Clustering data with hclust algorithm for (Study ST001764)

(Analysis AN002871)
MetaboliteStructureF1F2F3F4
GSH_13C2-15N-EllmansME4081701.05NANA0.75
trans-urocanic acidME4082590.730.340.492.43
GSH_EllmansME4081710.770.01NA1.44
Phenylacetyl glutamineME4082240.220.190.421.59
hypoxanthineME4081840.63NA0.451.96
adenosineME4080870.20NANA1.80
NADPHME4082150.33NA0.172.16
GSSGME4081730.552.501.000.22
xanthineME4082740.432.550.740.58
aspartate-13C6-15N4ME4081040.432.720.700.47
dihydroxyacetone_phosphateME4081400.382.810.670.48
Carbamoyl AspartateME4081130.301.690.760.46
pseudouridineME4082390.552.150.910.61
aspartateME4081030.512.350.810.59
uric acidME4082690.532.250.840.62
folateME4081480.661.861.090.57
glycerateME4081630.711.910.910.63
acetoacetateME4080770.480.051.570.56
cystineME4081330.650.362.160.83
ascorbateME4081010.920.001.361.67
2-hydroxyglutarateME4080670.930.021.491.47
Itaconic AcidME4081900.920.011.491.48
3-methyl-2-oxopentanoic_acidME4080720.900.541.241.29
sarcosineME4082480.780.551.371.29
GDPME4081560.770.401.271.55
ADPME4080880.800.501.241.44
Alpha-KetoglutarateME4080940.740.591.221.43
GMPME4081680.510.381.491.22
uridineME4082700.740.411.581.33
6-phosphogluconateME4080760.810.361.621.14
succinateME4082530.850.341.541.25
guanidinoacetateME4081750.95NA0.931.12
AMPME4080961.100.241.201.36
anserineME4080971.160.401.171.20
S-methylcysteineME4082521.170.361.191.24
guanineME4081760.990.040.771.54
2-aminoadipateME4080641.020.140.921.82
cytosineME4081351.250.080.751.81
adenineME4080860.30NA0.892.03
cytidineME4081340.680.351.011.89
dTMPME4081420.430.981.491.54
GSHME4081690.000.911.151.34
NADHME4082130.980.890.441.42
NADPME4082140.851.291.280.64
PyridoxalME4082400.611.501.300.73
2,3-BPGME4080630.621.590.970.98
glutamate-13C5,15NME4081600.741.550.940.89
F6P_G1PME4081460.701.600.960.87
Sedoheptulose-7-phosphateME4082490.711.600.970.85
taurineME4082540.671.541.040.91
dTTPME4081430.671.521.100.84
Glucose 6-phosphateME4081580.681.581.050.83
Methionine sulfoxideME4082010.781.700.920.73
trimethyllysineME4082600.671.810.890.80
xanthosineME4082750.691.670.910.80
UDP-hexoseME4082660.651.700.970.84
Ribose 1-phosphateME4082430.661.730.920.85
Ribose_Ribulose 5-phosphateME4082440.651.730.920.85
erythrose_4-phosphateME4081450.561.390.770.77
phosphoserineME4082310.591.330.970.82
serine-13C3-15NME4082510.841.290.801.13
acetylserineME4080850.771.450.890.99
dCytidineME4081370.701.380.941.09
acetylmethionineME4080840.721.370.871.13
N-acetylmethionineME4082090.731.360.871.13
ButyrylcarnitineME4081100.721.221.240.91
phosphoenolpyruvateME4082290.771.201.160.94
CTPME4081270.741.241.160.94
UTPME4082710.741.251.150.94
ATPME4081060.681.401.150.89
GTPME4081740.691.321.190.90
orotateME4082200.811.331.150.79
3-phosphoglycerateME4080730.741.371.130.86
niacinamideME4082160.781.311.140.86
inosineME4081870.661.451.160.99
CDPME4081160.731.311.090.97
O-phosphoethanolamineME4082180.771.271.011.03
citrateME4081200.741.451.060.86
glutamateME4081590.741.470.990.90
GARME4081550.811.340.970.97
AICARME4080900.711.411.020.98
fumarateME4081520.771.371.040.91
malateME4081980.761.410.990.94
Glycerol 3-PhosphateME4081640.751.371.000.97
hydroxyproline_gammaALAME4081820.751.381.020.94
PiridoxineME4082340.711.171.330.88
cis-aconitateME4081190.771.051.300.93
creatinineME4081260.741.091.320.94
hypotaurineME4081830.730.761.271.29
glutamineME4081610.840.761.141.26
UMPME4082670.890.701.171.23
PipecolateME4082330.800.791.231.19
lysineME4081960.870.821.151.17
tyrosineME4082620.830.861.121.22
dUMPME4081440.780.981.131.27
leucine-13C6-15NME4081950.830.970.991.25
Isoleucine-13C6-15NME4081890.810.961.021.25
leucineME4081940.810.971.011.25
PRPPME4082380.800.981.051.22
asparagineME4081020.810.971.061.19
threonineME4082560.820.951.081.19
threonine-13C4-15NME4082570.821.011.051.16
tyrosine-13C9-15NME4082630.810.981.091.15
histidineME4081780.890.881.031.21
methionine-13C5-15NME4082020.810.921.011.30
valineME4082720.810.891.031.30
alanine-13C3-15NME4080920.790.861.071.31
methionineME4082000.830.851.061.28
GlycerophosphocholineME4081650.740.911.241.24
cholineME4081180.790.971.141.14
prolineME4082350.820.961.141.11
phosphocholineME4082270.760.981.201.14
arginineME4080980.800.931.241.13
phosphocreatineME4082280.780.911.181.16
cAMPME4081120.821.180.951.12
S-Adenosyl-L-HomocysteineME4082460.811.161.011.07
lactatic_acidME4081930.741.140.961.27
palmitateME4082210.781.070.971.24
isoleucineME4081880.771.081.021.19
valine-13C5-15NME4082730.791.081.021.16
PantothenateME4082230.911.081.110.93
CMPME4081220.791.221.111.11
dATPME4081360.761.111.191.00
propionylcarnitineME4082370.791.141.150.98
alanineME4080910.811.101.121.03
C5 CarnitinesME4081110.781.121.131.03
phosphoethanolamineME4082300.781.131.101.05
carnitineME4081140.751.131.131.08
NAD+ME4082120.731.141.141.07
methylthioadenosineME4082030.761.171.101.05
UDP-GlcNAcME4082650.761.171.091.05
acetylcarnitineME4080810.771.161.111.03
FADME4081470.761.161.121.04
phenylalanineME4082250.801.131.071.06
arginine-13C6,15N4ME4080990.831.121.061.04
argininosuccinateME4081000.841.091.081.04
glycineME4081660.791.091.071.11
beta-alanineME4081070.821.071.071.09
proline-13C5-15NME4082360.811.081.071.10
IMPME4081850.801.041.101.08
cystathionineME4081280.831.071.081.06
acetylaspartateME4080800.821.061.091.07
UDPME4082640.821.071.091.06
Acetyl CoAME4080780.751.041.201.07
lysine-13C6-15N2ME4081970.821.041.141.04
betaineME4081080.801.041.141.07
creatineME4081250.791.061.161.06
carnosineME4081150.931.150.941.02
homocitrullineME4081800.961.080.931.04
histidine-13C6-15N3ME4081790.900.991.021.11
N-acetylglutamineME4082080.910.951.041.12
S-Adenosyl-L-methionineME4082470.970.861.081.09
biotinME4081090.960.921.091.03
folic_acidME4081490.990.941.090.97
phenylalanine-13C9-15NME4082260.850.900.751.52
N-acetylglutamateME4082070.810.810.951.47
acetylglutamateME4080820.810.870.951.40
serineME4082500.790.850.961.43
kynurenineME4081920.870.820.901.41
tryptophanME4082610.860.840.971.35
citrullineME4081210.920.621.021.41
3-methyl-2-oxobutyrateME4080710.830.751.071.37
ornithineME4082190.890.711.011.38
Kynurenic AcidME4081911.200.790.911.11
gamma-glutamyl-alanineME4081541.080.630.951.27
N2-acetyllysineME4082050.980.651.071.25
formyl_methionineME4081500.291.361.870.52
5-Hydroxyindole-3-AcetateME408075NA0.991.08NA
glucoseME4081570.001.041.71NA
GSH-13C2_15NME408172NA1.180.30NA
Coenzyme AME408124NA1.190.880.54
pyruvateME408241NA1.310.721.01

Factors:

F1Factor:-
F2Factor:buffer B
F3Factor:buffer C
F4Factor:buffer C_Ellmans
Data matrix
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