Clustering data with hclust algorithm for (Study ST000976)

(Analysis AN001597)
MetaboliteStructureF1F2F3F4F5F6F7F8
adenosine 5^-monophosphate (AMP)ME2404380.050.9911.110.140.850.810.051.31
5-oxoprolineME2404276.830.550.200.390.440.433.700.33
5alpha-pregnan-3beta,20alpha-diol monsulfate (2)ME2404212.910.490.690.221.170.305.130.38
pregnanediol-3-glucuronideME2406993.330.770.960.400.850.374.620.34
5alpha-pregnan-3(alpha or beta),20beta-diol disulfateME2404193.660.161.080.090.920.176.240.32
5alpha-pregnan-3beta,20alpha-diol disulfateME2404202.590.392.020.490.930.235.950.21
4-acetylphenol sulfateME2403930.340.340.340.340.340.486.580.69
4-ethylphenylsulfateME2404010.470.640.160.141.000.604.930.54
sorbitolME2407220.182.340.589.820.360.320.380.49
hexanoylglutamineME2407950.190.930.197.800.780.650.271.00
3-hydroxybutyrylcarnitine (2)ME2407870.271.230.278.050.360.640.271.10
hydroxybutyrylcarnitine*ME2405820.151.630.317.820.530.570.300.91
3-hydroxybutyrate (BHBA)ME2403740.300.790.484.632.540.520.380.69
alpha-hydroxyisovalerateME2404470.221.760.734.350.380.860.460.97
4-androsten-3beta,17beta-diol disulfate (1)ME2403970.222.710.544.870.310.710.470.58
cinnamoylglycineME2404840.661.870.394.890.600.700.790.70
xylitolME2407730.662.150.385.070.510.630.440.95
andro steroid monosulfate (1)*ME2404500.491.240.496.230.490.690.491.15
bradykinin, hydroxy-pro(3)ME2404711.090.980.645.970.710.730.640.78
N-oleoyltaurineME2406570.570.720.575.760.800.820.740.80
1,2-propanediolME2402700.721.050.604.511.290.671.040.68
eicosenoate (20:1n9 or 11)ME2405200.650.830.444.730.840.770.631.25
mead acid (20:3n9)ME2406170.550.750.484.990.430.960.621.06
ethyl glucuronideME2405260.035.220.017.240.020.210.020.01
3-hydroxybutyroylglycine**ME2407860.083.280.836.580.450.560.160.08
5alpha-androstan-3beta,17beta-diol disulfateME2404180.093.630.215.390.140.480.220.80
adenosineME2404360.100.291.930.340.590.430.144.75
pyridoxateME2407060.160.160.130.090.230.220.386.09
ursodeoxycholateME2407660.763.902.490.720.200.560.890.77
cholateME2404810.253.430.690.660.360.720.531.22
2-piperidinoneME2403650.562.931.330.640.500.860.580.81
chenodeoxycholateME2404800.623.190.880.600.530.730.690.97
5alpha-androstan-3alpha,17beta-diol disulfateME2404150.174.350.171.760.170.700.170.70
5alpha-androstan-3alpha,17beta-diol monosulfate (2)ME2404160.133.970.130.750.130.700.131.45
biliverdinME2404682.350.830.690.280.240.790.242.93
3-methyl catechol sulfate (1)ME2403830.070.480.040.960.430.563.522.21
2-ethylphenylsulfateME2403410.432.140.430.431.000.761.760.77
thiamin (Vitamin B1)ME2407490.181.100.180.400.181.153.290.35
3-methoxytyramine sulfateME2403810.661.240.660.660.690.763.000.83
5-hydroxyindoleacetateME2404240.341.000.640.280.670.872.801.06
3-ethylphenylsulfateME2403720.431.440.430.430.790.932.310.69
o-cresol sulfateME2406610.441.710.100.360.620.732.381.27
homostachydrine*ME2405770.780.090.090.260.391.660.481.08
saccharinME2407160.840.550.070.070.181.650.900.72
4-acetaminophen sulfateME2403920.050.050.050.050.051.980.051.09
glycylphenylalanineME2405640.080.830.080.130.621.760.310.34
isoleucylvalineME2405970.040.340.020.020.352.120.130.04
thymol sulfateME2407530.360.460.010.020.231.970.100.46
3-methylglutarylcarnitine (1)ME2403860.320.492.091.200.510.830.712.63
bilirubin (Z,Z)ME2404671.880.622.210.850.450.990.271.94
1-methylurateME2403070.170.750.332.800.220.750.203.08
theophyllineME2407480.201.000.162.550.161.070.162.08
paraxanthineME2406790.101.230.341.900.170.950.172.46
theobromineME2407470.611.130.202.010.250.860.372.43
adrenate (22:4n6)ME2404391.330.560.052.651.040.990.511.17
3-hydroxydecanoateME2403750.980.690.511.981.141.090.680.79
N-palmitoyl glycineME2406590.890.980.451.911.100.880.971.14
docosapentaenoate (n3 DPA; 22:5n3)ME2405140.900.860.552.130.790.941.021.22
docosapentaenoate (n6 DPA; 22:5n6)ME2405150.860.810.631.880.741.001.031.20
10-heptadecenoate (17:1n7)ME2402750.580.770.392.600.950.950.711.28
oleate (18:1n9)ME2406640.660.910.442.281.050.930.691.25
oleic ethanolamideME2406650.661.060.582.460.980.890.761.17
dihomo-linoleate (20:2n6)ME2405071.180.920.732.900.920.820.771.23
15-methylpalmitate (isobar with 2-methylpalmitate)ME2402800.850.880.832.500.860.970.930.97
17-methylstearateME2402831.000.860.742.590.960.920.950.98
N-palmitoyltaurineME2406601.130.950.842.331.010.930.910.84
stearate (18:0)ME2407270.990.950.812.260.950.910.841.10
docosatrienoate (22:3n3)ME2405161.701.110.752.190.810.870.571.21
alpha-ketoglutarateME2404480.990.990.542.210.800.800.761.68
hydantoin-5-propionic acidME2405800.780.780.782.210.780.810.781.87
2-aminoadipateME2403291.210.611.052.140.590.990.641.54
S-methylcysteineME2407211.390.970.772.380.530.890.441.66
5-dodecenoylcarnitine (C12:1)ME2407900.611.420.212.381.021.020.220.91
myristoleate (14:1n5)ME2406230.991.350.252.551.010.910.570.88
myristoleoylcarnitine*ME2407980.711.770.432.450.670.980.201.00
myristoylcarnitineME2406240.501.370.622.390.700.960.251.38
xanthosineME2407721.131.861.382.240.470.820.401.25
4-androsten-3beta,17beta-diol disulfate (2)ME2403980.691.661.291.970.600.930.930.86
1-palmitoleoylglycerophosphocholine (16:1)*ME2403160.541.510.801.960.520.970.891.09
2-palmitoleoylglycerophosphocholine*ME2403620.561.500.792.310.460.950.901.10
1-oleoylglycerophosphoglycerol*ME2403130.731.350.932.420.730.910.860.98
2-hydroxybutyrate (AHB)ME2403440.871.361.152.260.620.870.741.27
malateME2406130.841.451.102.110.720.820.931.18
3-S-cysteinyl-2-methylpropanoate*ME2407880.320.770.322.350.361.330.381.08
L-urobilinME2406110.141.050.632.820.261.370.170.82
1,7-dimethylurateME2402740.470.580.471.660.471.180.471.69
phenylalanylarginineME2406880.390.240.062.160.281.470.171.39
16a-hydroxy DHEA 3-sulfateME2402810.691.291.723.791.040.670.840.92
pregnen-diol disulfate*ME2407000.831.240.893.560.840.681.420.93
pipecolateME2406961.161.530.823.550.320.820.321.38
1-linoleoylglycerophosphoinositol*ME2403030.641.241.163.560.580.710.751.55
2-aminophenol sulfateME2403330.600.601.353.050.650.940.721.45
2-hydroxy-3-methylvalerateME2403420.570.661.043.550.601.030.671.08
acetoacetateME2404330.640.570.703.381.420.740.631.38
5-dodecenoate (12:1n7)ME2404220.951.550.523.800.970.790.450.77
10-nonadecenoate (19:1n9)ME2402760.710.770.524.170.870.880.631.08
mannitolME2406140.800.830.553.890.511.090.680.73
docosadienoate (22:2n6)ME2405120.980.940.743.661.060.790.671.05
cis-vaccenate (18:1n7)ME2404860.831.030.453.170.900.910.681.01
palmitoleate (16:1n7)ME2406730.511.000.273.490.860.960.471.06
caffeineME2404730.031.700.123.230.180.940.241.66
4-androsten-3beta,17beta-diol monosulfate (2)ME2404000.292.100.882.680.520.900.550.87
1-oleoylglycerophosphoinositol*ME2403140.481.840.223.180.730.830.880.77
4-androsten-3beta,17beta-diol monosulfate (1)ME2403990.562.240.563.500.800.640.890.76
C-glycosyltryptophan*ME2404790.181.180.792.950.270.922.210.69
glycerol 2-phosphateME2405510.240.210.273.480.961.131.230.69
glycerol 3-phosphate (G3P)ME2405520.090.070.163.390.731.201.420.78
1-ribosyl-imidazoleacetate*ME2407790.010.480.753.660.480.871.151.73
linoleate, methyl esterME2406080.420.420.423.040.820.761.361.80
palmitate, methyl esterME2406720.130.180.352.930.590.931.251.90
1-linoleoylglycerol (1-monolinolein)ME2403000.660.420.030.241.270.690.483.08
quinineME2407120.110.110.110.111.820.930.112.49
4-hydroxyhippurateME2404030.631.260.580.590.590.501.692.65
valerylcarnitineME2407670.380.770.850.230.660.771.292.55
dihydroferulic acidME2405090.541.050.410.451.400.680.662.24
stachydrineME2407260.200.500.310.450.461.051.132.28
succinylcarnitineME2407330.250.510.061.110.250.961.352.43
homocitrullineME2405750.510.740.310.920.660.920.812.24
cyclo(L-phe-L-pro)ME2404960.620.800.620.740.620.810.622.66
N-methyl prolineME2406560.781.020.490.400.510.830.862.45
methyl indole-3-acetateME2406200.290.290.291.450.700.940.292.73
indoleacetylglutamineME2405880.170.590.231.040.590.850.692.82
N-delta-acetylornithineME2406530.550.540.120.670.600.900.472.85
theanineME2407460.121.170.120.240.121.010.122.98
4-acetamidophenolME2403910.210.210.210.210.491.160.212.84
p-acetamidophenylglucuronideME2406700.030.030.030.030.261.560.032.24
homocysteineME2405763.101.060.830.231.180.661.960.78
4-allylphenol sulfateME2403942.111.740.210.150.781.070.490.76
ethanolamineME2405252.270.900.750.541.650.761.040.93
3,4-methylene heptanoyl carnitineME2407832.390.671.130.310.970.890.751.56
salicyluric glucuronide*ME2407192.111.070.580.580.580.801.191.69
5-hydroxyhexanoateME2404230.072.191.611.880.590.920.520.91
2-oleoylglycerol (2-monoolein)ME2403590.200.280.200.201.550.851.681.73
tartarateME2407360.440.500.200.201.031.092.160.90
methylnaphthyl sulfate (2)*ME2407970.281.140.090.091.411.211.230.35
N-acetylmethionine sulfoxideME2406480.480.480.480.482.100.990.840.91
HWESASXX*ME2405792.290.480.502.230.611.160.880.63
indolepropionateME2405902.510.960.631.560.560.951.110.93
1-palmitoylglycerophosphoinositol*ME2403221.221.530.281.590.790.801.201.13
tetradecadienoate (14:2)*ME2408022.051.580.461.560.960.850.530.91
glycodeoxycholateME2405580.240.181.621.231.271.001.251.31
taurodeoxycholateME2407430.130.081.340.321.440.881.891.56
laurylcarnitine*ME2406040.811.800.551.690.700.990.231.08
N-acetylglycineME2406430.492.200.751.510.780.820.631.09
3-hydroxyhippurateME2403760.471.500.271.700.271.210.700.91
N-acetylglutamineME2406420.741.870.771.590.860.911.020.61
indole-3-carboxylic acidME2405860.391.630.571.120.881.160.820.43
methyl glucopyranoside (alpha + beta)ME2406190.361.820.091.220.701.100.760.74
2-hydroxyhippurate (salicylurate)ME2403470.611.870.300.310.541.000.471.55
salicylateME2407181.041.550.050.230.611.180.421.14
DSGEGDFXAEGGGVR*ME2405180.342.300.340.340.551.320.340.34
cis-4-decenoyl carnitineME2404851.102.150.620.570.620.940.321.25
hemeME2405680.312.000.311.120.311.190.331.00
hexanoylcarnitineME2405720.701.700.480.940.831.060.341.04
hydroxycotinineME2405830.672.230.670.670.671.040.670.67
decanoylcarnitineME2405030.632.300.440.830.601.100.200.81
octanoylcarnitineME2406630.652.310.410.840.571.080.220.87
corticosteroneME2404890.850.990.850.870.990.852.060.91
21-hydroxypregnenolone disulfateME2403281.051.191.231.291.270.711.780.82
dehydroisoandrosterone sulfate (DHEA-S)ME2405040.991.160.781.411.220.811.620.75
estrone 3-sulfateME2405240.740.700.701.590.990.852.460.70
pregnenolone sulfateME2407011.200.951.052.071.150.712.230.56
pregn steroid monosulfate*ME2406981.141.010.742.161.050.751.750.83
creatineME2404931.990.652.290.691.060.921.041.02
pro-hydroxy-proME2407021.820.531.601.141.021.090.660.88
glutamine-leucineME2405470.351.072.791.300.541.140.970.80
cysteine-glutathione disulfideME2405001.101.032.230.561.390.910.900.85
isoleucylleucineME2405960.690.842.170.351.061.160.950.73
phenylacetylglycineME2406860.561.011.940.540.960.940.861.45
3-indoxyl sulfateME2403800.941.072.220.680.680.990.961.23
glycylleucineME2405630.881.202.380.880.880.960.881.01
sphinganineME2407231.390.871.870.600.981.040.970.86
sphingosineME2407241.201.201.960.660.820.961.031.00
2-aminoheptanoateME2403311.070.911.781.001.210.930.801.07
taurineME2407381.150.792.070.801.120.901.121.14
1-arachidonoylglyercophosphateME2402870.860.621.811.100.911.041.191.05
hypoxanthineME2405840.861.001.750.800.951.010.901.07
phenylalanylleucineME2406890.750.921.830.680.701.180.880.93
aspartylleucineME2404591.110.822.491.400.681.040.691.13
thyroxineME2407541.050.832.131.330.591.140.770.95
alpha-hydroxycaproateME2404451.051.471.591.590.711.050.600.70
N-acetylleucineME2406460.811.091.541.610.960.950.970.90
xanthineME2407711.051.051.771.620.900.930.791.06
4-hydroxyphenylpyruvateME2404040.560.911.761.530.411.081.341.03
N-acetylphenylalanineME2406490.771.291.761.440.580.990.831.15
S-adenosylhomocysteine (SAH)ME2407170.631.041.791.300.341.170.771.13
valylleucineME2407690.890.961.350.190.961.280.740.59
ADSGEGDFXAEGGGVR*ME2404400.471.180.470.470.471.540.470.47
phenylalanylphenylalanineME2406900.351.270.650.380.621.470.460.52
alanylleucineME2404420.700.700.700.700.701.410.700.70
HWESASLLRME2405781.110.510.740.610.521.580.510.52
tiglyl carnitineME2407550.150.970.191.370.401.050.691.95
2-linolenoylglycerophosphocholine(18:3n3)*ME2403530.401.240.211.200.311.070.911.59
pyroglutamine*ME2407080.391.570.401.350.491.000.611.47
hydroquinone sulfateME2405810.491.860.871.110.540.751.411.41
quinateME2407110.781.070.541.320.540.711.761.85
10-undecenoate (11:1n1)ME2402770.720.550.811.480.881.320.610.69
leucylleucineME2406061.130.960.581.250.691.260.940.50
glycodeoxycholate sulfateME2407940.180.500.421.580.991.290.910.75
glycolithocholate sulfate*ME2405610.280.560.501.650.791.111.021.33
5alpha-androstan-3beta,17alpha-diol disulfateME2404170.430.920.902.070.851.100.690.96
3-hydroxyoctanoateME2403780.550.620.951.571.331.060.820.89
dodecanedioateME2405170.240.540.972.031.401.020.790.98
trigonelline (N^-methylnicotinate)ME2407571.780.600.181.040.890.890.671.86
4-acetamidobutanoateME2403901.181.290.420.471.270.770.711.60
linoleate (18:2n6)ME2406071.111.040.371.171.020.910.691.44
linolenate [alpha or gamma; (18:3n3 or 6)]ME2406091.451.070.311.080.941.010.681.12
3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF)ME2403710.250.690.300.611.180.951.441.42
N-(2-furoyl)glycineME2406250.310.540.460.790.871.081.451.35
taurolithocholate 3-sulfateME2407440.420.560.691.030.890.951.491.55
ferulic acid 4-sulfateME2405280.430.920.430.430.561.021.741.43
argininateME2407930.390.560.830.410.820.981.651.61
1-nonadecanoylglycerophosphocholine(19:0)ME2403090.660.740.760.490.860.991.781.18
tartronate (hydroxymalonate)ME2407370.610.870.760.460.941.031.521.09
2-isopropylmalateME2403520.231.041.370.311.051.011.411.04
2-oxoarginine*ME2407820.251.041.040.591.120.991.341.03
fructoseME2405300.331.090.910.731.340.981.010.95
taurocholenate sulfateME2407420.531.040.780.791.390.851.431.04
allantoinME2404430.410.940.961.101.630.811.600.80
hydroxy-CMPFME2407770.390.700.930.481.510.881.920.90
hydroxy-CMPF*ME2407960.400.671.030.441.530.861.970.92
3-phenylpropionate (hydrocinnamate)ME2403881.350.850.950.510.581.161.270.92
4-guanidinobutanoateME2404021.460.630.610.420.951.151.490.67
HEPESME2405691.541.271.000.880.900.871.490.81
4-imidazoleacetateME2404051.690.900.951.570.720.991.100.92
hippurateME2405731.291.120.611.330.860.951.330.83
beta-alanineME2404621.541.030.741.441.010.821.221.09
heptanoate (7:0)ME2405701.530.970.871.210.850.931.250.99
phosphateME2406951.450.990.881.190.970.980.970.92
cysteine sulfinic acidME2404991.900.750.610.951.210.891.680.69
gamma-CEHCME2405322.100.670.900.790.880.991.270.96
glycineME2405541.780.921.060.851.150.881.011.08
allo-isoleucineME2404440.851.611.360.970.660.850.521.63
N-acetyltryptophanME2406511.141.601.001.280.161.120.681.02
5-methylthioadenosine (MTA)ME2404251.090.611.570.950.650.860.832.13
2,3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)*ME2407800.760.751.140.890.631.070.511.78
isovalerylcarnitineME2405990.850.841.311.160.440.980.731.87
N-acetylglutamateME2406410.390.831.541.491.180.930.771.27
1-palmitoylglycerophosphoglycerol*ME2403210.810.771.571.040.900.930.751.62
cytidineME2405020.590.791.721.091.030.930.591.62
cyclo(leu-pro)ME2404950.070.910.610.540.621.240.561.53
3-CMPFP**ME2407760.590.450.390.351.141.190.691.37
5alpha-androstan-3alpha,17alpha-diol monosulfateME2404140.420.420.420.420.701.300.621.56
2-aminooctanoateME2403320.440.670.220.851.001.170.621.35
1-oleoylglycerol (1-monoolein)ME2403100.550.860.180.461.150.991.111.38
2-hydroxyoctanoateME2403490.590.830.260.741.001.020.991.41
1-palmitoylglycerol (1-monopalmitin)ME2403170.470.960.450.501.021.110.911.17
N-acetyl-2-aminoctanoateME2407990.660.940.300.690.801.160.791.21
phenylcarnitine*ME2406920.621.090.300.630.301.031.251.73
4-vinylphenol sulfateME2404080.311.160.150.380.591.071.131.55
O-methylcatechol sulfateME2406670.580.870.300.350.441.181.081.51
3-[3-(sulfooxy)phenyl]propanoic acid*ME2403701.180.860.650.750.650.930.652.00
threitolME2407501.111.220.680.701.070.851.061.28
5alpha-androstan-3alpha, 17beta-diol-17-glucosiduronateME2404130.761.370.760.760.760.930.761.52
1-methyl-2-piperidinecarboxylic acidME2403050.751.180.540.680.581.010.981.52
xyloseME2407751.011.130.550.620.830.930.921.54
androsterone glucuronideME2407920.601.060.510.410.670.980.981.76
N-acetylhistidineME2406440.351.160.560.470.750.930.861.90
1-methylhistidineME2403060.490.860.490.970.791.030.951.54
glutarylcarnitine (C5)ME2405480.410.990.570.920.761.030.671.67
butyrylcarnitineME2404720.560.800.780.721.100.920.831.71
13-HODE + 9-HODEME2402780.700.840.600.740.880.940.861.78
N4-acetylcytidineME2406300.710.970.730.890.840.880.781.88
1-oleoylglycerophosphoethanolamineME2403120.451.220.601.710.690.891.461.17
2-oleoylglycerophosphoethanolamine*ME2403610.471.260.471.570.750.881.511.14
1-eicosapentaenoylglycerophosphoethanolamine*ME2402950.271.270.341.050.690.781.391.86
1-linoleoylglycerophosphoethanolamine*ME2403020.571.220.520.960.910.881.221.37
2-linoleoylglycerophosphoethanolamine*ME2403550.441.370.571.030.810.821.331.47
catechol sulfateME2404780.711.300.380.710.541.011.391.23
1-(14 or 15-methyl)palmitoyl-GPC (a17:0 or i17:0)*ME2407780.721.140.480.620.901.111.090.87
eicosapentaenoate (EPA; 20:5n3)ME2405190.841.200.400.940.621.081.230.99
gamma-glutamylglutamineME2405350.691.310.361.070.781.090.980.88
dimethyl sulfoneME2405100.301.010.301.191.110.991.181.07
1-docosapentaenoylglycerophosphocholine (22:5n6)*ME2402930.290.770.490.990.431.281.031.20
4-methylcatechol sulfateME2404070.380.750.671.010.551.330.860.97
1-linolenoylglycerophosphocholine (18:3n3)*ME2402990.751.030.581.320.541.011.061.40
1-eicosatrienoylglycerophosphocholine (20:3)*ME2402960.571.160.481.250.541.130.951.10
1-arachidonoylglycerophosphoethanolamine*ME2402850.560.970.731.310.841.060.921.13
imidazole lactateME2405850.511.020.551.290.701.080.951.22
3-methoxytyrosineME2403820.810.850.471.180.931.011.101.19
1-docosapentaenoylglycerophosphocholine (22:5n3)*ME2402920.440.950.600.960.721.101.121.18
epiandrosterone sulfateME2405210.520.990.370.980.811.071.011.23
N1-Methyl-2-pyridone-5-carboxamideME2406261.080.521.550.440.951.110.711.35
2-aminobutyrateME2403300.930.861.330.600.901.040.801.33
propionylcarnitineME2407040.850.801.150.620.761.021.001.51
N-acetyl-beta-alanineME2406391.031.151.590.880.651.040.751.19
2^-O-methyluridineME2407811.031.241.541.160.820.970.751.09
4-methyl-2-oxopentanoateME2404061.021.011.611.210.760.970.861.26
alanineME2404411.200.981.410.880.910.950.921.22
N-acetylaspartate (NAA)ME2406371.170.961.640.770.970.921.131.15
5-methyluridine (ribothymidine)ME2404261.010.771.230.930.841.011.071.26
phenylpyruvateME2406941.140.821.291.110.820.981.111.18
cortisoneME2404911.250.971.551.200.760.911.071.24
3-hydroxyisobutyrateME2403771.171.031.421.290.630.940.951.35
N-acetylmethionineME2406471.080.881.401.160.730.941.041.38
pyruvateME2407101.010.941.471.120.900.951.141.10
beta-hydroxyisovalerateME2404631.041.061.501.440.880.881.011.19
isovalerateME2405981.121.071.381.240.870.881.051.21
6-oxopiperidine-2-carboxylic acidME2404281.400.791.101.090.841.030.671.29
betaineME2404651.150.771.351.040.771.070.691.29
bilirubin (E,E)*ME2404661.130.961.321.100.601.050.391.55
N-6-trimethyllysineME2406331.081.011.070.930.700.940.721.65
cotinineME2404920.781.470.780.780.781.120.780.78
linoleoylcarnitine*ME2406101.071.301.070.700.501.030.761.38
sphingosine 1-phosphateME2407250.881.271.140.760.631.120.800.99
inositol 1-phosphate (I1P)ME2405921.201.020.990.541.250.831.261.18
ornithineME2406681.330.970.930.651.250.941.040.95
threonateME2407511.290.851.120.521.310.931.101.02
arabinoseME2404521.100.770.470.841.120.961.411.03
glycerateME2405491.030.890.820.511.061.011.330.96
1-margaroylglycerophosphocholine (17:0)ME2403040.871.130.690.510.851.031.330.97
1-pentadecanoylglycerophosphocholine (15:0)*ME2403240.910.990.830.630.831.011.201.20
arabonateME2404530.930.970.670.651.321.001.100.83
erythronate*ME2405230.650.960.700.631.251.021.030.99
kynurenateME2406001.030.770.710.690.991.100.821.15
2-hydroxydecanoateME2403450.800.570.710.571.121.051.131.27
androsterone sulfateME2404510.750.770.560.820.891.101.031.19
ribuloseME2407150.820.780.690.741.031.091.180.96
xylonateME2407740.790.760.680.771.041.051.151.10
isobutyrylglycineME2405940.971.041.211.430.660.941.431.04
beta-hydroxypyruvateME2404641.051.120.971.031.040.901.340.94
cortisolME2404900.931.151.191.130.870.871.411.10
1-docosahexaenoylglycerophosphoethanolamine*ME2402910.510.940.981.160.980.991.141.14
2-docosahexaenoylglycerophosphoethanolamine*ME2403370.480.921.111.081.051.001.260.96
etiocholanolone glucuronideME2405270.361.191.051.060.980.831.421.29
1-stearoylglycerophosphoethanolamineME2403260.681.161.000.781.060.821.431.29
2-stearoylglycerophosphoethanolamine*ME2403670.571.130.900.930.980.921.211.22
1-palmitoylglycerophosphoethanolamineME2403200.601.071.190.960.840.911.221.36
2-palmitoylglycerophosphoethanolamine*ME2403640.661.121.080.940.900.861.221.42
1-eicosapentaenoylglycerophosphocholine (20:5n3)*ME2402940.430.830.660.920.611.041.741.19
1-docosahexaenoylglycerophosphocholine (22:6n3)*ME2402900.550.860.990.800.831.051.451.04
1-palmitoylglycerophosphateME2403180.860.750.970.940.941.011.451.02
1-linoleoylglycerophosphocholine (18:2n6)ME2403010.661.020.660.950.671.011.331.23
2-linoleoylglycerophosphocholine*ME2403540.870.820.830.980.741.001.361.24
isobutyrylcarnitineME2405930.800.810.771.030.870.901.621.27
2-docosapentaenoylglycerophosphocholine (22:5n3)*ME2403380.600.730.890.861.030.971.131.39
gamma-CEHC glucuronide*ME2405330.870.870.870.871.010.871.081.59
2-hydroxyisobutyrateME2403480.560.920.850.751.141.000.841.28
7-alpha-hydroxy-3-oxo-4-cholestenoate (7-Hoca)ME2404290.881.000.770.861.050.980.871.22
phenylalanyltryptophanME2406910.711.130.640.791.010.941.001.30
2-methylbutyrylcarnitine (C5)ME2403570.800.910.751.210.650.970.951.58
N-acetylarginineME2406360.880.880.881.130.880.880.881.67
N-acetylcarnosineME2406400.530.850.851.290.671.060.821.47
phenylacetylglutamineME2406850.550.910.970.980.760.961.081.55
deoxycarnitineME2405050.660.890.991.070.801.000.911.44
pseudouridineME2407050.630.870.911.090.761.010.801.56
indolelactateME2405890.781.010.850.800.591.180.721.21
palmitoylcarnitineME2406760.621.160.940.890.691.060.851.26
pyroglutamylproline*ME2408010.581.120.750.870.581.140.751.28
1,3,7-trimethylurateME2402710.681.250.680.680.681.090.681.30
phenol sulfateME2406840.651.170.930.570.611.100.721.38
citrullineME2404880.840.811.080.850.851.030.711.49
6-bromotryptophanME2407910.880.910.930.740.741.090.791.34
piperineME2406970.790.790.790.790.791.130.791.27
p-cresol sulfateME2406800.640.970.880.750.741.050.951.37
N6-acetyllysineME2406310.761.010.960.820.850.950.991.46
carnitineME2404770.740.900.980.840.871.000.841.46
N1-methyladenosineME2406270.820.980.900.920.810.970.881.49
3-formylindoleME2407840.701.130.780.940.831.070.871.10
gamma-glutamylvalineME2405420.781.050.921.000.821.060.791.17
stearoylcarnitineME2407300.751.270.861.140.810.960.771.28
1,5-anhydroglucitol (1,5-AG)ME2402730.721.100.731.150.761.020.851.29
urateME2407630.681.090.911.120.711.050.791.28
deoxycholateME2405060.830.870.781.100.751.090.841.25
ureaME2407640.800.890.740.930.811.011.061.35
1-arachidoylglycerophosphocholine (20:0)ME2402881.081.270.900.950.590.991.231.07
gamma-glutamylisoleucine*ME2405360.641.280.770.950.791.061.030.94
kynurenineME2406010.701.250.941.020.701.021.330.93
1-palmitoylglycerophosphocholine (16:0)ME2403190.701.201.021.050.731.011.081.09
2-palmitoylglycerophosphocholine*ME2403630.731.060.940.960.691.051.161.11
2-stearoylglycerophosphocholine*ME2403660.761.151.000.840.791.021.161.04
1-arachidonoylglycerophosphocholine (20:4n6)*ME2402840.590.880.981.000.651.140.981.17
glycerophosphorylcholine (GPC)ME2405530.480.911.191.060.811.150.811.03
2-arachidonoylglycerophosphocholine*ME2403340.850.771.051.120.701.160.841.09
azelate (nonanedioate)ME2404600.840.871.011.140.891.050.751.24
gamma-glutamylalanineME2405340.790.771.211.140.871.040.811.31
7-methylguanineME2404300.670.951.161.310.581.090.871.25
gamma-glutamylleucineME2405370.621.111.101.180.761.060.791.16
2-arachidonoylglycerophosphoethanolamine*ME2403350.510.911.201.290.801.011.041.24
N-acetylisoleucineME2406450.720.961.211.240.870.951.051.26
3-methyl-2-oxovalerateME2403850.930.951.241.220.720.991.021.23
N-formylmethionineME2406540.861.011.181.300.790.950.961.30
caprylate (8:0)ME2404760.921.251.151.220.980.950.930.94
lactateME2406021.171.121.201.090.850.970.881.09
thioprolineME2408031.340.830.940.820.861.001.081.20
acisogaME2404351.270.841.010.970.991.020.991.00
alpha-tocopherolME2404491.200.930.970.931.020.980.991.06
mannoseME2406151.120.870.821.240.971.030.831.07
palmitoyl ethanolamideME2406740.961.010.751.150.980.960.931.20
pentadecanoate (15:0)ME2406820.990.960.741.141.020.980.861.18
1-stearoylglycerophosphocholine (18:0)ME2403250.951.081.030.810.851.001.111.09
tryptophanME2407580.900.981.180.790.891.030.941.14
succinateME2407321.041.100.911.120.930.951.031.07
1,3-dimethylurateME2402720.940.940.940.940.941.070.940.98
2-hydroxyacetaminophen sulfate*ME2403430.910.910.910.910.911.130.910.91
uridineME2407651.020.970.870.950.920.971.101.18
2-methoxyacetaminophen sulfate*ME2403560.920.920.920.920.921.030.921.16
7-methylurateME2404310.880.880.880.880.881.080.881.16
2-hydroxystearateME2403510.940.941.080.910.950.980.981.20
5-acetylamino-6-amino-3-methyluracilME2404110.960.960.960.960.960.990.961.15
5-acetylamino-6-formylamino-3-methyluracilME2404120.970.970.970.970.970.990.971.11
3-(N-acetyl-L-cystein-S-yl) acetaminophenME2403690.980.980.980.981.020.990.981.06
adenosine 3^,5^-cyclic monophosphate (cAMP)ME2404370.990.990.990.990.991.020.990.99
2-ethylhexanoateME2403400.881.011.091.110.971.001.001.02
cholesterolME2404820.950.981.120.951.060.971.001.06
palmitoyl sphingomyelinME2406751.001.081.160.951.130.920.921.09
1-myristoylglycerophosphocholine (14:0)ME2403081.001.140.981.110.641.020.971.17
N-acetylthreonineME2406500.960.920.971.110.830.941.081.37
2-hydroxypalmitateME2403501.020.940.971.240.880.990.911.18
undecanedioateME2407610.940.960.951.160.900.960.951.26
3-methyl-2-oxobutyrateME2403840.981.061.071.080.800.980.941.21
creatinineME2404940.781.020.981.100.801.010.961.22
dimethylarginine (SDMA + ADMA)ME2405110.870.971.051.100.880.970.931.30
N-acetylalanineME2406340.890.991.071.120.840.951.041.29
erythritolME2405220.970.981.050.890.880.940.991.37
5,6-dihydrouridineME2407890.821.060.870.970.870.960.941.34
N2,N2-dimethylguanosineME2406291.001.140.831.070.800.930.951.35
octadecanedioateME2406620.720.901.361.381.021.011.090.88
tetradecanedioateME2407450.700.741.101.301.001.110.940.90
leucineME2406050.651.001.310.870.901.061.110.95
1-palmitoylplasmenylethanolamine*ME2403230.870.951.280.950.950.991.101.09
valine ionME2408040.810.921.311.010.951.060.930.99
2-docosahexaenoylglycerophosphocholine*ME2403360.840.621.290.900.961.081.260.96
hexadecanedioateME2405710.570.661.271.050.901.161.050.91
stearoyl sphingomyelinME2407290.751.011.150.371.311.050.900.85
isoleucineME2405950.441.091.210.860.841.131.080.82
pyroglutamylglutamineME2407090.951.331.050.830.900.951.210.90
caproate (6:0)ME2404751.051.121.150.721.001.020.930.93
cysteineME2404980.941.231.320.671.100.931.020.99
p-aminobenzoate (PABA)ME2406770.551.221.010.801.161.061.020.68
pyridoxine (Vitamin B6)ME2407070.621.120.940.641.211.031.160.74
arginineME2404560.671.190.990.681.141.011.090.83
nicotinamideME2406550.651.200.940.631.161.011.140.79
myo-inositolME2406210.751.221.080.651.091.001.080.86
serineME2407200.611.131.150.741.121.011.100.87
asparagineME2404570.611.181.090.681.121.011.080.87
trans-4-hydroxyprolineME2407560.621.161.090.691.191.021.060.81
riboflavin (Vitamin B2)ME2407130.621.161.080.601.121.001.180.86
aspartateME2404580.651.141.020.661.091.021.140.87
pantothenateME2406780.611.120.990.681.081.021.130.92
sulfate*ME2407350.641.091.010.671.071.021.130.94
folateME2405290.791.270.950.800.951.011.040.92
biotinME2404690.811.140.950.881.070.991.090.91
glucoseME2405440.771.051.000.891.091.001.060.94
cholineME2404830.631.141.090.741.081.011.000.97
histidineME2405740.611.001.080.851.081.021.060.99
methionineME2406180.571.071.230.821.091.021.020.95
lysineME2406120.801.031.130.721.031.021.070.99
threonineME2407520.921.091.240.741.050.991.110.91
glutamateME2405450.751.221.200.821.040.981.080.90
tyrosineME2407600.841.091.160.851.071.010.950.93
valineME2407680.811.041.220.821.011.010.961.06
phenylalanineME2406870.771.061.200.901.011.020.951.00
prolineME2407030.741.141.240.941.010.990.970.98
N-acetylalliinME2406350.880.880.880.881.181.070.880.88
riboseME2407140.981.071.180.861.310.931.150.77
gluconateME2405430.880.931.030.621.191.031.140.83
glycolate (hydroxyacetate)ME2405601.050.930.920.811.181.011.100.84
1-oleoylplasmenylethanolamine*ME2403151.021.021.010.851.110.991.180.83
phenol redME2406830.911.051.000.841.081.011.100.85
3-hydroxy-2-ethylpropionateME2403730.431.180.891.800.550.980.781.44
1-oleoylglycerophosphocholine (18:1)*ME2403110.531.260.721.530.671.001.011.13
2-oleoylglycerophosphocholine*ME2403600.511.190.891.790.601.001.091.11
glycocholenate sulfate*ME2405570.611.350.911.000.621.090.801.09
oleoylcarnitineME2406660.711.410.971.130.571.050.691.19
gamma-glutamyllysineME2405380.421.480.621.280.561.060.901.07
gamma-glutamylmethionineME2405390.391.230.871.170.611.100.931.10
4-androsten-3alpha,17alpha-diol monosulfate (2)ME2403950.791.640.861.430.480.910.951.25
2-myristoylglycerophosphocholine*ME2403580.841.291.031.300.451.001.041.21
1-dihomo-linoleoylglycerophosphocholine (20:2n6)*ME2402890.591.240.711.310.570.951.241.33
1-eicosenoylglycerophosphocholine (20:1n9)*ME2402980.641.160.931.270.461.021.161.28
docosahexaenoate (DHA; 22:6n3)ME2405131.010.820.681.560.890.881.171.40
margarate (17:0)ME2406160.970.840.741.581.040.930.851.25
myristate (14:0)ME2406220.881.040.611.531.080.940.821.12
palmitate (16:0)ME2406710.870.910.601.601.100.940.831.20
4-androsten-3alpha,17alpha-diol monosulfate (3)ME2403960.720.861.041.840.830.961.001.23
1-eicosatrienoylglycerophosphoethanolamine*ME2402970.540.930.881.470.860.941.091.35
1-stearoylglycerophosphoinositolME2403270.741.070.921.580.870.951.061.10
2-eicosatrienoylglycerophosphocholine*ME2403390.841.000.831.350.681.071.001.07
arachidonate (20:4n6)ME2404550.930.930.781.510.761.010.961.19
N-acetyl-isoputrenine*ME2408001.091.051.161.430.631.090.890.91
caprate (10:0)ME2404740.951.120.841.491.090.990.780.86
13-methylmyristic acidME2402790.981.110.911.370.991.000.930.86
3-hydroxypropanoateME2403791.131.190.921.370.940.950.930.93
dihomo-linolenate (20:3n3 or n6)ME2405081.240.990.661.640.841.000.891.01
glycerolME2405501.291.120.791.610.950.950.910.92
16-hydroxypalmitateME2402820.990.990.941.760.880.970.861.07
nonadecanoate (19:0)ME2406581.040.910.891.580.950.980.951.01
2-hydroxyglutarateME2403461.061.530.931.060.780.910.741.20
5,6-dihydrothymineME2404091.031.260.871.100.910.980.771.08
benzoateME2404611.091.310.671.040.830.990.851.05
5,6-dihydrouracilME2404101.081.330.881.370.890.940.681.12
fumarateME2405311.051.350.841.240.800.900.931.20
3-formylindole*ME2407850.601.260.721.251.031.010.810.93
sucroseME2407340.571.420.701.511.060.870.801.17
gamma-glutamyltyrosineME2405410.860.761.141.770.351.110.421.64
indoleacetateME2405870.680.761.242.010.550.940.741.75
O-sulfo-L-tyrosineME2406690.700.871.351.520.451.060.921.38
1-arachidonoylglycerophosphoinositol*ME2402860.730.741.011.590.751.070.691.35
3-(4-hydroxyphenyl)lactateME2403680.990.981.091.480.591.030.741.33
acetylcarnitineME2404340.671.030.921.360.840.970.811.35
phenyllactate (PLA)ME2406930.871.010.951.360.801.000.681.32
uracilME2407620.761.161.301.531.030.920.551.26
N6-carbamoylthreonyladenosineME2406320.621.121.271.320.820.930.651.50
gamma-glutamylphenylalanineME2405400.750.921.291.470.691.000.641.50
N1-methylguanosineME2406280.600.991.291.550.750.990.761.35
cys-gly, oxidizedME2404970.991.020.691.410.760.940.591.60
vanillylmandelate (VMA)ME2407700.710.400.951.421.090.950.801.66
7-methylxanthineME2404320.650.650.651.450.651.100.651.59
guanidinoacetateME2405650.860.560.801.420.801.020.701.65
cystineME2405010.421.350.871.151.510.920.820.74
laurate (12:0)ME2406031.071.070.731.191.290.930.930.89
streptomycinME2407310.851.090.560.921.321.011.060.69
penicillin GME2406811.051.140.420.871.191.051.270.48
citrateME2404870.961.230.350.941.191.031.170.56
glutamineME2405460.871.180.371.001.281.031.180.51
stearidonate (18:4n3)ME2407281.331.320.300.780.861.090.810.79
tryptophan betaineME2407591.371.350.310.441.020.951.380.77
tauro-beta-muricholateME2407391.240.442.710.440.820.852.211.15
alpha-hydroxyisocaproateME2404460.700.512.262.800.411.100.941.03
arachidate (20:0)ME2404540.860.861.792.850.861.000.500.90
glycocholateME2405560.420.422.491.741.220.961.190.97
N-acetyl-aspartyl-glutamate (NAAG)ME2406381.070.602.452.481.330.810.890.91
3-ureidopropionateME2403890.241.503.022.250.750.790.801.11
glycoursodeoxycholateME2405620.571.232.862.560.700.870.571.13
glycochenodeoxycholateME2405550.360.613.602.100.930.850.881.35
N-acetyltyrosineME2406520.960.883.991.570.520.970.781.16
guanineME2405660.431.215.131.271.230.880.840.50
guanosineME2405670.450.933.780.500.981.050.551.12
inosineME2405910.451.013.230.471.440.980.520.92
taurochenodeoxycholateME2407400.230.273.890.513.440.540.710.76
taurocholateME2407410.120.121.470.195.200.400.400.31
glycohyocholateME2405590.370.561.250.493.650.630.580.51
3-methylhistidineME2403870.411.530.130.213.840.560.130.30
bradykinin, des-arg(9)ME2404700.030.920.030.103.930.740.140.33

Factors:

F1GROUP:case | TIMEPOINT:BL | REGION:MAK | GENDER:F
F2GROUP:case | TIMEPOINT:BL | REGION:MAK | GENDER:M
F3GROUP:case | TIMEPOINT:M06 | REGION:MAK | GENDER:F
F4GROUP:case | TIMEPOINT:M06 | REGION:MAK | GENDER:M
F5GROUP:control | TIMEPOINT:BL | REGION:MAK | GENDER:F
F6GROUP:control | TIMEPOINT:BL | REGION:MAK | GENDER:M
F7GROUP:control | TIMEPOINT:M06 | REGION:MAK | GENDER:F
F8GROUP:control | TIMEPOINT:M06 | REGION:MAK | GENDER:M
Data matrix
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