | 4 | dd | 1 | 90 | 3.803.813.893.90 | |
| 18 | 3.82 | 4 | dd | 1 | 88 | 3.813.813.823.83 | |
| 19 | 3.82 | 19 | dd | 1 | 74 | 3.543.583.693.733.743.753.763.783.803.823.833.863.873.893.913.923.974.044.05 | |
| 20 | 3.63 | 25 | dt | 1 | 70 | 3.373.423.433.483.523.533.573.573.583.593.613.623.623.643.663.673.673.683.713.733.803.813.833.863.88 | |
| 21 | 3.63 | 8 | td | 1 | 84 | 3.573.583.623.623.633.643.673.69 | |
| 22 | 3.23 | 11 | dd | 1 | 92 | 3.143.143.153.213.223.233.233.243.303.313.31 | |
| 23 | 1.49 | 6 | dt | 3 | 54 55 56 | 1.461.521.461.521.461.52 | |
Experimental Conditions
| Solvent: | H2O |
|---|---|
| Nucleus: | 1H |
| Frequency: | 100 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 9.63 KB |
| Peak Assignments (TXT) | Download file | 1.35 KB |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 576 KB |
| JCAMP-DX File (JDX) | Download file | 177 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available