Clustering data with hclust algorithm for Metabolomic testing of a putative MDH inhibitor (global) (Study ST000475)

UHPLC NEGATIVE ION MODE (Analysis AN000740)
MetaboliteStructureF1F2
Fructose 1,6-bisphosphateME1549640.551.45
LysoPE (18:1)ME1549780.321.68
LysoPE (20:4)ME1549790.351.65
L-Tryptophan-13C11ME1549760.971.03
Tryptophan-2,3,3-D3ME1549880.981.02
CITRIC ACID-13C6ME1549570.941.06
3-tert-Butyladipic acidME1549500.961.04
Dinoterb (herbicide)ME1549610.961.04
GLYCEROL 2-PHOSPHATE/SN-GLYCEROL 3-PHOSPHATEME1549690.951.05
Mono-(2-Ethylhexyl) PhthalateME1549810.951.05
CMPME1549581.080.92
C6H12O6-HEXOSE/KETOSE/INOSITOLME1549551.030.97
GLUTATHIONEME1549671.040.96
N-ACETYL-DL-GLUTAMIC ACIDME1549821.800.20
N-ACETYL-L-ASPARTIC ACIDME1549831.790.21
CREATINEME1549591.730.27
SARCOSINE/BETA-ALANINEME1549861.720.28
HYPOXANTHINEME1549711.490.51
URIDINE-5-MONOPHOSPHATEME1549901.490.51
ASPARTATEME1549531.410.59
L-GLUTAMINEME1549751.420.58
GUANINEME1549701.440.56
L-GLUTAMIC ACIDME1549741.440.56
CITRATEME1549561.450.55
GLYCERALDEHYDE/LACTATEME1549681.460.54
INOSINEME1549721.620.38
ISOCITRIC ACIDME1549731.530.47
LysoPE (18:0)ME1549771.530.47
TAURINEME1549871.580.42
MALATEME1549801.560.44
PHOSPHOCHOLINEME1549851.570.43
N-ACETYLNEURAMINATEME1549841.210.79
ADPME1549521.160.84
DIHYDROXYACETONE PHOSPHATEME1549601.150.85
4-oxoprolineME1549511.350.65
D-RIBOSE 5-PHOSPHATE/RIBULOSE 5-PHOSPHATEME1549631.340.66
C12H22O11-DISACCHARIDE-(6C/6C; GLC-GLC/GLC-FRC/GAL-GLC)ME1549541.300.70
DISACCHARIDE (6C/6C)/2-alpha-D-glucosyl-D-glucoseME1549621.290.71
GLUCOSE/FRUCTOSE_R2ME1549661.270.73
GLUCOSE/FRUCTOSE_R1ME1549651.280.72
URATEME1549891.280.72

Factors:

F1Treatment:-
F2Treatment:MDH inhib
Data matrix
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