13C NMR Spectrum (1D, 252 MHz, H2O, predicted) (NP0311904)
Spectrum Details
| NP-MRD ID: | NP0311904 |
|---|---|
| Compound name: | (2s,3s,4s,5r,6r)-6-{[(3ar,3br,5as,7s,9as,9bs,11as)-2-hydroxy-9a,11a-dimethyl-1-[(2r)-6-methyl-4-oxoheptan-2-yl]-3-oxo-3ah,3bh,4h,5h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid |
| Spectrum type: | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) |
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| Peak Assignment Table | |||||||
|---|---|---|---|---|---|---|---|
| Row No. | Cluster Midpoint | No. Peaks | Coupling Type | No. C's | Atom No. | Peak Centers (ppm) | |
| 1 | 182.50 | 1 | s | 1 | 13 | 182.50 | |
| 2 | 174.81 | 1 | s | 1 | 26 | 174.81 | |
| 3 | 151.34 | 1 | s | 1 | 11 | 151.34 | |
| 4 | 132.07 | 1 | s | 1 | 10 | 132.07 | |
| 5 | 103.98 | 1 | s | 1 | 23 | 103.98 | |
| 6 | 76.79 | 1 | s | 1 | 21 | 76.79 | |
| 7 | 76.30 | 1 | s | 1 | 31 | 76.30 | |
| 8 | 74.14 | 1 | s | 1 | 25 | 74.14 | |
| 9 | 74.02 | 1 | s | 1 | 33 | 74.02 | |
| 10 | 72.75 | 1 | s | 1 | 29 | 72.75 | |
| 11 | 58.38 | 1 | s | 1 | 15 | 58.38 | |
| 12 | 52.40 | 1 | s | 1 | 4 | 52.40 | |
| 13 | 50.86 | 1 | s | 1 | 39 | 50.86 | |
| 14 | 44.80 | 1 | s | 1 | 19 | 44.80 | |
| 15 | 43.37 | 1 | s | 1 | 7 | 43.37 | |
| 16 | 42.90 | 1 | s | 1 | 16 | 42.90 | |
| 17 | 39.94 | 1 | s | 1 | 42 | 39.94 | |
| 18 | 37.60 | 1 | s | 1 | 36 | 37.60 | |
| 19 | 37.39 | 1 | s | 1 | 41 | 37.39 | |
| 20 | 35.76 | 1 | s | 1 | 37 | 35.76 | |
| 21 | 34.50 | 1 | s | 1 | 20 | 34.50 | |
| 22 | 33.95 | 1 | s | 1 | 8 | 33.95 | |
| 23 | 29.50 | 1 | s | 1 | 35 | 29.50 | |
| 24 | 28.45 | 1 | s | 1 | 18 | 28.45 | |
| 25 | 25.28 | 1 | s | 1 | 17 | 25.28 | |
| 26 | 24.60 | 1 | s | 1 | 2 | 24.60 | |
| 27 | 22.60 | 1 | s | 1 | 3 | 22.60 | |
| 28 | 22.60 | 1 | s | 1 | 1 | 22.60 | |
| 29 | 20.60 | 1 | s | 1 | 43 | 20.60 | |
| 30 | 20.52 | 1 | s | 1 | 40 | 20.52 | |
| 31 | 19.08 | 1 | s | 1 | 9 | 19.08 | |
| 32 | 18.22 | 1 | s | 1 | 38 | 18.22 | |
Experimental Conditions
| Solvent: | H2O |
|---|---|
| Nucleus: | 13C |
| Frequency: | 1000 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 1.62 KB |
| Peak Assignments (TXT) | Download file | 1.42 KB |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 566 KB |
| JCAMP-DX File (JDX) | Download file | 155 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available