Clustering data with hclust algorithm for Different dose exposure of OPC-163493 on HepG2 cells (part-I) (Study ST001135)

CE UNSPECIFIED ION MODE/Triple quadrupole (Analysis AN001861)
MetaboliteStructureF1F2F3F4
IMPME2708370.880.841.380.90
GDPME2708300.820.841.331.01
Succinic acidME2708580.850.861.330.96
Coenzyme AME2708220.900.531.650.93
Oxoglutaric acidME2708490.690.581.571.17
AMPME2708180.730.691.630.95
GMPME2708350.700.751.640.91
3-hydroxy-3-methylglutaryl-CoAME2708110.640.761.561.04
ADPME2708160.730.811.490.97
Cis-Aconitic acidME2708200.811.010.641.45
Phosphoribosyl pyrophosphateME2708521.091.180.461.27
Glucose-1-phosphateME2708311.480.640.930.95
Pyruvic acidME2708530.961.200.860.98
Galactose-1-phosphateME2708291.180.850.851.12
Ribulose-5-phosphateME2708561.221.060.770.96
Malonyl-CoAME2708411.170.930.841.03
6-Phosphogluconic acidME2708131.180.990.831.00
UDP-glucoseME2708591.131.010.831.03
ADP-riboseME2708171.190.960.761.10
NADPHME2708471.171.040.741.06
Folic acidME2708241.031.090.920.96
Adenylsuccinic acidME2708151.171.020.900.91
Ribose-1-phosphateME2708541.100.960.960.97
2-hydroxyglutaric acidME2708071.110.980.920.99
XMPME2708601.111.010.890.99
3^,5^ cyclic GMPME2708101.080.801.140.98
Glycerol 3-phosphateME2708340.930.951.130.99
N-acetylglutamic acidME2708430.830.951.171.05
Lactic acidME2708390.880.881.181.06
Sedoheptulose 7-phosphateME2708570.910.901.111.09
Citric acidME2708210.900.980.951.17
Ketoisovaleric acidME2708380.900.941.041.12
3-Phosphoglyceric acidME2708121.080.910.921.09
Phosphoenolpyruvic acidME2708511.060.880.951.11
Fructose-1-phosphateME2708261.030.990.891.09
GTPME2708361.070.990.881.06
2-Phosphoglyceric acidME2708081.030.861.041.07
NADP+ME2708460.970.971.031.02
Glucose-6-phosphateME2708320.970.971.021.04
NAD+ME2708440.970.971.021.04
Fructose-6-phosphateME2708271.020.940.981.06
3^,5^ cyclic AMPME2708090.990.990.951.07
ATPME2708191.000.980.971.04
Acetyl-CoAME2708140.910.99NA1.12
Mevalonic acidME2708421.250.74NA0.89
Fumaric acidME2708281.491.410.041.06
2,3-Diphosphoglyceric acidME2708061.621.140.170.65
Glyceraldehyde-3-phosphateME2708331.491.150.240.74
PhosphocreatineME2708501.231.110.621.04
N-carbamoylaspartic acidME2708481.531.210.360.91
Fructose-1,6-biphosphateME2708251.371.150.590.89
NADHME2708451.471.130.600.80
Xylulose-5-phosphateME2708611.421.130.610.84
Dihydroxyacetone phosphateME2708231.381.240.450.94
Malic acidME2708401.381.150.471.01
Ribose-5-phosphateME2708551.381.120.530.96

Factors:

F1Treatment:-
F2Treatment:1
F3Treatment:10
F4Treatment:3
Data matrix
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