13C NMR Spectrum (1D, 75 MHz, H2O, predicted) (NP0160387)
Spectrum Details
| NP-MRD ID: | NP0160387 |
|---|---|
| Compound name: | 5,13-bis(3,4-dihydroxyphenyl)-7-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-8-yl]-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2,8,10,15,17,19-hexaene-6,9,17,19,21-pentol |
| Spectrum type: | 13C NMR Spectrum (1D, 75 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 | 159.26 | 1 | s | 1 | 44 | 159.26 | |
| 2 | 159.26 | 1 | s | 1 | 22 | 159.26 | |
| 3 | 158.02 | 1 | s | 1 | 2 | 158.02 | |
| 4 | 156.51 | 1 | s | 1 | 4 | 156.51 | |
| 5 | 156.30 | 1 | s | 1 | 50 | 156.30 | |
| 6 | 155.40 | 1 | s | 1 | 47 | 155.40 | |
| 7 | 154.17 | 1 | s | 1 | 7 | 154.17 | |
| 8 | 152.48 | 1 | s | 1 | 25 | 152.48 | |
| 9 | 152.21 | 1 | s | 1 | 20 | 152.21 | |
| 10 | 146.83 | 1 | s | 1 | 14 | 146.83 | |
| 11 | 145.94 | 1 | s | 1 | 37 | 145.94 | |
| 12 | 145.81 | 1 | s | 1 | 56 | 145.81 | |
| 13 | 145.81 | 1 | s | 1 | 35 | 145.81 | |
| 14 | 145.68 | 1 | s | 1 | 58 | 145.68 | |
| 15 | 145.46 | 1 | s | 1 | 16 | 145.46 | |
| 16 | 131.14 | 1 | s | 1 | 53 | 131.14 | |
| 17 | 130.99 | 1 | s | 1 | 32 | 130.99 | |
| 18 | 129.30 | 1 | s | 1 | 11 | 129.30 | |
| 19 | 125.50 | 1 | s | 1 | 12 | 125.50 | |
| 20 | 120.36 | 1 | s | 1 | 54 | 120.36 | |
| 21 | 119.85 | 1 | s | 1 | 33 | 119.85 | |
| 22 | 115.90 | 1 | s | 1 | 60 | 115.90 | |
| 23 | 115.83 | 1 | s | 1 | 34 | 115.83 | |
| 24 | 115.73 | 1 | s | 1 | 55 | 115.73 | |
| 25 | 115.43 | 1 | s | 1 | 13 | 115.43 | |
| 26 | 115.20 | 1 | s | 1 | 39 | 115.20 | |
| 27 | 111.53 | 1 | s | 1 | 43 | 111.53 | |
| 28 | 111.53 | 1 | s | 1 | 24 | 111.53 | |
| 29 | 107.48 | 1 | s | 1 | 18 | 107.48 | |
| 30 | 107.14 | 1 | s | 1 | 26 | 107.14 | |
| 31 | 104.25 | 1 | s | 1 | 6 | 104.25 | |
| 32 | 102.35 | 1 | s | 1 | 49 | 102.35 | |
| 33 | 101.89 | 1 | s | 1 | 10 | 101.89 | |
| 34 | 99.30 | 1 | s | 1 | 21 | 99.30 | |
| 35 | 98.26 | 1 | s | 1 | 3 | 98.26 | |
| 36 | 96.60 | 1 | s | 1 | 8 | 96.60 | |
| 37 | 96.00 | 1 | s | 1 | 46 | 96.00 | |
| 38 | 81.68 | 1 | s | 1 | 52 | 81.68 | |
| 39 | 78.15 | 1 | s | 1 | 31 | 78.15 | |
| 40 | 74.22 | 1 | s | 1 | 40 | 74.22 | |
| 41 | 68.02 | 1 | s | 1 | 28 | 68.02 | |
| 42 | 66.90 | 1 | s | 1 | 61 | 66.90 | |
| 43 | 44.80 | 1 | s | 1 | 42 | 44.80 | |
| 44 | 29.85 | 1 | s | 1 | 63 | 29.85 | |
| 45 | 29.14 | 1 | s | 1 | 27 | 29.14 | |
Experimental Conditions
| Solvent: | H2O |
|---|---|
| Nucleus: | 13C |
| Frequency: | 300 MHz |
Documentation
| Document Description | Download | File Size |
|---|---|---|
| Peak List (TXT) | Download file | 2.36 KB |
| Peak Assignments (TXT) | Download file | 1.41 KB |
| Spectra Image with Peak Assignments | Not Available | Not Available |
| Raw Spectrum Image | Not Available | Not Available |
| nmrML File (NMRML) | Download file | 570 KB |
| JCAMP-DX File (JDX) | Download file | 161 KB |
| Raw Free Induction Decay file for spectral processing | Not Available | Not Available |
| Validation Report | Not Available | Not Available |
References
Not Available