1H NMR Spectrum (1D, 500 MHz, H2O, predicted) (NP0206267)

Spectrum Details
NP-MRD ID:NP0206267
Compound name:3-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
Spectrum type:1H NMR Spectrum (1D, 500 MHz, H2O, predicted)
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?JSV
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Multiplets❮ ❯
8.01
8.01
6.92
6.74
6.46
5.80
5.30
4.87
4.22
4.19
4.05
4.04
4.04
4.01
4.01
3.83
3.82
3.67
3.51
3.46
3.45
3.42
1.27
Peak Assignment Table
Row No.Cluster MidpointNo. PeaksCoupling TypeNo. H'sAtom No.Peak Centers (ppm)
18.015ddd1
61
8.008.008.028.028.02
28.015ddd1
65
8.008.008.008.028.02
36.9210ddd2
62
64
6.916.916.936.936.936.916.916.916.936.93
46.742d1
66
6.746.74
56.462d1
78
6.466.46
65.802d1
60
5.795.81
75.302d1
58
5.295.31
84.876dt1
67
4.854.864.874.874.884.89
94.224dd1
88
4.214.224.224.23
104.194dd1
59
4.174.194.194.21
114.054dd1
90
4.044.054.054.06
124.042d2
81
82
4.034.05
134.042d2
69
70
4.034.05
144.014dd1
86
3.994.014.014.03
154.018m1
57
3.993.994.004.014.024.024.034.03
163.834dd1
84
3.813.833.833.85
173.8210dd1
72
3.793.803.813.813.823.823.833.833.843.85
183.677dt1
80
3.623.633.643.643.653.663.83
193.513t1
92
3.513.513.51
203.467dd1
74
3.433.453.453.463.463.483.48
213.458dd1
76
3.433.433.443.453.453.453.463.47
223.426td1
68
3.413.413.423.423.433.43
231.273t3
54
55
56
1.261.261.28
Experimental Conditions
Solvent:H2O
Nucleus:1H
Frequency:500 MHz
Documentation
Document DescriptionDownloadFile Size
Peak List (TXT)Download file6.21 KB
Peak Assignments (TXT)Download file1.36 KB
Spectra Image with Peak AssignmentsNot AvailableNot Available
Raw Spectrum ImageNot AvailableNot Available
nmrML File (NMRML)Download file571 KB
JCAMP-DX File (JDX)Download file166 KB
Raw Free Induction Decay file for spectral processingNot AvailableNot Available
Validation ReportNot AvailableNot Available
References
Not Available