Spectrum Details
NP-MRD ID:NP0234058
Compound name:(3,4,5-trihydroxy-6-{[4-hydroxy-2-(hydroxymethyl)-6-{6-methoxy-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-eneoxy}-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl]oxy}oxan-2-yl)methyl acetate
Spectrum type:1H NMR Spectrum (1D, 100 MHz, H2O, predicted)
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?JSV
Multiplets 
5.66
5.33
5.23
4.95
4.51
4.42
4.38
4.27
4.24
4.23
4.22
4.15
4.05
4.02
3.86
3.79
3.56
3.42
3.41
3.32
3.22
3.09
2.83
2.40
2.02
1.96
1.89
1.80
1.79
1.65
1.64
1.62
1.62
1.60
1.50
1.44
1.25
1.08
1.03
0.99
0.96
0.96
0.78
Peak Assignment Table
Row No.Cluster MidpointNo. PeaksCoupling TypeNo. H'sAtom No.Peak Centers (ppm)
15.666dt1
113
5.465.645.645.685.685.86
25.3314dd1
87
5.095.145.195.205.305.335.345.355.365.385.415.485.515.55
35.232d1
71
5.225.24
44.952d1
91
4.944.96
54.517m1
97
4.324.354.494.494.574.574.74
64.428dd1
112
4.344.364.404.424.424.444.484.50
74.3816ddd1
80
4.174.194.214.244.304.324.334.354.414.434.444.474.524.564.584.59
84.272d2
99
100
4.244.30
94.243t2
93
94
4.214.264.26
104.234dd1
110
4.194.224.234.26
114.227dd1
122
4.164.164.204.214.264.274.31
124.154dd1
96
4.134.144.174.18
134.058dd1
120
3.964.014.014.024.064.084.114.12
144.0211dq1
114
3.893.953.963.984.014.024.054.074.084.084.14
153.8610td1
92
3.733.803.813.843.853.863.873.903.923.98
163.7938m1
90
3.393.473.543.543.573.583.593.623.643.653.673.703.723.733.743.753.763.783.783.803.823.833.843.863.883.893.893.903.913.943.954.004.004.024.034.064.074.14
173.5616dd1
118
3.273.343.443.453.493.503.513.523.563.573.653.673.693.723.743.76
183.428dd1
104
3.393.393.403.413.433.443.453.46
193.416dd1
106
3.343.343.393.413.463.50
203.321s3
68
69
70
3.32
213.2212dd1
108
3.113.133.183.193.203.233.243.253.263.273.313.32
223.095td1
98
2.983.033.093.143.19
232.8333m1
76
2.542.582.592.612.622.662.692.712.722.742.752.772.792.802.822.832.842.852.852.872.882.882.892.922.932.942.962.983.013.053.063.083.08
242.408dd2
88
89
2.212.362.442.592.282.362.442.52
252.021s3
101
102
103
2.02
261.9641m2
124
125
1.691.751.801.821.861.881.911.931.941.991.992.022.032.062.082.092.112.142.152.182.231.721.781.821.841.861.871.881.891.911.931.961.971.981.991.992.012.032.082.132.18
271.8915m1
140
1.781.791.811.821.851.861.871.881.891.921.931.951.961.992.02
281.8041ddd2
85
86
1.581.591.601.621.621.641.651.651.661.681.741.751.781.781.851.861.861.881.891.941.961.961.992.002.002.011.641.711.721.731.731.741.771.771.791.801.851.932.012.062.07
291.797dd1
139
1.711.741.791.821.831.841.85
301.6529ddd2
72
73
1.371.401.421.441.481.511.551.561.601.621.631.671.741.751.761.771.821.841.871.481.591.621.631.661.681.701.851.871.90
311.6414ddd2
81
82
1.551.611.641.651.661.671.731.431.521.551.631.661.751.87
321.6233m1
84
1.421.431.441.451.461.481.511.521.551.561.561.571.581.591.601.611.631.631.651.661.671.681.691.711.721.731.741.751.771.781.801.821.83
331.6236ddd2
126
127
1.331.441.501.551.581.591.601.631.651.661.671.701.711.741.751.761.851.351.411.431.461.471.491.531.581.601.621.641.651.661.661.731.761.781.801.85
341.6033m2
74
75
1.361.401.441.471.481.541.561.591.611.621.671.681.701.731.761.821.371.431.471.491.511.541.551.571.581.601.621.681.691.721.731.821.84
351.5036m2
132
133
1.151.241.291.311.311.371.391.461.481.521.531.541.631.661.681.691.741.831.251.271.361.381.381.401.411.471.501.521.531.571.581.631.631.681.731.75
361.4432ddd2
134
135
1.181.251.271.301.351.351.371.401.421.461.471.491.511.531.581.621.631.721.151.251.351.351.371.411.431.461.481.491.521.571.611.63
371.254q3
115
116
117
1.241.241.241.30
381.0813ddd1
83
0.950.960.980.991.071.081.081.091.101.111.181.201.23
391.034q3
77
78
79
1.061.001.001.06
400.991s3
128
129
130
0.99
410.9644ddd1
131
0.650.660.690.710.740.760.770.770.790.810.810.840.850.860.880.890.900.910.920.940.940.960.970.980.981.001.021.031.031.061.071.071.081.111.131.131.151.171.191.221.231.241.261.28
420.969m3
141
142
143
0.850.940.951.010.910.950.951.011.05
430.781s3
136
137
138
0.78
Experimental Conditions
Solvent:H2O
Nucleus:1H
Frequency:100 MHz
Documentation
Document DescriptionDownloadFile Size
Peak List (TXT)Download file34.6 KB
Peak Assignments (TXT)Download file2.32 KB
Spectra Image with Peak AssignmentsNot AvailableNot Available
Raw Spectrum ImageNot AvailableNot Available
nmrML File (NMRML)Download file623 KB
JCAMP-DX File (JDX)Download file215 KB
Raw Free Induction Decay file for spectral processingNot AvailableNot Available
Validation ReportNot AvailableNot Available
References
Not Available