Clustering data with hclust algorithm for (Study ST002512)

HILIC NEGATIVE ION MODE (Analysis AN004137)
MetaboliteStructureF1F2F3F4F5F6F7F8F9F10F11F12F13
2-Hydroxy-4-methylpentanoic acidME6057170.1312.340.120.26NA0.020.770.040.050.060.160.070.06
3-Phenyllactic acidME6057300.458.380.541.82NA0.130.950.200.360.170.170.200.18
1-Methyluric acidME6057010.250.600.253.55NA0.160.680.193.63NANANA0.45
AdonitolME6057451.060.560.992.91NA0.730.540.743.140.450.500.490.50
N-Acetyl-tryptophanME6059210.751.020.713.76NA0.450.580.513.240.540.460.540.44
2-Ketogluconic acidME6057210.220.370.216.77NA0.060.070.085.400.090.160.060.62
Carbamoyl-DL-aspartic acidME6057880.130.330.277.76NA0.030.160.013.340.050.120.050.22
N-CinnamoylglycineME6059240.381.010.366.41NA0.120.660.303.770.230.100.230.14
3,4-Dihydroxyhydrocinnamic acidME6057240.175.470.620.23NA0.083.290.120.100.040.020.030.02
L-Dehydroascorbic acidME6058060.654.010.620.70NA0.721.160.891.340.620.620.590.69
C12-ASME6057860.030.040.040.11NA0.400.602.251.011.340.832.911.06
1-Myristoyl-sn-glycero-3-phosphocholineME6057020.230.170.300.27NA0.961.931.571.991.011.120.781.57
lysoPE 16:1ME6060560.030.140.040.06NA0.732.241.571.821.301.291.151.75
2-HydroxyquinolineME6057200.520.590.632.77NA0.340.520.550.871.351.511.531.36
4-Hydroxy-6-methyl-2-pyroneME6057350.840.731.032.46NA0.630.660.870.611.220.841.131.12
Sinapic acidME6059871.380.781.223.54NA0.300.220.470.850.811.180.681.14
(2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acidME6056961.110.841.203.19NA0.530.500.751.530.640.570.810.69
5-Hydroxy-3,4-dihydro-2(1H)-quinolinoneME6057411.141.031.222.52NA0.770.730.862.020.440.530.510.55
Phe-SerME6059470.511.220.410.54NA1.701.090.811.340.781.580.891.63
Trp-ValME6060080.371.070.310.34NA1.321.501.051.690.801.241.011.70
XanthineME6060341.131.411.020.86NA0.921.010.960.860.821.080.721.37
Phe-GlyME6059430.751.720.560.57NA1.471.401.121.200.640.980.771.06
Trp-ThrME6060071.081.850.780.68NA0.981.261.051.080.671.120.720.93
L-Cysteine-glutathione disulfideME6058690.352.970.430.36NA0.381.390.901.230.861.311.011.33
PurineME6059670.453.170.430.46NA0.600.970.810.720.871.291.011.88
AdenineME6057440.352.130.421.11NA0.331.640.561.531.031.181.161.25
HypoxanthineME6058570.401.890.350.72NA0.521.480.721.560.831.380.772.17
Caffeic acidME6057872.341.312.163.04NA0.580.330.800.640.180.460.040.04
D-SACCHARIC ACIDME6057992.281.482.312.30NA0.360.260.430.200.260.580.421.09
(-)-Hydroxycitric acid lactoneME6056951.991.682.292.09NA0.520.390.710.350.300.590.330.58
Gly-SerME6058402.142.452.071.49NA0.230.250.290.140.680.770.850.64
Quinic acidME6059681.891.951.771.56NA0.750.440.690.320.440.960.420.84
1-(1Z-Hexadecenyl)-sn-glycero-3-phosphocholineME6056980.870.771.050.77NA1.561.611.821.810.300.400.330.38
2^-O-MethyluridineME6057141.371.471.251.75NA1.151.201.091.730.310.300.270.20
ManninotrioseME6058911.200.821.191.07NA0.972.411.010.240.690.590.790.74
IsomaltoseME6058651.410.881.291.23NA0.952.160.970.200.660.580.680.75
MelibioseME6058941.360.781.221.23NA0.982.330.960.250.660.560.700.71
N-AcetylornithineME6059291.282.831.420.35NA0.591.050.660.270.761.110.900.85
Gly-GlyME6058351.361.891.300.93NA0.460.580.550.241.141.371.181.09
Gly-ThrME6058411.592.011.390.99NA0.310.380.390.261.151.231.311.13
Pro-SerME6059621.672.081.090.77NA0.731.040.590.420.971.130.960.66
PseudouridineME6059661.391.981.220.43NA0.670.770.800.191.231.221.270.70
AsparagineME6057821.511.871.490.66NA0.630.850.750.180.951.150.940.91
ThreonineME6060041.411.901.320.60NA0.630.950.710.181.061.221.010.98
GlutamineME6058291.282.081.130.53NA0.570.970.640.201.191.441.140.91
Pro-GlyME6059571.371.901.170.71NA0.620.920.590.311.051.501.060.94
Gly-AsnME6058321.692.871.610.97NA0.150.230.230.111.051.201.180.91
Gly-Pro-AlaME6058391.522.601.160.97NA0.470.810.480.290.951.300.940.80
Pro-ThrME6059631.872.481.300.96NA0.340.660.340.210.991.151.100.81
Gly-GluME6058341.442.631.541.22NA0.290.470.430.240.811.181.040.89
Gly-AspME6058331.572.191.631.21NA0.300.390.440.180.931.101.111.05
TRANS-4-HYDROXYPROLINEME6059921.652.091.691.36NA0.360.600.600.220.700.920.960.82
Homovanillic acid sulfateME6058551.140.601.671.18NA0.500.501.331.031.440.361.040.67
3-Methoxy-4-hydroxyphenylglycol sulfateME6057281.130.681.420.95NA0.540.481.210.621.870.531.170.95
N-Acetyl-D-galactosamine 4-sulfateME6059060.910.711.600.67NA0.530.541.390.551.860.431.390.71
GuanineME6058440.760.781.021.22NA0.581.311.191.490.860.531.330.75
DeoxyuridineME6057161.301.061.180.48NA0.950.860.940.671.331.561.080.39
SwertisinME6059911.071.360.950.64NA1.071.491.160.301.131.160.810.66
FormononetineME6058101.330.831.090.89NA1.360.910.991.051.311.020.540.63
XanthosineME6060351.660.991.400.74NA1.360.751.160.481.260.540.570.78
GenistinME6058131.191.041.181.23NA0.870.561.080.120.891.161.051.15
SucroseME6059891.211.001.320.76NA0.690.540.930.251.131.241.311.42
Thr-PheME6059991.291.081.311.08NA0.600.510.700.590.971.461.021.48
1-KestoseME6056991.100.931.261.23NA1.140.861.270.610.820.740.830.86
DaidzinME6058051.050.971.110.71NA1.100.851.190.630.821.150.980.95
InosineME6058631.281.001.180.78NA0.970.911.120.790.950.970.871.03
CystineME6057961.481.331.430.76NA0.830.640.820.291.031.080.961.22
delta-HydroxylysineME6060381.461.621.301.09NA0.680.680.760.360.851.171.031.02
RaffinoseME6059691.261.251.150.58NA0.960.891.010.221.081.261.081.10
STACHYOSEME6059711.281.111.240.58NA1.070.791.130.231.061.071.101.03
N2,N2-DimethylguanosineME6059311.491.221.420.87NA1.090.811.150.440.850.820.750.82
1-MethylguanosineME6057001.421.121.380.66NA1.080.751.200.281.000.910.950.89
PalatinoseME6059371.451.141.340.73NA1.030.821.080.290.970.930.931.00
GalactinolME6058121.471.311.360.71NA1.060.871.090.200.881.020.830.92
MelezitoseME6058931.491.201.470.71NA1.050.671.180.230.830.930.881.00
GentianoseME6058141.491.231.480.80NA1.090.691.140.280.810.890.840.93
LactitolME6058741.481.221.420.79NA1.050.801.140.300.800.930.830.95
4-Pyridoxic acidME6057401.521.171.461.69NA0.310.290.540.491.071.091.091.41
Azelaic acidME6057841.791.261.731.83NA0.330.350.630.230.840.980.971.00
suberic acidME6060661.711.401.671.80NA0.520.610.840.370.660.800.790.72
CreatinineME6057941.520.680.961.80NA1.060.500.911.170.760.791.000.96
L-SaccharopineME6058721.560.671.612.09NA0.910.411.061.090.530.330.720.85
N-AcetylleucineME6059171.211.311.271.81NA0.740.920.890.990.710.740.860.59
N-AcetyltyrosineME6059121.031.241.151.69NA0.671.270.901.340.660.760.790.62
4,6-DihydroxypyrimidineME6057310.981.151.121.66NA0.530.790.881.501.070.641.080.69
Orotic acidME6059341.011.151.131.79NA0.510.780.881.541.040.591.040.65
Homogentisic acidME6058541.280.881.172.09NA0.690.530.961.470.880.640.780.75
L-FucitolME6058711.220.991.201.78NA0.870.750.921.510.690.750.700.77
3-Hydroxyglutaric acidME6057261.091.641.112.18NA0.540.530.581.300.721.050.741.02
MannoseME6058920.961.290.991.66NA0.540.800.691.630.891.030.911.00
4-Acetamidobutyric acidME6057330.970.990.961.93NA0.580.710.661.221.001.161.101.07
N-Acetylneuraminic acidME6059190.901.040.821.93NA0.660.700.761.470.941.061.021.10
Citric acidME6057920.990.990.911.88NA0.810.670.830.710.951.181.141.16
N-AcetylphenylalanineME6059110.911.260.972.00NA0.540.830.750.970.951.071.170.84
WogonosideME6060331.020.841.041.08NA1.110.801.121.480.781.040.840.86
DaidzeinME6058031.060.931.061.32NA0.950.850.971.660.750.990.760.87
IsoschaftosideME6058661.000.891.071.34NA0.910.801.011.470.720.900.851.15
IsovitexinME6058670.970.930.971.27NA0.950.901.041.510.810.950.821.04
NeodiosminME6059330.960.811.021.28NA0.940.791.081.600.820.880.861.04
VerbascoseME6060321.201.001.131.19NA1.040.751.131.020.870.890.840.88
Daidzein 4^-sulfateME6058041.110.971.041.37NA0.870.750.971.250.871.030.910.95
N-Acetyl-D-galactosaminitolME6059071.161.070.991.42NA0.980.850.911.171.030.810.830.90
Naringenin-4^-O-beta-D-glucuronideME6059321.050.791.181.29NA0.900.601.071.130.900.831.051.14
Hexadecanedioic acidME6058461.200.951.031.21NA0.780.660.861.001.161.091.160.95
BaicalinME6057851.030.951.051.06NA0.900.761.041.000.991.041.021.15
galactitolME6060391.280.891.261.16NA0.910.690.950.820.961.030.931.04
N-Acetylaspartylglutamic acidME6059141.351.271.431.36NA0.650.550.780.671.020.820.971.10
Phthalic acidME6059521.241.001.201.45NA0.700.731.030.680.860.921.041.05
1,4-Cyclohexanedicarboxylic acidME6056971.220.791.531.13NA0.610.611.230.741.220.491.190.78
3-Hydroxyhippuric acidME6057271.150.971.521.04NA0.670.621.200.751.070.701.230.65
Gentisinic acidME6058151.130.881.421.33NA0.650.601.110.741.070.751.240.79
2-Hydroxycinnamic acidME6057181.140.881.261.16NA0.840.661.101.081.090.761.060.77
AllantoinME6057581.271.021.431.13NA0.880.761.140.770.920.690.950.76
N-FormylmethionineME6059251.311.881.391.87NA0.771.050.911.030.490.430.530.43
SarcosineME6059721.241.241.961.28NA0.700.661.020.880.540.690.790.66
Pro-ValME6059641.521.611.171.71NA0.540.700.610.710.850.900.911.03
N-Acetylaspartic acidME6059131.741.561.581.45NA0.730.680.800.520.570.920.630.80
N-Acetyl-glutamic acidME6059101.561.481.521.50NA0.780.770.830.640.630.860.620.83
N-Acetyl-alanineME6059091.481.471.601.14NA0.680.740.920.390.770.990.810.85
Sulfoacetic acidME6059901.611.271.531.34NA0.750.650.960.530.800.760.850.76
Asp-Gly-AspME6057731.631.031.481.67NA1.010.730.990.630.640.600.640.81
Asp-AspME6057701.531.181.341.78NA0.880.750.850.770.680.730.670.90
Asp-HisME6057741.571.271.481.61NA0.810.720.920.670.670.640.740.80
Glucuronic acidME6058271.571.281.321.62NA0.780.640.840.980.830.770.690.72
Pimelic acidME6059531.391.441.281.62NA0.760.800.900.940.680.760.780.70
Asp-AsnME6057691.531.211.401.67NA0.920.760.980.890.580.670.640.73
DL-Isocitric acid lactoneME6058001.511.211.451.61NA0.870.700.980.970.550.800.640.69
Asp-ArgME6057681.461.401.391.53NA0.850.730.930.760.600.820.750.76
Asp-LeuME6057751.441.301.351.44NA0.930.820.960.890.580.760.720.76
Asp-AlaME6057671.511.371.381.47NA0.930.810.990.800.630.730.630.69
Asp-PheME6057761.471.331.381.49NA0.890.810.960.880.620.750.660.73
Asp-TyrME6057811.501.351.411.50NA0.870.820.950.860.590.760.650.70
3-Oxo-1,8-octanedicarboxylic acidME6057291.501.321.321.66NA0.840.760.960.860.690.750.650.69
alpha-Asp-LysME6060361.481.321.381.59NA0.900.780.940.830.600.710.670.78
Asp-GlnME6057711.451.241.331.60NA0.910.770.940.930.660.730.660.78
Asp-SerME6057781.441.261.301.55NA0.910.820.960.870.680.750.670.78
Asp-TrpME6057801.411.181.231.51NA0.890.730.920.950.750.850.750.88
Asp-GluME6057721.401.111.311.53NA1.040.841.040.800.680.710.640.85
Asp-ThrME6057791.371.221.231.40NA1.040.901.050.900.660.770.670.74
N-AcetylserineME6059201.481.921.281.28NA0.820.930.930.820.650.720.580.66
Pro-AlaME6059541.501.581.221.40NA0.790.930.720.830.730.810.820.77
Glu-LysME6058241.381.651.301.30NA0.840.960.940.750.630.790.710.77
N-Acetyl-DL-valineME6059081.371.441.331.25NA0.850.990.970.640.750.780.850.68
CytidineME6057971.660.851.540.80NA2.050.922.020.350.240.200.280.26
CitrullineME6057932.152.001.660.18NA1.211.481.360.090.270.480.270.31
Proline-hydroxyprolineME6059651.801.451.871.62NA0.840.851.030.650.300.430.510.35
GuanosineME6058451.971.211.870.78NA1.290.801.230.410.530.450.480.42
UridineME6060171.961.301.651.05NA1.180.731.090.680.560.420.470.59
L-Cysteinesulfinic acidME6058701.652.211.510.81NA0.881.190.930.350.500.690.610.51
N-ACETYL-DL-METHIONINEME6059051.501.841.600.99NA0.910.951.000.410.660.690.650.58
RibothymidineME6057431.921.901.611.50NA1.221.141.220.390.300.330.280.16
2^-O-MethylcytidineME6057121.771.741.480.89NA1.361.191.280.530.410.400.350.25
2^-O-MethylinosineME6057131.982.031.620.93NA1.271.071.340.280.310.280.270.21
N-Arachidonoyl-alanineME6059220.130.260.120.04NA0.100.190.120.111.873.611.542.41
Met-ValME6059010.230.310.230.23NA0.180.210.280.241.992.732.004.13
LinoleoylglycineME6058870.190.310.230.10NA0.090.120.160.061.893.422.043.37
N-OleoylglycineME6059280.200.330.260.12NA0.070.150.190.091.642.971.883.31
4-(2-Hydroxyethyl)piperazine-1-ethanesulfonic acidME6057320.321.040.350.40NA0.130.260.200.301.312.231.434.97
Malic acidME6058900.331.850.330.27NA0.230.180.260.140.963.840.943.98
Ser-SerME605982NA3.230.070.01NA1.830.710.410.301.301.411.451.47
DL-o-TyrosineME6058021.013.440.450.17NA0.300.950.200.121.542.571.070.81
Succinic acidME6059880.182.510.200.76NA0.200.630.330.651.762.011.941.58
N6-AcetyllysineME6059300.722.890.390.15NA0.270.900.250.091.602.151.511.77
Thr-HisME6059980.882.740.47NANA0.410.770.440.141.091.491.421.57
Phosphoric acidME6059510.450.660.320.43NA0.560.760.840.611.093.961.391.52
1-Oleoyl-2-hydroxy-sn-glycero-3-phospho-(1^-rac-glycerol)ME6057030.220.460.261.92NA0.460.680.601.461.402.211.441.65
Pantothenic acidME6059390.311.030.291.44NA0.220.390.261.211.832.241.681.95
Pro-AspME6059550.931.390.870.72NA0.500.680.570.341.322.001.581.31
S-SulfocysteineME6059701.081.251.020.82NA0.460.370.640.521.401.521.681.31
Gly-PheME6058380.702.110.590.74NA0.680.870.550.591.331.421.561.23
Glu-HisME6058220.901.440.900.47NA0.550.780.630.241.431.581.531.71
Ser-GluME6059760.801.600.660.76NA0.560.690.600.481.381.651.551.62
Val-AspME6060190.741.720.660.51NA0.660.910.630.441.301.591.491.67
Ala-AspME6057480.902.110.610.54NA0.510.760.500.441.301.841.371.63
Lys-ValME6058880.621.860.510.73NA0.560.790.660.751.311.791.301.64
Methionine sulfoxideME6059031.341.830.860.44NA0.480.880.550.211.221.671.431.28
Pro-MetME6059601.102.070.900.65NA0.660.680.790.560.931.201.171.34
2-Hydroxyglutaric acidME6058680.821.640.911.22NA0.450.650.531.021.161.321.341.32
Gly-ValME6058430.861.550.770.96NA0.550.710.630.811.211.501.381.43
Pro-GluME6059561.111.830.921.07NA0.620.940.620.660.951.491.061.06
N-Carboxyethyl-gamma-aminobutyric acidME6059231.071.470.950.92NA0.560.590.610.551.211.611.231.53
Ser-GlyME6059771.081.560.910.95NA0.530.610.630.431.171.691.271.46
Val-GluME6060200.921.510.810.72NA0.750.930.710.511.181.571.261.38
Cysteic acidME6057951.141.710.970.74NA0.580.810.620.481.171.541.271.14
Glutamic acidME6058281.141.840.950.72NA0.560.940.570.341.201.531.181.27
DimethylarginineME6059041.060.830.911.55NA0.620.510.680.761.181.321.161.74
2-methylmaleic acid/citraconic acidME6057231.171.081.021.30NA0.480.500.700.491.291.501.411.17
3-Hydroxybutyric acidME6057250.891.121.021.41NA0.380.890.730.411.161.261.551.26
Ferulic acidME6058091.070.641.111.51NA0.350.240.600.711.301.511.671.41
4-Guanidinobutyric acidME6057341.180.871.241.17NA0.360.460.730.231.231.521.521.44
Sebacic acidME6059731.350.791.471.28NA0.300.280.690.251.311.201.571.35
4-HydroxybenzaldehydeME6057360.760.500.960.68NA0.450.420.800.461.731.461.981.67
UROCANATEME6060150.950.551.330.41NA0.390.220.890.111.661.481.911.75
4-Hydroxyquinoline-2-carbaldehydeME6057390.820.700.990.66NA0.670.610.890.621.461.741.361.49
Chenodeoxycholic acid 24-acyl-beta-D-glucuronideME6057891.000.701.091.04NA0.510.380.780.521.541.421.451.56
Palatinose1ME6059380.750.761.010.46NA0.570.530.930.691.461.071.751.49
16-Hydroxyhexadecanoic acidME6057100.740.881.010.71NA0.700.710.820.691.751.181.531.17
N-AcetylglucosaminylasparagineME6059150.941.120.970.93NA0.710.710.880.601.221.211.331.43
N-AcetylhistidineME6059160.831.150.980.67NA0.610.700.830.581.471.231.531.39
12R-Hydroxy-5Z,8Z,10E,14Z-eicosatetraenoic acidME6057060.151.760.190.20NA0.420.920.770.521.671.932.391.33
Ala-ArgME6057470.111.320.110.34NA0.720.620.510.611.841.401.921.01
Gly-ArgME6058310.571.020.450.70NA0.620.700.570.792.111.492.031.14
Aspartic acidME6057831.151.220.950.71NA0.200.300.280.151.592.271.591.99
Ser-LysME6059800.291.070.310.38NA1.030.570.550.412.081.832.101.62
Asn-GlnME6057630.381.460.310.37NA0.410.660.480.361.852.322.021.81
Gly-LysME6058370.381.360.310.46NA0.530.710.590.482.031.902.051.50
Asn-AspME6057620.671.550.640.35NA0.160.260.280.101.872.312.181.85
Gly-TyrME6058420.501.900.360.28NA0.270.420.340.232.142.002.341.62
His-GluME6058500.711.730.560.24NA0.240.410.330.102.082.142.161.60
His-GlnME6058490.851.790.790.36NA0.350.560.450.221.542.531.531.40
His-AlaME6058470.621.640.470.45NA0.570.710.610.511.492.261.581.53
Val-ThrME6060280.571.530.380.39NA0.540.740.590.641.612.371.651.46
Asn-AlaME6057610.691.620.690.47NA0.390.690.580.461.552.071.681.41
Thr-Gly-ThrME6059970.751.670.550.39NA0.420.740.490.401.572.341.711.37
Thr-AspME6059950.621.720.490.47NA0.260.430.360.261.641.912.092.21
Thr-GluME6059960.631.520.460.47NA0.400.530.480.341.632.001.922.03
TryptophanME6060090.841.520.740.34NA0.340.580.470.181.751.991.921.53
gamma-GlutamylglutamineME6060400.841.280.850.34NA0.470.650.610.151.681.991.611.66
SerineME6059861.061.560.940.39NA0.370.630.470.111.571.871.581.65
gamma-GlutamyltyrosineME6060430.741.150.720.29NA0.420.600.550.151.831.852.001.81
Ser-Gly-SerME6059780.741.070.650.28NA0.430.600.660.231.782.101.921.68
ArabitolME6057590.901.200.750.52NA0.380.370.460.201.672.161.871.78
Asn-ThrME6057650.641.350.650.49NA0.260.490.440.351.692.142.091.70
Pro-LeuME6059590.731.390.510.65NA0.350.490.440.441.731.872.001.78
Pro-PheME6059610.701.250.500.53NA0.390.460.440.381.942.231.911.65
PhenylalanineME6059500.701.280.590.32NA0.430.650.530.291.822.201.781.72
Tyr-AspME6060100.661.310.620.48NA0.410.590.510.351.682.051.791.88
Ser-HisME6059790.662.280.330.15NA0.450.380.360.121.501.891.881.67
His-AspME6058480.921.630.800.50NA0.230.250.310.122.071.741.921.32
Asn-SerME6057640.901.821.000.52NA0.280.450.370.171.541.971.871.32
Ser-AspME6059740.801.940.740.41NA0.400.330.330.131.461.571.781.52
TaurineME6059930.371.430.280.47NA0.810.510.420.341.671.751.732.84
Ala-HisME6057500.491.930.310.13NA0.270.580.390.141.532.361.802.47
Leu-HisME6058790.371.130.330.25NA0.580.770.590.431.392.621.602.52
Phe-GluME6059420.551.300.430.34NA0.470.670.520.451.342.231.822.38
alpha-Glu-AspME6060370.741.720.640.33NA0.470.750.580.181.302.161.482.09
lysoPE 22:6ME6060650.521.360.430.46NA0.520.740.570.721.432.441.362.07
Phe-AspME6059410.671.540.600.57NA0.300.500.430.491.412.681.382.07
Fumaric acidME6058110.610.830.660.99NA0.510.470.660.541.461.512.081.85
Threonic acidME6060030.550.780.700.84NA0.440.570.720.671.421.631.782.11
5-Hydroxy-3-indoleacetic acidME6057420.730.880.610.71NA0.400.520.540.551.672.191.512.13
Met-GlnME6058960.670.890.650.57NA0.630.700.580.371.272.341.562.13
D-(+)-TrehaloseME6057980.830.670.930.43NA0.480.500.830.211.491.901.771.93
Glu-SerME6058250.781.060.730.49NA0.580.650.650.351.661.701.631.92
N-Methylglutamic acidME6059260.831.010.760.66NA0.590.660.700.541.521.691.471.77
Phe-ThrME6059480.661.110.640.69NA0.710.890.670.691.121.731.372.11
Gly-IleME6058360.651.230.560.70NA0.740.740.701.031.201.781.331.79
Thr-ThrME6060000.761.400.560.62NA0.630.850.670.831.331.561.451.71
Gln-LeuME6058170.451.080.430.43NA1.180.930.791.061.101.821.241.94
Ala-AlaME6057460.430.970.410.73NA0.761.010.811.101.111.791.361.98
Leu-AspME6058760.580.990.480.58NA0.830.970.881.361.051.761.321.57
Ala-LysME6057530.171.540.160.36NA0.580.960.740.731.681.881.851.77
UracilME6060160.141.310.190.21NA0.491.150.740.791.572.251.632.04
lysoPC 16:0ME6060450.450.940.470.45NA0.660.820.810.881.591.931.691.55
Ile-LysME6058600.450.920.360.59NA0.890.840.710.751.511.951.571.86
Val-LysME6060240.250.830.290.62NA0.840.660.640.851.781.991.791.88
Gln-ThrME6058190.351.220.250.26NA0.950.960.660.641.561.801.751.99
Glu-ThrME6058260.431.280.350.39NA0.770.990.720.551.411.971.631.90
His-LeuME6058510.461.310.410.47NA0.731.020.800.681.261.771.561.88
AlanineME6057560.291.060.450.48NA0.930.610.600.541.621.891.732.18
Ser-ThrME6059830.591.170.500.51NA0.550.690.610.531.581.881.781.94
Val-Gly-ValME6060210.481.060.470.46NA0.430.760.680.511.551.872.051.93
Phe-AlaME6059400.310.870.270.37NA1.010.970.811.231.021.681.352.66
Phe-ValME6059490.330.710.330.44NA0.880.980.761.571.121.591.292.56
Val-LeuME6060230.330.520.280.57NA0.830.860.791.701.151.901.292.39
Ala-IleME6057510.420.620.430.54NA0.690.690.691.251.261.971.432.53
Leu-SerME6058820.340.470.340.38NA0.830.840.881.341.022.091.492.46
Glu-LeuME6058230.400.980.320.51NA0.580.800.670.741.382.201.622.32
Thr-AlaME6059940.451.000.370.49NA0.640.850.740.871.151.971.462.52
Thr-ValME6060010.500.850.460.75NA0.700.640.581.161.232.211.262.32
Leu-ThrME6058830.460.710.430.55NA0.600.610.621.071.472.101.642.27
Val-MetME6060250.510.640.490.64NA0.590.550.650.881.482.071.632.31
Trp-LeuME6060060.300.660.280.25NA0.941.070.921.001.182.271.322.28
Tyr-LeuME6060120.360.680.430.42NA0.960.990.890.791.222.021.422.15
Ala-LeuME6057520.290.560.280.34NA0.790.860.761.461.192.231.642.10
Leu-GluME6058780.470.810.350.50NA0.910.840.701.141.262.191.401.93
1-Palmitoyl-2-hydroxy-sn-glycero-3-phospho-(1^-rac-glycerol)ME6057040.240.600.271.11NA0.641.070.821.381.351.811.421.80
lysoPC 16:1ME6060460.280.410.290.29NA0.641.331.051.341.481.801.591.73
Gln-SerME6058180.591.090.470.33NA1.700.710.570.491.241.851.401.63
Ser-GlnME6059750.711.710.590.41NA1.840.780.500.381.171.621.291.33
Gln-AlaME6058160.121.210.140.15NA0.861.050.550.611.201.591.321.64
Ala-GluME6057490.591.790.450.53NA1.221.220.710.831.031.641.031.44
Glu-AlaME6058210.471.620.430.46NA0.771.300.780.671.241.721.341.60
2-Benzothiazolesulfonic acidME6057150.160.160.200.17NANANA0.41NA1.251.372.462.06
Cholic acidME6057910.060.690.060.16NA0.130.050.120.201.861.142.131.13
Aleuritic acidME6057570.760.550.850.69NA0.050.070.350.081.691.372.901.90
trans-Traumatic acidME6060670.820.531.040.92NA0.130.120.470.141.841.732.252.01
13S-Hydroxy-9Z,11E,15Z-octadecatrienoic acidME6057080.290.540.370.39NA0.440.600.710.641.691.842.901.57
13-Hydroxy-9Z,11E-octadecadienoic acidME6057070.280.770.350.35NA0.420.570.730.471.842.152.771.32
14-Hydroxy-4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoic acidME6057090.250.940.350.33NA0.390.540.680.611.782.272.781.16
Glutaric acidME6058300.400.380.350.43NA0.380.360.710.531.491.572.962.49
2-Hydroxy palmitic acidME6057190.370.460.500.48NA0.420.470.750.501.621.942.382.24
VanillinME6060310.430.350.560.62NA0.520.430.950.591.601.442.531.88
HypotaurineME6058560.090.730.140.26NA1.590.670.340.441.521.621.932.94
Met-AspME6058950.270.570.350.39NA1.270.580.490.521.482.191.802.55
Met-SerME6058990.210.440.190.22NA1.530.510.420.611.422.291.632.86
lysoPE 20:3ME6060630.030.400.02NANA0.210.590.400.461.512.041.482.06
Met-MetME6058980.080.320.090.06NANA0.190.140.031.502.381.602.02
N-Oleoyl-serineME6059270.180.250.140.11NA0.240.170.22NA1.222.261.382.53
Val-HisME6060220.280.960.300.22NA0.620.770.530.311.293.101.592.71
lysoPE 20:4ME6060640.111.700.120.10NA0.170.340.270.271.813.311.652.82
Ile-Gly-IleME6058590.191.410.150.17NA0.220.430.310.271.702.961.983.01
Leu-GlnME6058770.251.070.200.14NA0.360.480.310.231.823.052.122.63
LysineME6058890.441.090.320.19NA0.170.330.180.072.402.732.162.49
LeucineME6058860.451.010.340.17NA0.180.320.270.122.362.802.362.02
MethionineME6059020.491.140.390.19NA0.230.380.300.152.232.632.142.19
HistidineME6058530.651.090.570.24NA0.190.360.240.062.222.552.182.02
IsoleucineME6058640.631.190.490.22NA0.210.380.310.142.182.542.171.92
Thr-Val-LeuME6060020.301.410.270.32NA0.240.450.350.251.752.582.362.27
Tyr-ThrME6060130.361.300.310.17NA0.270.450.380.211.862.552.202.46
lysoPC 20:4ME6060530.441.030.320.37NA0.460.520.460.571.782.561.872.15
L-gamma-Glutamyl-glutamic acidME6058730.641.030.580.42NA0.340.490.420.181.822.231.852.38
Tyr-GluME6060110.511.240.450.30NA0.350.510.460.221.792.222.112.24
Ala-ThrME6057550.460.940.360.27NA0.410.540.390.281.922.511.942.49
gamma-GlutamylleucineME6060410.420.810.360.30NA0.280.390.350.272.112.382.202.58
Asp-ProME6057770.820.690.690.49NA0.170.170.280.142.082.062.182.52
Dodecanedioic acidME6058080.400.440.520.47NA0.210.270.500.272.161.952.752.13
Pro-IleME6059580.580.870.430.57NA0.290.370.360.322.082.192.331.94
Phe-PheME6059460.060.790.080.07NA0.210.270.370.561.972.712.272.84
Ser-ValME6059850.130.590.120.08NA0.360.310.250.172.142.612.533.27
Asn-ValME6057660.110.860.150.05NA0.090.240.250.092.212.622.902.90
Ser-MetME6059810.140.710.150.07NA0.270.270.230.202.272.672.622.93
gamma-GlutamylmethionineME6060420.280.640.240.17NA0.090.200.200.102.522.812.422.71
N-Acetyl-mannosamineME6059180.310.670.280.20NA0.200.190.240.202.792.612.372.36
His-ThrME6058520.270.640.160.16NA0.120.180.200.092.603.162.702.17
Leu-TyrME6058850.040.270.050.06NA0.120.150.180.252.532.982.632.30
ArginineME6057600.290.620.120.78NA0.260.350.280.352.232.712.212.46
Val-SerME6060270.220.540.200.20NA0.330.360.340.341.963.192.422.42
lysoPE 20:2ME6060620.060.240.060.06NA0.290.890.570.592.282.792.172.45
lysoPC 20:2ME6060510.130.300.150.13NA0.300.570.520.522.272.802.432.26
lysoPE 18:1ME6060580.100.460.110.16NA0.270.630.480.552.362.772.182.43
lysoPE 18:0ME6060570.160.380.200.14NA0.310.390.450.432.632.762.332.20
Phe-LysME6059450.190.400.240.31NA0.310.290.340.442.482.512.502.40
Ser-TyrME6059840.230.810.300.20NA1.160.710.470.291.802.432.131.78
Val-PheME6060260.200.450.230.22NA0.470.580.460.902.113.121.841.99
Ile-PheME6058620.220.600.220.26NA0.560.640.560.931.782.581.812.41
lysoPE 18:2ME6060590.270.590.350.39NA0.560.560.750.841.822.371.901.95
lysoPE 18:3ME6060600.220.550.320.39NA0.560.720.830.891.602.581.811.89
Ile-MetME6058610.480.590.320.33NA0.620.650.600.921.622.471.762.12
Leu-TrpME6058840.260.580.320.23NA0.590.790.680.781.812.601.702.07
lysoPC 18:2ME6060480.370.550.430.44NA0.700.690.860.901.632.151.841.67
lysoPC 18:3ME6060490.380.510.430.39NA0.690.690.790.801.592.272.001.66
lysoPC 20:5ME6060540.450.750.380.48NA0.490.550.531.081.892.251.841.77
2-Methylglutaric acidME6057220.470.600.570.63NA0.490.570.590.651.812.141.931.80
Leu-LysME6058810.350.750.390.50NA0.560.570.620.621.782.161.962.10
lysoPC 20:3ME6060520.140.280.070.09NA0.400.840.660.792.062.472.112.33
lysoPE 20:1ME6060610.110.390.130.14NA0.421.070.740.872.042.191.922.35
Leu-ArgME6058750.190.730.190.29NA0.480.770.620.782.122.142.121.55
Val-ArgME6060180.230.690.230.39NA0.420.580.600.712.281.962.281.78
Ile-ArgME6058580.200.440.210.33NA0.820.670.560.642.162.262.091.96
1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholineME6057050.300.770.350.28NA0.410.480.550.532.222.382.121.94
lysoPC 20:1ME6060500.200.400.220.21NA0.420.690.660.732.122.292.232.13
lysoPC 18:1ME6060470.250.460.270.27NA0.400.530.590.612.172.552.212.02
lysoPE 16:0ME6060550.150.620.190.21NA0.360.640.570.642.222.592.062.19
4-Hydroxyphenylpyruvic acidME6057380.500.250.780.38NA0.350.280.820.261.862.361.782.50
Gln-ValME6058200.180.590.190.14NA0.690.530.380.341.722.562.292.92
Ala-PheME6057540.330.690.410.31NA0.360.470.400.471.632.631.932.94
Met-IleME6058970.300.390.360.36NA0.430.420.550.621.612.511.883.12
Met-ThrME6059000.300.390.350.34NA0.420.460.480.571.622.402.023.20
Leu-IleME6058800.260.430.300.35NA1.060.590.631.221.391.991.692.59
Val-TyrME6060290.290.480.310.49NA0.590.420.641.231.412.122.082.45
DL-Leu-DL-ValME6058010.230.390.270.30NA0.510.540.621.081.472.291.743.15
Val-ValME6060300.230.410.230.38NA0.530.570.571.131.522.351.752.97
Phe-LeuME6059440.320.450.500.29NA0.750.550.620.661.652.241.862.45
Tyr-ValME6060140.220.760.250.32NA0.550.840.580.781.582.121.822.69
Cholesterol 3-sulfateME6057900.370.340.450.45NA0.390.480.730.682.551.532.980.81
Docosahexanoic acidME6058070.080.460.080.12NA0.310.580.670.512.101.794.080.92
2^-DeoxycytidineME6057110.840.430.810.36NA0.830.430.790.161.912.392.140.69
ThymidineME6060050.900.780.810.37NA0.820.610.750.281.912.021.970.62
PG 40:8ME6059350.411.050.580.34NA0.190.320.490.262.751.672.231.27
PG 44:12ME6059360.600.620.760.65NA0.490.330.500.453.170.941.821.54
4-Hydroxyphenyllactic acidME6057370.933.530.983.74NA0.150.540.280.590.630.780.470.38
lactic acidME6060440.101.520.113.37NA0.050.610.120.141.293.141.291.58

Factors:

F1SampleType:Cecal | Group:15644
F2SampleType:Cecal | Group:2243
F3SampleType:Cecal | Group:AB12n2
F4SampleType:Cecal | Group:GF
F5SampleType:- | Group:-
F6SampleType:LI | Group:15644
F7SampleType:LI | Group:2243
F8SampleType:LI | Group:AB12n2
F9SampleType:LI | Group:GF
F10SampleType:SI | Group:15644
F11SampleType:SI | Group:2243
F12SampleType:SI | Group:AB12n2
F13SampleType:SI | Group:GF
Data matrix
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