Clustering data with hclust algorithm for (Study ST002667)

(Analysis AN004339)
MetaboliteStructureF1F2F3F4F5F6F7
warfarinME6310042.620.860.850.010.011.191.15
C14:0 SMME6310590.810.450.611.640.571.720.81
5-hydroxytryptopholME6308581.111.040.390.861.960.670.55
cAMPME6310731.110.910.900.911.690.870.53
21-deoxycortisolME6308510.580.950.900.790.951.940.83
C16:1 LPEME6310720.591.030.990.731.331.690.65
C22:6 LPEME6310341.590.881.000.821.040.391.11
imidazoleacetateME6309360.701.010.951.821.010.890.60
N-acetylmethionineME6309640.951.041.001.480.770.751.02
GABAME6309220.881.010.991.651.030.670.77
urocanateME6310020.970.960.961.440.980.900.76
arachidoyl ethanolamideME6308731.360.820.990.541.211.051.00
N-lauroylglycineME6309711.290.980.960.401.470.881.00
acetylcholineME6308620.821.011.020.790.900.781.69
4-guanidinobutanoateME6308561.030.970.950.790.790.951.49
pantothenolME6309761.130.980.960.970.730.781.43
beta-guanidinopropionateME6308780.770.890.910.740.821.351.43
hippurateME6309291.161.141.130.710.591.041.34
guanosineME6309281.221.061.060.620.651.161.27
trimethylamine-N-oxideME6309981.321.021.010.580.521.221.35
inosineME6309371.041.101.090.860.651.261.07
niacinamideME6309701.110.980.990.890.631.241.15
C24:0 LPCME6310221.100.970.960.870.791.051.22
2^-O-methyladenosineME6308540.981.031.070.770.761.091.32
adenosineME6308640.951.071.080.770.781.201.21
C34:1 DAGME6310710.650.981.071.201.540.980.61
N-acetylhistidineME6309620.801.051.041.161.610.770.61
putrescineME6309860.631.101.091.071.630.690.86
cyclohexylamineME6309170.571.061.070.991.690.910.76
N-acetylaspartateME6309590.741.021.020.931.650.840.83
thiamineME6309950.751.011.000.951.700.940.67
ectoineME6309210.780.991.061.331.460.630.77
homoarginineME6309320.870.940.901.261.560.640.76
C16:0 Ceramide (d18:1)ME6310690.790.960.971.301.120.920.91
glycineME6309260.791.011.011.211.240.920.83
phenylacetylglycineME6309770.720.990.981.141.290.950.91
C5 carnitineME6308910.931.021.010.891.360.811.00
sphingosineME6310660.861.041.020.961.390.850.91
agmatineME6308660.831.011.020.971.360.860.97
sphinganineME6310680.821.021.021.001.340.890.93
N-acetyltryptophanME6309670.820.930.991.241.450.830.71
3-methylhistidineME6308550.791.011.021.091.380.890.83
hydroxyprolineME6309330.771.011.001.131.370.870.84
citrullineME6309140.851.021.011.031.500.840.76
N-acetylglutamineME6309600.830.971.051.071.440.850.80
C16-OH carnitineME6309030.761.021.030.861.101.480.77
anserineME6308720.781.001.070.971.151.230.83
methionine sulfoxideME6309460.790.960.920.981.241.240.82
C22:4 LPCME6310210.621.031.030.771.491.230.85
biopterinME6308810.781.051.060.901.321.070.87
sulfamethoxazoleME6309930.881.061.080.711.441.080.80
alpha-hydroxymetoprololME6308711.010.911.060.651.071.121.17
C7 carnitineME6308941.151.011.020.700.961.081.08
C18:2 LPC AME6310111.061.001.020.761.091.071.00
C18:2 LPC BME6310121.121.021.020.741.111.050.96
C20:5 LPCME6310151.191.091.100.631.070.961.03
C20 carnitineME6309081.251.011.020.741.010.961.01
C3 carnitineME6308861.261.021.020.810.970.950.99
C4 carnitineME6308891.431.021.030.640.960.940.99
linoleoyl ethanolamideME6309431.360.960.990.730.761.131.05
C34:3 PC plasmalogenME6310400.841.011.001.240.890.971.05
C4-OH carnitineME6308900.871.170.861.240.851.060.96
ala-alaME6308670.721.031.071.120.851.171.07
C3-DC-CH3 carnitineME6308880.840.950.931.210.761.290.97
xanthineME6310051.160.990.991.140.590.891.23
pterinME6309850.971.161.201.010.681.031.10
biliverdinME6308801.101.021.031.090.721.130.92
C20:0 SMME6310641.091.041.041.040.760.991.07
C22:0 SMME6310651.111.051.070.990.810.971.05
urateME6310011.100.970.981.070.800.901.16
xanthosineME6310061.041.011.021.140.850.881.08
N-acetylleucineME6309631.071.031.011.181.190.860.69
N-carbamoyl-beta-alanineME6309691.071.001.021.031.270.930.68
C20:4 LPCME6310161.061.011.010.811.430.900.78
C22:6 LPCME6310191.110.991.010.731.401.010.75
C16 carnitineME6309020.941.011.030.871.340.990.83
L-alpha-glutamyl-L-LysineME6309401.001.011.041.001.220.920.83
C18:1 carnitineME6309051.041.021.030.911.220.930.88
C18:1 LPC plasmalogen AME6310241.091.001.020.911.230.940.82
C18 carnitineME6309041.051.011.020.811.310.970.83
C20:3 LPCME6310171.081.011.010.821.200.960.92
C22:5 LPCME6310201.091.001.010.771.251.010.87
pro-glyME6309820.901.061.030.731.250.911.16
1-methylguanosineME6308481.070.901.011.011.080.791.10
C5:1 carnitineME6308921.041.011.040.851.150.851.07
methylthioadenosineME6309500.961.141.181.090.990.790.98
C36:4 PEME6310470.851.031.020.930.911.141.14
glutathione reducedME6309250.831.021.020.930.941.081.20
phytosphingosineME6310670.801.051.030.881.071.061.14
guanidinoacetateME6309270.751.031.041.021.040.961.18
N-alpha-acetylarginineME6309680.821.041.020.980.971.001.19
cystineME6309180.900.950.951.191.031.050.91
methyl N-methylanthranilateME6309471.030.911.011.141.021.040.83
imidazole propionateME6309350.960.990.990.910.991.240.92
C14 carnitineME6308990.931.021.010.921.111.180.85
C18:1-OH carnitineME6309060.881.001.020.931.071.240.88
C14:1 carnitineME6309001.001.011.010.950.981.120.94
C18:2 LPEME6310280.981.011.000.981.031.110.89
alpha-glycerophosphocholineME6308700.991.021.030.931.131.070.84
N6,N6,N6-trimethyllysineME6309550.981.011.010.921.181.050.85
phosphocholineME6309790.881.021.010.941.081.110.97
C18:2 carnitineME6309070.941.021.020.911.101.070.96
C32:2 PCME6310360.911.011.020.921.141.080.92
C24:1 ceramide (d18:1)ME6310700.961.040.981.120.960.891.05
C18:1 LPEME6310291.011.011.011.111.060.900.92
C34:2 PE plasmalogenME6310531.051.001.001.150.990.890.92
C36:3 PE plasmalogenME6310421.011.000.991.120.990.910.97
C20:4 LPEME6310321.041.021.051.041.020.851.01
N-acetylgalactosamineME6308831.011.011.021.131.020.811.00
beta-alanineME6308770.861.011.011.051.071.040.97
betaineME6308790.891.021.031.021.051.040.97
1-methyladenosineME6308470.901.001.011.041.021.070.98
C26 carnitineME6309100.911.000.981.021.031.031.01
5-methylcytosineME6308600.901.000.991.041.110.931.03
alanineME6308680.831.011.011.071.081.001.02
proline-betaineME6309840.831.011.011.081.090.961.03
C30:0 PCME6310350.920.991.050.951.081.021.01
C38:6 PEME6310490.911.011.010.981.071.030.99
C34:3 PCME6310380.980.991.010.991.060.990.98
C36:2 PEME6310480.961.001.011.001.061.000.97
C40:6 PEME6310510.951.031.030.981.080.990.97
glutamateME6309230.971.011.020.991.100.970.95
tyrosineME6310000.941.011.000.971.100.971.01
cytidineME6309190.971.051.030.981.080.930.99
N6-acetyllysineME6309570.941.021.031.001.090.950.99
S-adenosylhomocysteineME6309870.891.031.061.031.130.950.94
ADMAME6308650.951.021.031.011.150.960.90
aspartateME6308760.951.011.021.011.140.980.90
asparagineME6308750.931.031.021.051.140.940.92
C36:2 PCME6310390.941.001.011.031.120.970.94
N6-methyllysineME6309580.931.011.011.031.130.950.95
1-methylnicotinamideME6308501.011.011.010.981.140.930.92
N2,N2-dimethylguanosineME6309530.990.980.980.991.160.930.94
C18:1 LPC plasmalogen BME6310250.991.031.040.951.110.980.93
prolineME6309830.961.021.010.931.150.970.96
isoleucineME6309380.951.001.010.981.170.960.94
methionineME6309450.921.011.020.981.170.970.95
leucineME6309410.961.011.010.981.130.960.97
phenylalanineME6309780.941.011.010.971.140.980.95
C18:0 LPCME6310141.031.001.010.951.051.010.95
C38:7 PE plasmalogenME6310550.991.031.021.001.051.000.92
5-methylcytidineME6308591.011.011.001.001.051.000.93
C38:6 PE plasmalogenME6310561.011.021.020.991.031.000.94
C16:1 SMME6310601.041.011.031.051.020.950.91
C18:1 SMME6310621.061.031.031.021.030.990.86
allantoinME6308690.921.021.011.081.070.940.97
creatinineME6309160.931.061.041.041.080.950.94
S-methyl-L-cysteine-S-oxideME6309920.951.040.991.061.031.030.90
C-glycosyltryptophanME6309120.981.031.031.031.080.980.90
2^-deoxycytidineME6308530.931.001.001.071.071.010.92
7-methylguanineME6308610.951.011.011.051.070.980.94
arginineME6308740.971.000.991.021.030.961.03
N4-acetylcytidineME6309540.961.011.021.071.020.931.01
C38:7 PC plasmalogenME6310430.951.010.991.100.971.040.95
phenylalanine-d8ME6308450.961.021.011.071.000.990.96
valine-d8ME6308460.961.011.011.061.000.980.97
C38:6 PC plasmalogenME6310440.991.011.001.050.991.020.94
C40:7 PE plasmalogenME6310581.011.001.011.051.000.990.94
serineME6309900.871.001.001.121.170.930.91
acisogaME6308630.901.001.041.131.200.930.82
glutamineME6309240.911.011.001.081.210.940.85
pipecolateME6309800.881.001.001.101.190.970.85
ornithineME6309741.000.970.961.091.110.970.87
N6,N6-dimethyllysineME6309560.891.001.011.061.181.020.84
N-acetylhistamineME6309610.931.021.011.031.131.060.86
SDMAME6309890.951.000.991.061.160.980.87
1-methylhistamineME6308490.961.000.991.041.161.020.83
histamineME6309300.971.021.011.031.141.000.84
N-acetylornithineME6309650.781.031.020.991.261.000.94
dimethylglycineME6309200.851.011.031.051.200.990.89
S-adenosylmethionineME6309880.850.991.001.031.200.970.95
lysineME6309440.910.990.971.081.310.910.82
NMMAME6309730.931.000.981.071.240.890.89
threonineME6309960.931.001.011.021.200.900.94
histidineME6309310.960.960.940.991.290.910.91
tryptophanME6309990.931.000.980.971.280.930.90
valineME6310030.901.021.020.971.250.930.93
2^-deoxyadenosineME6308520.831.011.030.900.911.311.03
C10 carnitineME6308961.001.011.030.800.861.301.01
C14:2 carnitineME6309010.931.021.010.930.921.181.02
leu-glyME6309420.990.991.030.910.891.171.03
C12:1 carnitineME6308981.031.011.040.860.881.210.99
C12 carnitineME6308971.011.011.030.840.961.210.96
C34:4 PCME6310370.901.021.020.921.001.131.03
C18:0 LPE BME6310310.921.020.990.921.011.061.08
hypotaurineME6309340.931.011.030.871.071.051.07
C8 carnitineME6308951.021.011.000.810.951.141.07
C14:0 LPCME6310070.971.021.040.850.951.061.13
C16:1 LPCME6310081.011.041.030.880.951.061.07
C18:1 LPCME6310131.051.011.000.840.971.061.06
4-pyridoxateME6308571.110.981.070.870.991.001.00
N1-methyl-2-pyridone-5-carboxamideME6309521.061.031.030.911.020.911.07
pantothenateME6309751.041.051.040.880.960.961.11
trigonellineME6309971.071.011.020.880.951.001.07
C18:3 LPEME6310271.071.031.061.010.920.891.06
C16:0 SMME6310611.031.031.031.040.900.971.03
C18:0 LPE AME6310301.001.021.011.050.920.971.04
C16:1 LPC plasmalogenME6310231.090.991.021.040.911.010.94
serotoninME6309911.051.041.030.980.931.070.91
methylguanidineME6309481.071.051.060.930.931.010.99
cholineME6309131.071.021.021.000.960.970.98
C18:3 LPCME6310101.011.001.030.990.991.001.00
C38:5 PE plasmalogenME6310571.041.021.020.980.941.040.98
C36:5 PC plasmalogenME6310411.031.011.010.990.961.040.97
C36:5 PE plasmalogenME6310541.031.021.020.990.971.020.96
N1-acetylspermidineME6309510.981.011.010.951.031.001.02
C34:0 PEME6310460.960.991.050.981.001.011.03
butyrobetaineME6308820.981.011.020.960.991.041.01
creatineME6309150.961.021.010.970.991.041.03
C20:0 LPEME6310331.011.030.980.921.021.041.00
C16:0 LPCME6310091.011.011.030.910.971.061.03
C2 carnitineME6308851.031.021.030.930.961.051.00
C34:3 PE plasmalogenME6310520.941.010.981.010.951.031.07
C34:2 PEME6310450.971.031.010.950.931.081.04
C38:4 PEME6310500.951.011.020.980.921.061.07
C16:0 LPEME6310261.031.021.010.960.931.001.07
C20:4 carnitineME6309091.021.021.030.940.871.071.08
taurineME6309941.021.021.020.930.911.081.03
C18:0 SMME6310631.031.051.051.050.841.050.97
C3-DC carnitineME6308871.021.020.971.100.921.050.91
C6 carnitineME6308930.910.990.991.030.931.141.01
C20:1 LPCME6310180.960.990.980.990.871.091.11
carnitineME6308840.951.021.031.010.821.111.08
cadaverineME6309110.131.241.270.883.300.140.24
kynurenateME6309390.380.931.031.861.960.620.22
N-methylprolineME6309720.510.970.971.601.770.620.53
progesteroneME6309810.120.970.891.472.710.490.29
methylimidazoleacetateME6309490.610.971.011.132.140.510.62
N-acetylputrescineME6309660.371.021.011.032.520.430.63

Factors:

F1Group:Control | Timepoint:8 weeks of training or control time | Sex:Female
F2Group:QC-DriftCorrection | Timepoint:0 hour | Sex:-
F3Group:QC-Pooled | Timepoint:0 hour | Sex:-
F4Group:Training | Timepoint:1 week of training or control time | Sex:Female
F5Group:Training | Timepoint:2 weeks of training | Sex:Female
F6Group:Training | Timepoint:4 weeks of training | Sex:Female
F7Group:Training | Timepoint:8 weeks of training or control time | Sex:Female
Data matrix
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