Clustering data with hclust algorithm for (Study ST003521)

HILIC NEGATIVE ION MODE (Analysis AN005783)
MetaboliteStructureF1F2F3F4F5F6F7F8F9F10F11F12F13F14F15F16F17F18F19F20F21F22F23F24F25F26F27F28F29F30F31F32F33F34F35F36F37F38F39F40F41F42F43F44F45F46F47F48F49F50F51F52F53
L-GlutamineME9179760.071.570.1913.750.220.110.480.130.210.240.100.853.534.132.412.180.050.231.580.360.050.400.170.200.231.501.800.710.090.310.420.690.210.280.120.140.090.040.181.271.330.320.136.763.140.190.960.141.280.570.630.610.63
Glu-Glu-IleME9176550.021.830.099.950.190.090.790.090.280.610.070.624.133.352.202.040.040.904.020.380.192.700.520.230.301.092.480.630.050.440.621.900.090.280.160.210.130.020.311.320.350.100.120.752.380.120.760.051.360.710.680.730.51
ApigeninidinME9176480.574.232.0912.520.440.410.650.340.420.520.481.061.081.151.201.000.220.410.820.370.200.520.550.440.350.800.900.560.160.420.600.530.370.490.510.440.330.260.721.261.311.090.383.221.190.511.020.671.240.720.740.740.74
carbidopaME9176770.253.220.948.960.670.470.900.360.600.580.501.851.822.221.671.500.280.561.710.580.220.960.690.640.431.161.400.730.210.540.721.080.620.890.560.550.200.140.451.360.970.510.162.253.230.621.990.681.260.730.730.750.80
sn-glycero-3-PhosphoethanolamineME9179060.142.350.7610.310.460.430.710.340.480.390.461.191.752.441.682.880.160.481.880.690.200.630.610.480.261.071.430.680.150.430.960.880.410.560.410.400.170.140.471.200.910.550.192.461.800.461.490.531.210.700.650.680.79
Ala-Gly-Pro-SerME9180020.210.560.301.100.110.13NA0.090.290.160.150.173.703.193.542.890.300.500.510.600.270.330.330.220.963.071.911.700.350.750.830.960.370.440.260.31NA0.080.130.274.222.190.695.981.260.470.530.301.830.970.890.740.82
3-Dehydro-L-threonateME9176100.040.890.144.990.120.070.240.09NA0.120.05NA3.663.094.252.400.070.391.810.600.100.520.220.160.352.632.771.220.160.500.620.840.240.240.090.140.050.030.140.43NA0.930.2611.362.120.260.880.151.620.740.740.710.79
alpha-RibazoleME9176570.040.850.124.210.110.060.270.080.130.110.060.324.444.203.903.140.070.371.630.560.090.510.200.140.372.433.121.200.160.450.570.780.240.220.090.160.060.030.140.572.320.910.2511.151.750.260.800.141.510.650.680.680.69
L,L-Cyclo(leucylprolyl)ME9180270.450.710.421.200.660.490.820.430.740.800.460.731.110.840.710.790.500.840.930.490.400.780.570.450.610.720.810.530.450.790.690.890.470.460.460.430.620.410.851.200.610.490.460.541.160.470.760.4012.370.570.450.470.55
PE(32:0)ME9180151.460.830.700.490.710.880.771.070.680.820.540.580.851.000.740.630.920.840.730.750.990.770.740.560.710.780.730.680.900.871.000.810.600.830.660.590.650.840.770.670.780.810.712.470.920.920.790.8413.600.740.840.700.80
(1S,4S)-4-Hydroxy-3-oxocyclohexane-1-carboxylateME9176280.100.070.060.040.150.120.120.080.140.100.100.080.310.350.280.325.365.503.302.628.578.807.035.170.320.210.360.270.350.340.440.360.390.230.290.290.080.130.100.080.100.110.130.140.110.340.160.130.320.410.400.380.25
3-(Pyrazol-1-yl)-L-alanineME9176060.030.020.020.010.190.310.230.180.330.260.290.180.400.290.300.280.674.592.572.137.426.985.284.090.170.140.320.130.740.711.050.591.821.001.861.820.070.090.090.070.020.020.030.030.070.270.130.101.211.421.421.401.18
N-α-acetyl lysine methyl esterME9176300.020.020.030.010.170.300.190.170.300.230.270.160.420.290.270.274.354.412.582.056.826.995.153.940.170.140.280.130.720.661.060.591.870.971.861.690.060.090.080.060.050.060.070.070.060.260.120.101.341.671.661.651.04
Ala-Thr-Thr-TyrME9175460.200.170.220.170.290.510.390.430.450.450.420.260.650.520.670.403.633.492.161.615.545.694.233.340.430.500.520.300.850.811.170.701.761.021.861.500.170.340.200.160.160.330.290.200.200.440.290.211.271.551.631.551.03
N-(6-Aminohexanoyl)-6-aminohexanoateME9178810.02NANANA0.050.100.080.030.160.080.070.050.410.180.200.183.923.341.661.385.006.254.623.080.140.090.270.100.630.390.870.361.850.320.941.16NA0.040.030.01NANA0.020.040.020.070.060.032.141.892.012.000.66
[FA methyl(11:0)] 10-methyl-undecanoic acidME9177130.550.560.500.720.470.530.450.440.540.520.590.490.550.400.450.550.600.590.500.470.580.480.760.520.610.560.480.510.540.720.570.700.770.700.620.600.420.570.490.560.610.470.490.770.600.481.430.452.956.466.676.676.85
Ile-TyrME9177450.590.580.590.630.380.540.430.540.590.440.560.450.380.460.390.490.590.570.450.440.440.550.690.470.730.430.540.580.500.690.810.700.630.760.540.510.340.400.440.360.350.390.360.740.550.541.530.566.695.685.175.165.48
FA oxo(9:0) oxo-nonanoic acidME9177460.080.070.120.050.140.210.120.120.270.210.490.110.300.140.240.201.661.031.151.221.572.172.081.750.260.140.140.130.470.310.780.511.360.360.721.120.030.080.050.030.070.130.100.060.120.360.270.134.748.578.428.290.72
N6-Acetyl-N6-hydroxy-L-lysineME9177250.090.060.14NA0.300.360.270.150.450.310.370.160.830.520.700.831.261.191.110.891.161.441.310.940.530.340.530.400.620.550.810.691.140.670.790.900.090.190.160.100.070.200.230.210.160.530.360.253.507.517.377.610.65
(2R,4S)-2,4-DiaminopentanoateME9177910.260.170.160.080.340.380.270.280.310.300.440.200.610.470.470.611.060.980.740.870.760.950.960.850.640.440.600.580.880.720.980.841.070.480.590.800.190.440.240.080.230.270.320.260.170.460.300.243.068.428.657.920.60
TetraacetylethylenediamineME9179050.280.160.170.080.250.440.210.240.360.230.420.190.540.390.470.611.190.920.770.980.691.080.920.940.590.370.590.550.800.710.910.761.250.490.620.910.130.310.190.100.190.240.280.240.150.340.380.234.048.208.208.040.67
gamma-L-Glutamyl-D-alanineME9179321.170.660.530.170.190.460.040.250.640.431.140.410.020.050.030.070.760.310.250.390.731.251.081.640.310.170.120.240.680.360.370.253.551.191.122.020.140.650.270.070.280.580.340.280.130.460.760.314.038.057.537.270.77
[PR] 2E,6E-farnesolME9177941.210.260.410.070.140.280.080.170.370.240.630.170.300.240.200.221.020.450.470.390.840.770.871.250.240.150.230.180.680.290.410.392.840.680.841.290.100.480.110.050.180.310.230.150.120.370.370.265.359.658.588.070.39
Ile-Ser-ValME9175870.310.360.350.360.320.440.650.380.640.370.310.341.032.230.370.540.612.080.460.593.150.621.480.680.770.450.650.631.880.900.790.270.440.360.280.960.320.430.370.420.350.330.380.340.310.550.380.322.396.396.906.422.00
5-Oxo-D-prolineME9176200.720.310.540.130.250.650.290.410.580.270.430.290.611.020.470.461.111.560.880.923.540.882.311.530.570.520.540.631.290.641.070.600.910.640.731.600.230.580.290.190.210.280.290.250.180.400.520.342.075.145.445.381.33
OxalateME9176130.690.340.510.120.270.620.280.390.560.260.410.280.661.090.460.501.171.600.841.063.390.842.211.470.630.540.520.671.430.751.200.640.870.610.701.530.210.560.280.200.230.270.280.280.170.380.500.322.084.935.225.161.78
IMPME9179030.060.040.04NA0.150.340.160.190.200.190.350.160.470.330.400.401.420.810.920.972.082.143.012.900.530.240.390.351.120.980.880.821.570.401.221.120.050.220.120.120.100.180.160.100.140.210.280.193.996.175.906.020.73
3-Phospho-D-glycerateME9179120.220.170.140.100.330.480.350.360.430.320.450.300.800.760.750.821.121.031.241.150.841.241.151.180.670.480.730.610.890.791.070.961.250.600.830.960.160.300.260.160.160.220.260.340.240.360.410.263.826.456.586.720.71
L-AlanineME918017NANANANA0.320.410.180.150.280.140.470.210.790.490.530.511.510.860.901.080.871.491.141.110.680.450.510.600.980.711.090.741.610.600.721.140.120.290.13NA0.130.290.250.140.140.390.400.193.366.205.816.210.70
LL-2,6-DiaminoheptanedioateME9179160.190.090.09NA0.180.220.110.110.230.160.270.090.690.530.860.671.781.361.391.071.671.681.981.480.810.560.880.710.810.760.990.961.050.420.670.700.080.170.100.090.240.380.410.380.190.280.390.232.887.356.546.430.62
gamma-Glutamyl-gamma-aminobutyraldehydeME9179980.150.060.130.040.110.220.100.100.120.110.290.081.380.521.201.042.081.201.591.301.492.412.391.670.740.341.010.640.580.341.150.771.040.220.610.850.050.120.100.040.040.110.140.050.030.100.140.083.986.946.516.670.83
Ile-Pro-ProME9179990.150.060.130.040.100.210.090.100.120.110.290.081.350.521.241.082.051.181.571.281.472.382.351.580.630.311.070.600.540.321.120.761.020.220.600.830.050.070.070.040.040.110.140.050.030.090.130.083.926.937.236.670.82
1-hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-(1^-rac-glycerol)ME9176230.420.340.250.250.340.530.240.330.320.350.610.331.450.581.331.281.901.091.551.241.512.122.251.870.720.761.160.750.740.531.190.831.170.570.741.030.330.350.340.240.310.370.450.250.200.370.450.403.335.445.015.650.78
UDPME9179100.160.140.110.090.160.250.090.090.230.110.180.081.310.991.180.941.642.551.711.432.221.882.381.400.680.360.700.501.330.851.391.120.870.390.760.930.060.080.06NA0.110.160.290.180.110.400.200.111.445.475.915.630.59
5-Methyltetrahydropteroyltri-L-glutamateME917973NA0.020.05NA0.190.290.210.200.260.180.260.111.491.111.481.701.621.781.851.431.511.501.471.100.780.531.170.850.740.711.300.990.640.290.550.610.080.150.120.040.180.200.360.230.190.220.290.142.125.805.645.500.73
D-4-HydroxyphenylglycineME9180260.040.020.04NA0.170.270.200.180.220.170.250.091.441.041.381.581.551.661.861.331.401.491.441.020.730.501.090.790.610.661.210.920.630.290.590.570.070.140.110.080.160.200.330.230.220.200.270.132.246.566.366.560.70
Ala-Gly-ProME917991NA0.13NA2.460.460.281.540.510.340.710.492.871.044.083.361.060.130.442.020.490.060.500.630.520.231.031.820.610.170.440.910.980.420.430.320.280.06NA0.302.660.660.21NA2.484.500.311.890.381.200.660.640.660.61
homocapsaicinME9176850.030.390.063.150.620.401.660.540.500.620.493.501.224.503.811.380.160.422.420.560.090.690.740.640.311.041.450.610.100.460.771.130.660.730.380.370.110.070.312.850.820.290.122.825.730.412.410.411.740.700.760.770.87
4-CoumarateME9176970.261.510.332.620.810.590.950.530.600.700.431.402.271.522.401.860.280.681.250.920.441.240.710.490.532.011.741.140.461.061.431.650.700.750.550.570.280.240.631.372.070.830.294.991.290.630.970.472.100.830.981.021.12
Ala-Val-Asp-SerME9178990.131.670.374.240.260.180.530.210.31NA0.170.492.882.583.002.260.150.330.850.410.170.470.320.270.382.071.181.050.190.590.540.630.310.370.260.34NANA0.310.743.341.210.345.702.210.430.940.331.490.750.650.540.86
Trifluoroacetic acidME9176680.051.030.145.300.320.240.670.240.310.280.130.853.833.223.502.820.090.472.190.670.180.930.280.250.312.292.761.270.240.691.091.130.450.400.170.290.100.060.271.021.710.500.176.002.810.311.050.191.610.720.750.730.79
4-hydroxy-3-indolylmethyl-glucosinolateME9178510.030.610.114.220.650.472.310.460.681.550.291.771.842.311.141.390.110.802.560.340.231.230.360.480.300.521.150.350.120.410.460.800.190.330.150.150.470.201.112.880.910.310.663.245.150.420.800.131.661.311.321.361.21
FA trihydroxy(18:1)ME917810NA0.61NA4.120.460.312.270.330.460.980.210.962.593.621.111.18NA0.643.210.30NA0.470.12NA0.270.741.100.20NA0.210.230.88NA0.13NANA0.13NA0.391.800.530.110.103.185.170.140.760.090.930.580.410.490.51
HomogentisateME9177680.201.500.324.240.840.792.010.500.570.930.261.311.471.261.451.210.171.183.130.600.331.160.480.240.521.131.270.720.290.581.271.030.480.610.260.350.450.230.922.990.840.400.335.263.420.380.760.353.310.750.870.800.92
D-Alanyl-D-alanineME9177800.090.840.204.630.420.160.370.130.370.240.160.892.933.612.011.900.060.402.030.540.100.910.320.290.301.601.560.940.190.590.781.180.370.510.230.330.110.050.191.051.330.350.115.285.990.642.130.351.320.630.730.780.76
Ile-Met-SerME9177260.060.810.154.860.330.300.880.370.430.400.160.912.982.452.092.310.100.492.640.630.201.120.230.370.231.662.031.070.230.610.871.290.440.410.250.310.090.100.251.061.410.440.145.226.100.701.910.311.670.760.850.850.92
15S-hydroxy,14R-(S-cysteinyl)-5Z,8Z,10E,12E-eicosatetraenoic acidME9175540.150.890.234.160.510.491.540.440.420.510.25NA3.221.922.883.000.180.522.970.630.331.160.340.430.271.402.230.900.280.591.171.030.350.450.250.330.240.150.451.601.060.330.183.783.280.280.770.212.041.111.131.101.29
PG(36:2)ME9175620.100.930.185.750.440.421.320.380.400.430.211.313.222.512.903.090.120.413.270.530.261.030.260.400.181.242.000.840.220.531.050.980.270.360.200.260.180.090.351.621.000.250.143.974.360.210.670.172.190.991.081.031.11
FA (12:1) dodecenoic acidME9179260.111.380.275.270.800.741.730.480.661.200.251.402.802.411.401.160.131.172.630.560.321.540.450.210.551.201.580.770.250.661.281.100.410.550.250.340.500.180.912.210.820.340.273.814.730.350.720.281.920.800.750.750.56
Lys-ValME917724NA0.930.206.540.280.391.320.610.280.740.161.402.613.251.761.17NA0.412.070.450.221.120.240.180.251.451.370.390.190.710.391.190.190.210.180.150.250.150.921.930.830.450.364.143.480.160.700.131.540.790.630.760.76
Carnosifloside IIIME9177780.482.321.146.320.690.560.930.440.560.510.471.062.191.801.861.880.320.731.520.710.440.940.770.640.491.781.800.830.330.670.971.040.490.660.530.490.430.320.681.071.510.800.303.202.680.621.190.811.420.700.761.070.70
Ala-Val-Val-ProME9176810.181.270.264.440.700.601.080.420.560.550.301.222.302.062.601.750.180.671.850.770.321.020.560.440.311.772.051.070.390.791.421.520.640.690.460.530.210.180.491.481.800.850.214.322.730.581.170.371.970.830.870.851.03
FA (13:2) tridecadienoic acidME9177890.221.130.314.760.670.511.090.440.630.540.361.191.621.691.921.690.230.532.290.640.450.940.460.390.361.621.561.170.360.821.331.370.500.710.470.470.130.200.471.431.320.490.183.794.090.781.790.521.810.891.111.211.14
Ala-Leu-Trp-ValME917594NA0.21NA1.290.520.272.000.300.881.420.271.871.441.540.780.800.080.883.930.470.272.050.670.360.330.721.410.540.160.891.132.410.340.650.340.430.220.070.501.660.230.100.100.488.040.782.720.351.170.690.810.800.66
PA(34:1)ME917639NA0.44NA1.850.150.080.770.090.200.52NA0.444.704.033.122.95NA0.904.010.620.201.810.410.180.491.102.630.70NA0.500.711.440.080.180.070.140.11NA0.340.940.420.200.201.741.520.080.59NA1.230.790.840.640.83
FA oxo(18:0)ME917659NA1.040.054.060.180.110.700.100.290.560.120.644.453.743.032.530.040.994.850.580.152.180.510.210.511.293.240.960.080.510.772.090.100.240.140.180.15NA0.340.860.450.230.191.011.470.170.640.031.240.790.850.740.62
Glu-GluME917542NA0.920.053.820.240.101.070.120.280.600.070.625.093.812.642.390.040.954.390.450.182.410.610.220.441.102.450.640.050.500.691.660.130.260.170.150.14NA0.351.350.400.150.161.312.620.140.870.051.260.720.750.770.62
5-MethoxytryptophanME9175650.000.390.042.710.250.131.330.140.320.540.080.724.193.982.042.160.061.006.070.360.161.910.400.220.511.032.680.620.090.630.731.950.170.280.120.210.220.060.532.440.310.110.151.174.230.190.840.071.210.870.800.830.74
CTPME9178900.000.320.041.210.520.301.650.290.410.590.050.343.122.191.731.540.111.465.330.700.302.820.800.390.711.232.740.970.140.941.192.440.290.340.180.230.350.080.762.300.440.170.221.212.800.301.380.121.311.051.030.980.90
Hexanoic acidME917870NA0.34NA1.000.690.391.800.410.631.060.221.093.452.841.731.690.101.335.390.640.362.180.580.280.591.042.150.600.100.620.931.620.210.390.180.210.490.120.832.890.370.180.240.892.890.220.880.111.330.600.720.660.73
HydroxypyruvateME9176580.010.440.052.090.510.271.940.300.641.110.171.303.162.781.651.610.061.014.950.440.212.050.550.300.531.062.380.640.130.861.082.350.290.500.240.350.320.080.722.740.340.140.160.964.440.281.200.121.240.830.830.830.77
UDP-2,3-diacetamido-2,3-dideoxy-α-D-glucuronateME9178880.010.290.041.350.390.231.580.250.460.770.120.843.762.932.142.180.081.275.950.520.232.180.590.290.551.002.580.740.110.710.931.990.220.360.180.260.280.060.642.280.340.130.181.004.160.241.030.091.210.870.820.820.78
cis-2-hydroxypenta-2,4-dienoateME9176340.010.500.051.620.670.322.040.360.791.200.211.452.531.541.741.450.081.173.560.550.252.460.700.320.581.312.470.800.171.091.332.840.380.640.320.450.400.090.822.480.390.150.191.162.330.331.600.151.150.960.990.960.89
MesaconateME917583NA0.280.050.900.840.542.880.541.041.650.311.662.191.581.371.470.101.305.230.630.392.780.890.470.410.651.600.500.110.640.941.600.250.480.270.320.410.101.012.470.370.170.210.923.420.261.240.151.210.820.780.800.78
NicotinamideN-oxideME917766NA0.270.021.021.070.642.770.671.221.830.381.601.961.261.561.270.111.434.010.890.503.491.090.470.440.801.790.590.130.680.860.860.280.470.310.390.480.110.932.350.420.190.221.042.460.291.510.161.280.850.880.900.82
D-Gluconic acidME917764NA0.370.111.321.050.632.580.741.011.640.461.632.171.651.431.570.111.173.330.550.402.481.090.480.550.841.740.630.130.620.861.110.250.440.350.330.830.241.443.550.440.250.210.812.430.260.950.181.420.730.860.810.77
HymenoflorinME9176990.010.480.061.911.030.553.160.611.332.160.442.521.861.501.051.000.071.003.950.460.352.580.890.450.330.631.330.410.130.740.951.700.350.640.370.440.500.121.113.250.310.150.150.703.090.281.240.181.240.830.800.830.78
FADME917894NANANANA0.490.16NA0.120.290.450.540.300.41NA0.340.564.741.722.071.520.745.481.241.670.220.160.13NA0.400.510.700.932.560.992.770.45NA0.13NANANANANANA0.130.27NA0.120.71NANANANA
Bis-D-fructose 2^,1:2,1^-dianhydrideME9175560.152.270.515.911.410.523.511.301.832.090.462.320.880.680.320.43NA0.290.72NANA0.420.04NANA0.390.770.11NA0.140.310.43NANANANA0.990.291.623.310.930.490.491.251.110.070.260.091.390.590.550.640.71
GTPME9178920.431.050.561.720.910.661.300.770.901.600.620.940.881.561.060.900.471.091.410.720.771.120.780.612.210.991.100.850.510.960.951.120.550.690.670.612.000.551.011.550.820.621.744.302.500.840.910.621.570.750.780.850.95
CitrateME9175910.390.500.761.550.771.141.400.810.751.200.920.860.870.721.111.560.600.700.880.790.591.410.620.691.340.941.341.280.650.880.911.210.570.270.290.481.260.891.230.971.441.121.267.060.480.660.740.541.881.491.551.691.81
D-GlucarateME9176040.951.102.553.630.680.911.340.680.730.950.900.770.720.641.151.520.480.570.680.660.491.100.580.631.020.751.291.230.470.770.800.920.420.590.680.461.050.651.570.921.060.831.347.570.580.520.881.591.460.560.931.321.26
D-galactosylononitolME9175930.841.351.605.050.610.921.280.610.671.070.690.701.050.821.051.420.460.641.060.620.451.410.470.561.120.851.331.040.510.780.851.010.410.670.640.440.960.671.011.071.180.871.085.011.050.530.761.462.141.221.301.321.29
D-PhenylalanineME9176380.741.232.015.810.610.861.570.570.660.960.760.711.000.801.111.480.360.581.050.600.401.260.470.491.070.751.201.100.410.710.721.000.360.530.560.420.920.611.451.211.060.731.235.580.880.440.861.371.991.161.201.221.14
MaltoseME9175970.971.251.794.170.700.991.350.700.791.150.800.771.130.801.151.530.510.651.250.730.571.490.560.601.320.951.591.110.600.820.901.080.470.200.390.301.050.771.131.041.340.981.105.101.000.610.821.581.090.771.441.080.91
SucroseME9176170.871.272.444.010.670.961.570.670.721.080.850.740.970.831.231.590.420.490.750.490.481.430.530.551.170.771.241.230.470.480.540.700.430.620.650.450.740.661.561.001.160.821.385.380.780.460.961.491.891.311.341.361.31
PS(18:0)ME9175471.113.802.496.191.081.081.330.910.800.960.851.140.210.690.540.340.310.550.470.380.220.390.480.420.740.440.550.280.210.420.400.460.500.490.440.491.170.751.191.421.571.341.752.440.760.671.030.721.721.201.171.060.91
Asn-Leu-Pro-ProME9179631.012.451.794.560.650.850.830.730.440.650.490.561.021.251.351.010.490.881.140.770.390.810.580.491.380.901.370.930.480.680.850.850.700.460.480.551.301.001.391.761.050.921.091.860.810.580.860.571.751.061.151.080.96
UMPME9176050.473.021.224.461.030.801.470.851.221.860.961.560.881.201.141.190.251.041.190.680.461.050.750.420.520.651.030.560.280.620.770.840.450.720.660.380.640.370.741.021.040.871.021.930.920.531.260.511.641.151.160.531.04
ATPME9178980.171.140.422.301.320.971.570.971.071.350.722.332.192.461.551.610.291.14NA0.660.301.040.780.450.521.231.490.810.170.770.811.560.560.680.430.500.590.521.672.380.960.600.221.64NA0.491.360.541.230.560.530.630.74
D-GlutamineME9177481.321.361.031.311.511.241.281.061.121.120.850.621.461.410.971.25NANA0.51NANA0.20NANA1.251.431.071.281.090.64NA0.940.370.450.400.242.172.041.961.480.670.780.811.32NANA0.630.460.780.450.540.480.62
Gln-Pro-His-HisME9179661.261.801.362.761.361.190.991.211.071.060.800.981.191.500.840.890.490.570.710.740.540.440.420.391.261.010.790.790.620.780.710.700.650.630.630.651.521.251.522.201.161.220.892.320.750.630.960.860.660.770.770.840.90
FA dimethyl(16:0)ME9175520.870.600.353.940.721.625.680.360.591.270.321.360.911.471.270.620.751.851.630.390.471.030.760.420.980.440.600.700.570.660.851.980.340.610.630.880.330.490.500.820.440.630.830.731.890.630.530.352.821.651.651.722.17
N-hydroxy DAPME9178191.020.670.483.080.871.593.920.470.681.280.461.191.141.591.310.760.681.662.000.480.561.070.930.491.050.580.560.760.670.610.971.860.450.730.770.900.410.530.621.080.540.640.720.732.960.850.670.512.550.361.571.681.76
FA hydroxy(9:0) hydroxy-nonanoic acidME9178000.301.510.251.340.330.692.870.201.183.160.411.272.201.962.110.780.492.102.860.320.250.800.630.520.810.400.500.621.090.340.761.940.260.500.270.990.980.660.562.220.620.650.461.501.630.400.910.692.351.141.240.950.77
Phenylalanyl-ThreonineME9177880.401.690.400.610.430.663.810.291.264.850.301.352.150.963.061.120.512.092.240.140.210.880.430.400.910.370.470.651.140.450.762.790.380.550.300.901.310.600.471.570.730.700.321.621.110.510.620.711.861.391.111.030.88
CarbetamideME9178200.581.270.490.810.441.061.460.311.222.870.321.181.140.481.450.460.491.571.320.36NA0.350.420.771.160.360.360.352.470.511.171.530.260.870.381.661.751.290.670.840.481.190.303.020.520.420.271.081.991.852.082.431.67
Ala-Ala-SerME9178390.771.690.550.640.410.921.49NA1.483.300.500.951.000.611.910.401.212.021.010.37NA1.150.910.930.950.480.481.141.190.470.521.620.650.680.401.581.560.840.491.270.881.060.381.681.130.400.480.971.271.251.381.331.08
L-ErythruloseME9177860.711.730.660.580.251.151.820.251.753.960.481.161.120.652.020.790.622.350.920.230.331.070.590.860.970.630.600.771.210.580.631.790.400.750.501.431.790.830.541.290.821.160.481.961.090.900.391.061.661.741.641.721.09
Thr-Ala-AlaME9178353.641.131.99NA0.381.070.301.161.03NA1.010.460.32NA0.330.811.180.520.520.711.210.250.741.001.821.350.801.611.610.670.740.661.100.920.950.690.892.260.640.210.731.001.272.49NANA0.400.59NANANANA0.81
UDP-glucoseME9175583.301.401.540.570.681.02NA0.830.910.501.300.560.480.440.320.771.440.410.610.951.370.341.261.361.451.150.901.331.780.760.590.641.301.290.801.000.641.940.840.230.971.471.261.69NA0.410.720.521.15NANANA0.82
Arg-Leu-Thr-TyrME9175340.07NA0.10NANA0.552.200.160.50NANANA0.643.610.10NA0.161.760.080.112.810.032.190.400.400.110.180.342.380.520.56NA0.040.10NA2.210.070.07NA0.190.09NANANANA0.200.23NA3.492.963.143.093.09
FA (18:3)ME9179210.710.450.670.390.480.981.310.730.930.520.540.470.931.920.700.550.891.430.770.892.220.761.601.110.880.650.740.811.640.931.110.740.720.680.621.630.520.650.500.670.520.490.500.520.420.730.770.492.353.463.533.542.71
L-SerineME9176980.550.400.660.340.370.912.240.470.980.380.450.410.982.400.530.360.651.570.410.452.710.462.241.030.730.550.510.382.321.001.060.390.500.460.472.560.430.590.340.530.430.330.400.380.410.580.620.352.613.903.263.633.44
L-ProlineME9179870.100.060.070.040.320.951.370.491.090.380.450.330.370.950.190.220.451.830.400.404.690.763.981.410.370.200.370.421.790.901.550.440.910.820.854.720.130.230.160.160.080.070.090.080.210.660.670.332.593.313.433.382.76
DethiobiotinME9179850.110.080.120.030.620.970.600.771.160.580.890.450.410.510.320.450.941.360.950.893.101.833.052.080.500.330.550.571.251.051.660.982.011.432.023.050.220.390.240.150.090.090.140.120.290.990.850.541.613.703.903.591.40
GlycylprolineME9179770.110.080.120.030.630.980.600.771.170.560.900.450.420.490.330.460.951.270.860.893.121.843.082.100.450.330.520.581.261.051.670.992.021.442.033.080.220.390.240.150.090.090.140.120.291.000.860.551.513.733.933.621.41
7,8-H2pterin-6-ylmethyl-l-(4-aminophenyl)-1-deoxy-D-ribitolME917853NANANANANANA0.560.67NANA1.190.91NANA0.430.34NANA0.320.66NANA0.940.84NANA0.580.44NANA0.590.59NANA1.010.80NANA0.520.50NANA0.460.51NANA1.051.251.833.283.113.180.42
(E)-GlutaconateME9175660.360.470.43NA0.631.720.490.180.830.610.350.221.821.180.89NA1.451.17NA0.602.591.252.400.531.550.920.64NA1.310.800.560.341.420.580.630.410.580.820.580.610.920.470.39NA0.720.390.380.432.993.682.891.960.85
4-OxoprolineME9179200.450.570.390.310.330.420.420.370.560.360.330.331.421.461.671.280.831.030.770.910.570.720.620.471.271.161.351.010.620.700.740.870.690.480.440.760.480.490.580.460.821.160.931.490.350.660.700.391.235.755.515.480.83
Deamino-NAD+ME9176540.150.140.220.420.570.530.280.340.790.520.640.460.610.530.830.861.161.521.491.181.682.482.031.860.660.320.980.691.351.412.121.982.061.121.521.770.170.210.250.190.130.380.580.520.590.570.780.522.114.043.844.100.83
(R,R)-Tartaric acidME9176310.280.150.170.070.250.390.260.310.290.250.530.311.440.821.141.431.771.431.761.581.821.972.352.020.870.561.100.951.120.951.671.581.470.611.381.560.140.320.230.130.170.260.390.260.200.450.450.402.585.044.704.570.91
AMPME9179820.220.110.110.050.240.310.230.300.300.230.520.301.450.841.081.591.641.721.821.581.972.072.512.100.890.591.080.931.211.111.771.661.430.601.391.460.120.270.230.110.170.230.370.260.090.430.500.381.633.673.643.540.94
L-LeucineME9179830.230.110.120.050.250.330.240.310.320.230.530.311.500.861.121.641.701.781.881.641.721.822.252.170.910.611.110.961.080.921.831.391.480.621.431.510.130.280.240.110.170.240.380.270.190.450.520.402.274.284.104.040.97
Leucyl-leucineME9179240.090.110.050.030.801.000.530.590.910.670.630.530.580.390.410.401.491.331.091.211.211.551.111.020.640.510.550.431.461.501.681.531.881.371.551.420.280.280.270.200.040.030.04NA0.601.190.750.611.464.484.394.310.84
(2S,4S)-MonatinME917592NANANANANA0.15NANA0.14NA0.18NA0.780.450.710.661.201.101.191.071.071.211.330.960.630.440.680.690.850.791.190.890.870.370.570.74NANANANANA0.120.180.22NA0.210.31NA1.664.684.333.860.56
Ile-ValME917797NA0.32NANA0.470.430.550.440.590.450.520.421.040.630.560.881.020.951.040.860.741.780.961.430.530.550.880.630.730.970.880.960.830.520.750.81NA0.430.37NA0.310.34NA0.46NA0.530.400.483.175.044.954.490.60
FA hydroxy(16:0)ME9176630.610.410.370.260.480.790.400.560.590.630.760.550.790.650.650.691.581.061.151.451.271.611.741.470.690.560.720.650.771.031.401.221.651.001.251.310.370.560.390.280.350.410.530.450.310.600.640.342.114.334.184.310.98
2-oxopimelateME9178170.350.320.33NA0.350.720.270.470.720.380.620.341.160.920.940.691.661.541.171.461.131.181.301.020.970.870.970.521.131.091.410.811.310.710.950.910.280.380.30NA0.270.540.430.450.310.780.350.401.565.154.544.630.79
PseudouridineME9177620.290.150.25NA0.560.630.620.370.560.450.710.541.050.900.971.121.301.531.291.251.301.391.010.770.860.560.870.750.960.761.530.920.860.380.580.65NA0.170.30NA0.220.360.350.370.290.520.380.203.234.744.594.760.85
[FA oxo(14:0)] 3-oxo-tetradecanoic acidME9177320.260.300.23NA0.420.670.320.310.660.450.530.390.730.930.821.031.341.251.521.191.161.261.231.070.700.620.900.861.091.011.351.131.270.890.981.140.190.490.19NA0.290.400.520.520.320.720.510.302.494.533.694.960.83
IndolelactateME9178820.370.210.19NA0.310.700.340.460.560.320.550.260.990.991.161.161.181.481.151.220.940.980.941.041.000.821.081.171.121.081.471.080.860.610.810.61NA0.480.29NA0.250.380.620.35NA0.720.48NA2.104.044.014.200.89
Lys-Ala-ProME9175530.420.310.340.190.530.670.480.490.510.420.590.371.130.941.111.121.371.431.401.361.061.121.091.021.140.871.191.061.030.961.341.160.830.570.720.760.290.430.380.230.310.450.580.520.310.560.520.342.374.444.584.650.92
Dicyclohexyl disulfideME9178280.880.980.58NANA1.09NANA0.66NA0.56NA0.770.680.570.590.810.870.670.600.910.981.201.520.560.510.840.750.800.600.700.761.370.590.561.28NA0.560.38NA0.460.620.520.57NA0.590.50NA1.743.943.684.230.98
UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-meso-2,6-diaminoheptanedioate-D-alanineME9178571.600.670.61NANA0.45NANA0.53NA0.80NA0.86NA0.530.621.100.690.651.051.510.701.121.350.890.640.480.731.300.571.160.611.091.030.500.98NA0.570.38NA0.350.670.880.61NANA0.44NA0.933.473.763.490.66
(S)-AMPAME9179300.940.750.600.400.590.860.440.731.050.731.180.900.550.430.360.510.630.690.740.810.770.991.141.630.550.590.520.510.720.501.050.882.201.411.551.740.411.050.620.350.510.610.590.860.350.690.970.731.764.444.494.250.70
DaidzinME9179480.440.620.480.440.800.810.630.540.790.790.890.821.070.730.890.750.830.890.850.810.511.240.980.711.020.711.020.710.910.870.980.981.291.061.031.150.710.680.790.630.630.780.760.640.431.100.940.712.203.623.683.641.01
Ile-Val-Pro-SerME9180060.850.820.750.630.930.910.740.870.880.910.850.810.920.820.790.810.920.960.680.890.720.860.830.960.940.950.780.890.900.900.820.840.970.940.880.910.840.870.920.721.011.030.960.990.700.890.910.791.482.923.252.960.94
PA(32:1)ME9176420.930.950.790.450.941.110.600.690.900.900.700.751.021.000.630.711.360.760.851.200.671.320.830.661.081.160.590.710.871.240.700.711.211.210.581.180.901.130.980.800.780.951.101.140.590.510.821.042.192.713.412.640.99
d-biotin d-sulfoxideME9179190.300.280.380.080.880.930.560.661.100.751.020.750.510.400.470.581.020.860.730.691.111.141.401.441.040.850.820.811.201.211.090.952.221.371.451.640.561.040.690.440.360.330.300.450.621.310.960.891.263.313.473.370.92
FA methyl(14:0)ME9177601.260.830.730.590.730.880.520.831.230.761.031.030.860.610.810.790.870.820.920.951.071.041.461.370.730.790.950.721.160.760.961.201.850.871.421.480.570.930.730.690.670.900.750.860.560.680.920.821.413.533.762.731.03
L-LysineME9179900.970.670.640.350.581.000.310.790.940.681.020.680.730.640.540.791.300.880.991.111.151.491.681.930.740.670.560.751.120.831.121.062.031.381.541.770.400.920.560.320.450.690.690.960.320.720.850.471.582.852.792.901.09
Ile-LysME917806NA0.38NANANA0.49NA0.41NANA0.340.291.49NANA0.48NA0.662.570.80NA0.561.061.83NANA0.360.760.470.511.780.781.660.460.641.09NANA0.34NANA0.91NA2.87NANA0.93NA1.421.332.001.750.59
L-CladinoseME9177590.541.320.74NA0.940.59NA0.260.540.470.470.642.452.483.001.870.701.191.240.830.640.750.850.721.251.911.181.280.580.980.590.690.790.940.760.850.320.380.65NA1.510.910.621.642.041.101.710.941.680.911.220.590.65
S-Adenosyl-L-homocysteineME9179680.290.440.300.270.150.160.200.160.250.170.180.182.332.252.882.291.361.581.251.500.830.910.810.642.312.012.201.761.141.161.211.260.730.500.370.760.220.200.260.201.381.901.672.660.540.830.700.551.371.551.591.521.04
UrocanateME9179720.270.470.260.250.150.170.190.160.230.180.190.172.292.312.742.221.341.521.331.460.800.940.800.642.291.942.181.601.131.111.171.230.750.510.390.730.210.200.280.201.382.011.652.490.520.820.710.531.231.521.541.531.04
His-LeuME917988NA1.150.30NA0.280.340.550.330.310.440.270.322.261.692.702.890.241.383.011.300.531.861.200.651.071.783.011.660.120.981.291.850.140.440.500.490.42NA0.70NA0.640.450.480.82NA0.180.79NA1.050.920.921.330.97
L-AspartateME917880NANANANANANANANANANANANA2.481.242.032.150.230.832.000.980.561.360.520.251.031.312.221.600.450.900.821.360.09NANA0.24NANA0.180.150.360.540.760.82NA0.100.17NA1.211.631.871.740.84
FA hydroxy(18:1)]ME9175890.070.280.130.400.260.130.240.180.310.290.190.273.302.082.833.000.351.793.141.301.171.770.690.381.462.282.802.250.781.981.312.050.270.310.320.290.190.020.250.290.540.620.911.360.520.240.240.123.180.800.901.111.08
CDP-DG(16:0/18:2(9Z,12Z))ME917537NA1.020.141.490.360.190.710.180.340.420.130.253.492.253.653.150.151.494.830.990.482.160.990.310.871.883.371.340.121.311.582.290.120.270.270.240.270.050.420.670.460.280.270.650.900.190.550.071.590.720.760.670.66
SuccinateME917656NA0.610.150.670.17NA0.300.150.240.250.15NA3.881.633.413.260.181.533.230.971.132.370.470.191.052.072.881.800.651.981.472.670.140.340.210.210.130.050.280.390.520.430.581.770.640.180.270.09NA0.790.860.920.71
Formyl-5-hydroxykynurenamineME918024NA0.090.060.220.180.110.190.130.220.220.120.243.711.783.634.010.371.813.141.341.231.670.630.261.652.373.232.500.741.791.392.170.180.220.190.260.170.070.200.180.600.831.121.460.320.180.210.07NA0.870.900.910.86
Glu-Ala-PheME9175670.060.240.120.370.260.180.360.200.330.370.190.323.612.163.683.160.471.743.581.281.221.870.660.311.632.193.292.310.791.811.332.170.290.300.310.340.210.130.270.280.590.550.841.220.540.240.260.15NA0.790.760.860.82
Dihydroclavaminic acidME9177170.18NANANA0.280.540.600.470.520.240.560.472.532.151.141.431.331.614.201.501.191.600.791.190.770.821.390.941.070.891.161.671.030.731.060.910.210.490.300.49NA0.180.310.74NA0.470.460.412.281.321.011.311.07
L-GlutamateME9179150.150.10NANA0.410.510.640.260.310.300.440.132.272.592.181.951.531.474.161.631.182.081.291.071.150.882.951.600.770.921.741.430.930.440.770.670.110.320.330.40NA0.270.550.670.220.280.330.311.511.031.261.090.43
PicolinamideME9180280.200.100.16NA0.410.560.640.280.310.300.470.182.252.572.171.941.521.464.131.761.240.940.971.381.150.882.931.590.860.921.731.420.930.430.770.710.150.320.330.40NA0.310.620.830.220.370.330.311.961.221.111.310.97
sn-glycero-3-Phospho-1-inositolME9175840.130.100.120.040.140.270.150.140.270.160.180.112.412.132.212.042.593.591.541.321.361.101.431.022.301.993.062.060.981.041.141.500.920.500.890.900.170.280.180.170.200.220.200.160.161.510.280.221.241.741.611.741.11
Pyridoxamine phosphateME9179650.140.110.270.100.220.410.230.240.340.230.320.152.101.843.432.772.292.332.212.081.872.261.971.331.420.872.171.381.030.971.251.100.880.400.700.540.120.240.230.130.200.410.550.710.190.400.370.251.281.651.611.681.01
CasimiroedineME9179510.090.070.120.050.120.200.150.120.220.110.180.082.762.453.332.912.783.092.352.002.371.741.841.261.601.292.291.801.010.981.250.910.540.250.440.410.080.110.110.070.260.410.520.410.130.270.220.121.191.591.651.691.05
Val-Pro-ArgME9179490.090.070.120.040.130.180.180.120.190.130.190.072.712.483.343.012.683.102.322.112.401.771.901.191.621.222.261.841.051.011.200.920.530.250.390.440.080.100.110.080.290.360.510.400.130.300.210.111.201.621.581.561.15
N6-(1,2-Dicarboxyethyl)-AMPME9175380.23NA0.47NA0.070.250.300.310.230.150.340.292.492.261.952.391.902.852.161.532.471.902.582.111.110.711.161.200.670.561.190.940.580.310.870.98NA0.150.220.090.170.150.350.32NA0.320.570.371.271.401.511.301.30
HarmanME9179550.280.260.440.130.230.370.330.260.350.220.420.172.061.412.102.242.032.733.132.092.381.912.551.671.250.931.801.300.910.761.471.170.810.400.730.790.180.240.270.150.320.470.650.620.190.400.380.191.151.541.511.571.07
NAD+ME9179540.280.260.440.130.230.360.330.260.350.220.410.172.121.522.412.222.012.713.102.072.361.902.531.651.240.921.791.290.900.761.461.160.810.390.730.790.180.240.270.150.310.470.640.620.190.400.380.191.201.531.481.431.06
Pyrimidine nucleosideME9177180.190.570.22NA0.710.771.580.500.600.720.460.332.432.452.451.920.621.872.791.240.801.721.180.811.511.131.750.750.721.561.872.590.330.340.660.580.550.360.600.940.370.410.680.781.110.190.600.20NA0.800.970.870.86
FA methyl(12:0) dodecanoic acidME9177470.180.440.320.730.480.581.230.480.540.810.370.602.712.771.911.550.591.223.171.070.632.430.880.940.741.111.690.720.491.291.441.770.730.660.730.720.360.300.701.120.240.390.341.482.230.380.890.301.830.950.851.000.97
N6-(L-1,3-Dicarboxypropyl)-L-lysineME918019NA0.42NANA0.600.431.420.510.930.330.371.080.992.701.131.640.341.102.941.020.641.860.820.60NA1.071.880.420.511.351.682.130.910.910.860.89NANANA0.660.52NANA1.312.090.581.330.230.830.360.360.380.87
4-Hydroxyhexan-3-oneME9177630.361.100.542.411.011.130.840.710.771.250.631.571.981.850.911.570.551.242.480.810.701.840.870.530.611.291.560.870.631.131.621.091.000.920.640.830.740.540.911.550.550.310.502.133.160.670.880.591.800.970.910.930.44
indole-3-acetyl-valineME9178380.070.450.111.700.750.611.260.580.670.900.852.381.441.881.531.240.410.832.020.680.281.091.171.100.441.061.930.780.340.830.981.281.021.510.951.040.120.190.290.980.890.490.101.633.510.802.481.071.340.650.740.670.89
L-TryptophanME9179530.181.030.422.790.450.330.580.330.380.490.230.391.801.922.641.460.361.792.620.880.431.810.860.371.311.512.511.350.461.451.891.820.980.660.480.670.410.230.651.140.710.550.511.441.280.551.230.460.081.111.091.060.88
D-GlucosamineME9180230.320.810.371.250.430.461.180.550.680.750.360.842.672.072.592.350.280.891.950.600.281.100.550.471.011.483.421.260.370.730.852.050.380.490.420.520.450.350.991.570.430.420.553.541.050.160.780.121.740.951.120.961.03
GMPME9178950.420.550.380.590.530.651.180.660.620.730.390.712.691.942.082.250.500.992.711.040.531.620.870.621.091.252.551.340.440.771.131.890.420.600.460.660.560.370.851.400.750.440.602.101.130.330.930.301.680.951.030.870.91
L-2-Aminoadipate 6-semialdehydeME918022NA0.850.182.450.920.511.230.630.840.630.401.151.972.532.142.140.220.922.310.910.231.080.610.600.301.641.780.930.290.941.111.610.550.680.450.440.190.190.542.001.050.550.202.752.330.591.670.331.040.630.550.620.61
SulfateME9178040.120.940.361.771.240.840.980.881.310.650.691.331.261.811.151.410.470.781.431.080.380.830.860.780.431.672.031.220.551.061.391.770.630.880.570.600.330.380.761.611.430.930.353.161.540.901.540.830.630.860.930.880.76
Epsilon-(gamma-Glutamyl)-lysineME9179860.101.000.271.441.150.731.330.791.010.600.611.262.061.862.041.770.321.072.041.030.280.920.790.660.411.591.931.230.391.031.301.600.520.700.510.550.290.290.721.751.260.790.282.551.290.841.570.641.140.630.660.680.74
nicotinamide guanine dinucleotideME9178300.101.020.400.931.260.861.240.981.160.810.731.291.341.471.671.820.451.081.281.240.370.800.830.810.561.621.641.200.541.341.491.340.670.850.700.730.430.380.731.561.320.950.421.991.400.991.520.741.170.720.690.700.69
2S-hydroxy-butanoic acidME9177531.340.671.290.841.070.951.411.471.000.870.710.780.410.860.991.280.941.421.121.021.590.440.880.880.831.281.001.191.111.191.221.100.500.881.020.801.171.080.710.910.850.700.991.151.301.150.711.27NANANANA0.65
[FA (11:0)] undecanoic acidME9177440.870.591.240.761.100.781.781.680.990.910.720.760.431.081.251.780.621.641.381.021.440.390.910.850.681.470.831.410.821.181.361.180.310.871.060.691.070.740.691.170.710.500.871.271.411.100.681.36NANANANA0.60
alpha-D-Galactosyl-N-acetyllactosamineME917887NA0.66NANA1.500.822.720.971.772.030.712.130.981.081.040.990.131.541.750.640.781.801.190.530.460.951.020.500.271.071.111.510.500.840.560.540.810.281.221.690.560.250.300.742.270.421.210.311.06NANANA0.78
6-Phospho-D-gluconateME917549NA0.400.13NA1.190.751.150.660.881.590.871.650.651.891.451.410.371.321.390.710.450.951.020.721.391.201.890.780.391.191.111.380.650.920.700.760.730.261.001.170.950.750.540.751.430.681.500.562.131.341.041.230.97
AcetophenazineME917598NA0.410.19NA0.730.721.580.440.670.981.001.781.143.081.331.560.781.221.760.760.240.631.061.050.841.291.580.590.480.921.221.181.080.871.190.820.250.190.751.690.410.560.151.121.800.791.621.331.390.970.980.920.87
N2-Succinyl-L-ornithineME9177080.521.170.67NA0.920.851.580.811.191.760.811.532.031.941.690.730.411.201.600.510.481.370.760.590.821.400.770.620.440.820.941.270.860.840.770.770.720.751.011.830.570.640.651.020.960.551.510.731.541.000.921.131.05
Pyridoxal phosphateME9178470.690.360.45NA0.861.011.600.600.791.220.971.280.911.872.351.220.801.271.010.690.851.231.160.980.961.110.690.871.060.780.951.781.551.031.271.460.570.630.780.580.530.570.240.740.960.611.461.051.920.950.920.960.82
p-Menthane-3,8-diolME9176920.320.750.520.911.220.971.631.311.112.041.411.840.980.560.681.160.350.851.160.690.771.530.750.911.000.821.430.960.681.271.491.370.921.261.131.220.660.571.111.710.770.590.581.350.741.180.931.100.240.850.800.970.86
[PS(18:1)] 1-(9Z-octadecenoyl)-sn-glycero-3-phosphoserineME9175360.190.990.611.371.171.151.100.750.761.631.061.66NA1.890.981.400.581.040.780.950.240.481.130.831.751.111.521.000.370.820.791.240.941.091.010.890.860.451.061.271.060.960.550.830.950.701.420.890.731.231.501.151.11
Ala-SerME9178110.861.040.98NA1.111.100.420.861.411.431.181.350.46NANA0.780.970.78NA0.750.730.900.951.011.25NA1.230.650.581.030.740.811.191.531.581.060.820.850.730.531.180.760.770.76NA1.211.581.47NA1.281.071.081.17
Glutathione disulfideME9175740.040.140.100.281.441.450.840.800.871.741.742.030.441.510.660.690.901.050.680.790.430.681.551.422.241.000.800.520.330.930.770.801.511.561.401.380.770.400.680.701.001.150.540.750.981.182.131.450.811.311.251.271.12
PA(34:2)ME917541NA0.400.19NA1.241.450.580.691.071.501.681.90NA2.08NANA0.791.23NA0.610.560.631.521.331.550.55NA0.350.240.460.59NA0.981.361.331.270.600.220.670.600.570.590.51NA1.731.032.431.251.621.090.920.951.09
2-IsopropylmaleateME9177270.17NANANA0.761.220.360.871.610.950.971.130.570.290.290.380.820.40NA0.480.990.981.071.520.470.300.340.470.910.800.980.612.472.241.402.410.640.690.290.250.250.440.310.280.982.561.671.561.912.122.052.411.37
L-beta-aspartyl-L-threonineME9176320.940.710.850.440.801.080.630.870.931.181.540.820.420.630.680.560.781.040.971.261.421.541.691.710.630.790.720.681.351.291.701.081.882.712.611.860.470.770.590.490.380.700.780.660.611.881.671.670.651.311.441.251.03
N-AcetylmethionineME9176670.680.660.870.310.611.270.720.660.701.281.780.600.420.840.950.410.600.981.111.201.302.012.141.450.520.960.870.541.081.492.310.871.533.302.631.540.350.660.660.340.290.790.860.510.412.112.031.210.421.441.951.260.85
4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehydeME9176070.860.560.60NA1.070.870.340.780.77NA1.050.541.201.231.321.291.041.211.121.120.760.541.201.151.621.311.911.321.011.001.661.521.220.950.780.840.601.210.59NA0.330.700.701.15NA0.270.49NA3.380.08NANA0.70
Acetyl-CoAME9175760.870.270.69NA0.710.86NA0.970.61NA1.010.231.160.891.001.351.420.831.311.511.300.461.302.041.791.181.312.351.870.951.550.901.071.091.031.030.351.280.56NANA0.730.811.19NA0.270.59NA0.860.09NA0.151.20
Arg-Thr-Gln-TyrME9176490.830.380.700.310.740.830.700.980.690.601.360.660.720.651.681.901.381.341.701.702.082.101.511.191.311.541.591.520.801.270.831.951.380.871.790.880.661.180.720.570.761.231.701.140.671.090.891.020.570.640.650.660.80
GDPME9178850.47NA0.30NA0.420.74NA0.781.010.330.710.300.871.271.291.201.552.001.751.792.021.031.581.660.891.081.211.161.341.341.971.521.391.031.170.98NA0.420.28NANA0.770.780.70NA0.820.650.341.930.190.200.090.68
Dihydronaringenin-O-sulphateME9175330.590.390.42NA0.500.710.500.481.000.830.820.520.810.900.971.092.021.751.731.601.911.311.421.501.250.980.601.001.531.401.761.431.591.081.371.03NA0.900.240.22NA0.290.670.670.591.060.760.371.77NANANA0.65
Leucyl-HydroxyprolineME9178840.590.420.500.140.621.080.250.900.790.570.700.400.900.631.131.112.101.911.781.442.101.181.501.421.361.101.001.151.601.581.751.201.521.030.781.020.480.780.35NA0.610.620.761.030.611.210.690.671.04NANANA0.84
Glu-Ile-ThrME9176880.530.410.470.380.571.160.670.460.410.460.810.481.341.291.781.842.282.522.322.141.721.041.531.571.611.011.811.591.791.452.062.251.040.491.070.990.490.860.370.310.330.420.931.070.460.710.480.490.450.420.200.340.86
phe-FMDPME9176530.42NA0.26NA0.690.800.590.530.770.380.670.530.520.901.061.762.062.142.121.982.290.891.711.731.050.871.341.401.241.571.091.250.801.021.680.94NA0.350.52NANA0.430.320.490.471.240.610.540.28NANANA0.71
UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6- diaminopimelateME9178760.610.330.30NA0.770.710.690.460.910.610.680.351.091.311.151.451.952.642.061.652.241.241.601.101.311.001.080.991.701.521.691.611.170.841.090.720.450.570.34NA0.370.420.680.470.680.870.480.42NANANANA0.63
Phe-GlyME9178320.630.190.31NA0.750.910.850.801.020.710.750.450.841.181.411.471.721.742.081.841.961.731.901.900.980.961.241.031.361.712.301.731.400.991.621.400.230.600.410.200.210.440.690.670.730.800.740.580.190.240.230.190.99
Succinyl-CoAME9175630.15NA0.16NA0.550.580.660.670.730.720.740.421.601.321.361.351.741.652.691.541.571.551.571.081.050.821.341.031.050.981.811.860.990.961.181.12NA0.690.45NA0.490.380.720.630.610.640.720.38NANANANA0.69
IAA-94ME9178430.180.410.20NA1.271.170.781.041.220.920.741.041.081.361.041.841.011.882.831.560.551.430.960.850.291.370.780.740.661.631.611.740.871.301.160.910.280.590.841.510.570.620.21NA0.740.921.221.021.260.950.921.000.90
Polypropylene glycol (m w 1,200-3,000)ME9176830.40NA0.29NA0.680.63NA0.270.860.740.710.930.881.451.361.401.561.502.411.320.931.791.271.220.711.090.870.640.791.490.991.351.211.371.231.000.270.480.560.52NA0.260.22NA1.961.251.430.721.570.770.880.870.92
Ile-Gly-MetME9178440.310.75NANA1.321.091.040.780.800.700.760.591.180.871.171.151.761.931.191.511.201.841.160.751.481.061.531.191.161.180.941.471.050.941.050.900.84NA0.690.53NA0.570.600.54NA1.170.850.28NA0.971.370.780.86
N-Acetyl-D-glucosamine 6-phosphateME9176840.500.360.280.291.091.460.731.121.631.091.211.140.900.660.711.032.191.941.091.351.861.741.051.011.260.971.411.241.141.711.261.291.201.180.881.030.780.540.480.590.300.400.410.600.691.571.980.542.131.321.091.191.13
D-Glucose 6-phosphateME9176350.230.200.581.610.680.720.921.220.180.540.631.250.980.781.942.461.061.421.971.790.981.101.521.740.810.872.171.960.660.971.421.450.620.580.951.510.230.570.961.330.240.420.821.220.280.640.851.061.881.121.211.761.92
1-O-Methyl-myo-inositolME9178241.111.610.831.701.141.360.880.830.511.270.751.551.251.270.930.800.650.651.310.880.441.710.850.610.921.65NA1.001.051.151.680.931.171.220.790.890.810.710.570.860.660.760.62NA2.040.950.690.902.121.161.091.161.24
Tetradecanoic acidME9176612.791.321.720.940.371.020.320.810.430.341.020.570.900.410.520.741.630.640.730.961.200.540.992.650.970.900.662.061.280.400.540.511.220.430.530.910.571.840.770.430.771.511.872.960.280.310.390.400.801.521.651.591.37
Tryptophyl-ProlineME9179812.861.121.630.660.440.940.360.710.590.370.860.430.890.470.510.661.570.730.890.891.080.750.961.591.201.030.691.441.300.640.840.561.040.610.751.120.451.560.570.290.771.321.683.110.360.450.410.492.731.361.291.551.42
PG(33:1)ME9175862.831.141.260.710.750.87NA0.750.580.400.980.650.560.410.540.841.260.260.250.840.890.410.981.791.781.141.011.651.320.770.660.671.140.730.871.090.491.500.640.340.751.261.352.56NA0.430.510.342.171.551.651.601.07
2-Amino-5-phosphopentanoic acidME9180213.021.651.500.690.610.800.250.860.700.440.910.640.700.300.530.791.290.670.390.791.010.420.761.591.270.981.031.680.940.650.690.701.110.620.740.960.661.640.800.450.811.491.742.24NA0.240.560.252.611.501.701.700.97
L-Methionine S-oxideME9180202.931.351.630.900.550.880.290.870.500.320.970.550.770.410.480.791.340.510.740.871.120.510.881.611.141.100.821.601.200.520.650.451.230.650.500.960.551.610.730.351.021.701.912.630.250.340.480.302.311.631.581.641.36
PE(32:1)ME9180092.111.291.201.020.420.900.480.840.940.560.970.731.450.851.251.541.000.610.990.820.760.660.841.211.521.431.951.980.940.500.791.011.130.850.631.060.601.440.980.860.821.091.231.710.510.270.630.362.141.021.100.991.01
butyrylcholineME9179612.471.431.380.880.530.770.640.640.720.510.830.491.411.161.080.751.081.311.460.870.930.981.231.070.990.941.611.330.990.550.830.861.030.490.680.970.481.330.650.610.841.101.462.030.460.450.430.442.551.161.101.160.85
InosineME9179312.851.741.621.380.850.810.400.700.760.480.850.561.361.081.041.211.000.691.390.990.800.711.131.111.331.091.411.580.920.840.860.961.150.780.720.850.511.190.800.700.600.931.041.660.680.400.520.302.881.000.970.960.84
4-[N-γ-L-glutamyl-)-p-(β-aminoethyl)phenoxy-methyl]-2-(aminomethyl)furanME9177051.670.900.960.510.530.830.440.670.670.500.970.551.230.791.611.491.620.991.181.661.140.871.481.401.961.321.901.980.990.951.231.021.030.710.670.970.571.050.810.480.770.901.071.180.310.540.690.451.060.920.940.960.94
D-Glucono-1,5-lactone 6-phosphateME9175721.750.720.800.420.591.090.260.710.850.440.880.451.040.610.741.091.580.690.611.281.120.821.361.331.420.981.091.481.070.660.990.751.570.680.951.310.411.150.840.370.591.091.041.60NA0.450.450.602.461.671.931.931.22
FA oxo(12:1)ME9177361.911.011.060.550.660.860.300.790.640.381.010.530.660.611.010.971.330.821.181.161.080.761.081.681.251.181.301.501.070.811.091.011.421.090.941.220.511.100.750.410.791.011.081.450.420.640.800.392.871.511.661.671.01
BetaineME9179971.610.711.010.420.590.940.290.880.710.380.920.520.850.730.751.101.600.881.211.541.160.761.232.021.290.960.971.551.440.851.190.841.510.931.071.180.541.310.580.440.560.950.952.130.430.510.560.651.971.481.391.461.45
UDP-N-acetyl-D-galactosamineME9178582.570.971.060.600.490.800.420.940.550.250.990.500.730.590.751.031.380.830.991.371.120.791.131.891.030.830.871.321.220.861.070.981.440.751.040.990.601.380.700.330.921.411.552.070.210.490.570.402.541.131.221.360.99
Leu-TyrME9176441.981.231.360.840.580.870.260.850.800.511.000.600.700.540.731.091.450.820.761.131.230.701.061.861.251.111.081.501.170.730.830.891.260.880.871.280.541.240.710.420.901.371.561.580.300.710.590.421.811.331.281.441.01
L-MethionineME9179742.021.181.180.530.630.970.240.760.910.401.080.490.820.620.591.311.530.650.851.001.140.681.171.831.171.121.031.591.160.700.960.811.361.020.801.380.461.370.670.390.891.361.402.140.370.540.590.402.581.201.271.421.25
Cysteinyl-ProlineME9178232.350.780.460.840.530.67NA0.770.480.280.700.671.531.070.841.211.161.030.971.321.111.131.281.831.110.911.021.351.441.161.161.071.060.811.021.240.360.860.580.240.560.811.151.64NA0.430.720.331.621.281.661.460.93
FA oxo(7:0)ME9176691.460.870.980.490.580.91NA0.640.640.320.650.520.930.621.141.121.831.001.291.640.950.621.251.351.480.971.521.931.260.880.920.881.500.730.680.97NA1.090.590.390.670.970.891.25NA0.300.600.511.071.681.731.651.04
(R)-2-HydroxyglutarateME9176931.460.730.880.460.720.960.540.920.900.591.000.650.880.861.071.301.031.051.001.100.820.701.021.391.431.221.711.711.000.680.951.121.331.050.841.220.571.160.780.550.630.720.871.080.270.510.690.491.491.911.931.991.07
L-ValineME9177501.620.951.010.470.720.920.440.770.850.601.020.621.080.981.251.311.140.870.971.380.840.751.291.241.391.111.621.510.980.660.980.781.091.020.911.030.591.050.790.520.650.880.951.420.420.520.740.491.391.901.701.811.02
4-Amino-2-methyl-5-phosphomethylpyrimidineME9178421.610.980.860.750.680.750.580.700.710.520.850.631.110.991.161.421.300.851.151.361.000.651.221.481.541.231.551.591.070.581.320.811.100.780.711.000.461.080.740.490.690.970.941.320.290.520.710.291.331.851.861.851.03
FA methyl(16:1)ME9177511.600.850.870.550.690.850.390.740.710.470.990.521.030.721.051.241.391.151.071.211.010.701.271.411.461.241.381.531.000.781.050.991.160.860.721.120.521.090.700.320.750.911.091.430.270.590.710.471.482.011.901.931.05
N-arachidonoyl alanineME9178541.441.130.880.470.530.940.360.780.810.530.930.581.180.780.881.041.461.111.071.311.441.071.351.521.430.911.421.451.130.981.190.921.660.980.871.270.521.130.690.470.720.810.901.430.460.550.600.510.891.541.531.311.17
P-DPDME9177521.850.920.820.600.621.080.420.790.860.440.790.541.030.730.731.321.491.060.961.071.210.921.521.701.330.891.031.361.180.780.930.941.210.760.721.230.341.200.660.400.680.851.131.58NA0.550.540.351.012.041.861.851.11
5-HydroxypentanoateME9176641.441.391.230.650.921.441.121.241.390.950.770.621.331.201.220.731.221.392.191.451.291.431.050.950.950.740.810.881.051.431.381.230.891.331.170.710.680.660.650.840.580.610.571.600.871.121.200.482.571.170.970.991.10
Phe-ThrME9176962.560.671.870.670.861.450.661.781.280.930.910.540.710.590.850.471.941.041.251.941.600.941.040.710.960.740.610.951.641.411.420.981.241.511.350.880.650.700.570.480.530.540.751.450.781.161.150.851.981.231.121.230.77
FA methyl(15:0) tridecanedioic acidME9177841.600.641.051.380.721.040.811.111.070.760.670.990.630.640.630.470.940.901.131.181.611.861.591.321.180.991.141.170.911.021.500.801.741.171.050.770.820.980.830.660.750.880.831.462.470.930.820.980.551.911.551.351.51
Cyclo(deltaAla-L-Val)ME9180291.621.061.010.650.721.160.361.081.170.951.301.010.590.450.340.721.000.600.740.800.910.961.371.810.910.900.570.941.040.761.080.972.421.901.612.020.581.330.820.520.670.930.951.770.640.901.320.692.142.141.901.941.21
PE(32:2)ME9178141.621.071.020.650.721.160.361.081.300.951.401.020.590.430.320.721.000.590.830.850.911.031.411.730.970.950.660.961.120.761.071.022.431.901.612.020.581.330.820.520.680.930.951.500.640.901.320.701.402.152.142.081.11
3-PropylmalateME9176891.740.901.290.600.680.970.590.960.880.761.260.720.670.740.660.681.740.630.691.100.980.861.031.331.150.580.680.811.440.740.940.811.670.951.061.550.961.450.800.641.031.301.180.860.571.100.851.371.731.571.822.381.06
CDPME9178931.180.800.810.370.781.090.380.690.900.721.220.671.030.700.990.811.740.960.681.401.441.171.311.491.540.970.861.121.801.111.100.861.861.231.281.480.741.160.570.370.991.221.200.800.341.180.960.851.402.062.082.101.25
[FA trihydroxy(4:0)] 2,3,4-trihydroxy-butanoic acidME9176450.760.620.750.560.641.331.740.751.000.760.710.681.401.641.070.691.011.580.900.891.410.981.501.161.100.691.001.061.581.381.400.700.820.900.701.920.710.780.670.860.640.720.720.640.680.941.030.601.141.361.391.431.44
AdenylylselenateME9176370.780.570.920.490.551.371.700.921.240.640.660.581.261.690.820.561.001.500.800.891.580.741.721.251.190.841.101.111.701.371.290.570.830.870.611.640.720.910.590.890.750.510.580.570.541.031.170.591.101.811.701.711.66
N-Acetyl-L-leucineME9176240.800.590.940.500.571.401.740.941.270.630.670.591.281.730.890.571.021.530.810.911.610.751.631.181.180.861.041.161.741.401.220.580.850.820.631.680.740.930.590.910.710.580.640.350.561.051.160.601.251.741.741.501.61
PG(16:1(9Z)/16:1(9Z))ME9177391.080.760.860.710.730.950.830.960.920.990.950.830.870.820.860.941.300.930.791.120.981.110.961.171.060.730.880.891.300.841.061.171.180.900.751.200.890.870.820.861.050.990.861.000.720.930.810.821.622.212.282.390.94
H2S2O3ME9176210.820.870.890.800.820.930.950.990.690.900.920.801.111.391.010.881.051.350.941.031.730.851.030.900.800.871.001.130.851.010.990.870.850.950.910.910.820.860.860.940.790.840.940.870.770.971.030.881.471.711.691.761.45
PI(32:3)ME9178450.810.730.900.660.761.061.470.891.080.810.850.721.151.550.950.670.891.230.790.851.360.941.190.890.980.910.930.861.271.020.980.690.790.890.721.220.820.890.830.950.870.810.830.660.690.931.000.751.571.962.061.991.46
4-Dodecylbenzenesulfonic AcidME9176080.780.680.870.580.750.990.920.630.730.811.000.601.451.401.020.892.602.330.991.572.111.151.381.010.960.961.070.601.401.291.690.810.941.040.950.820.600.970.910.600.550.900.970.680.560.940.980.591.101.391.521.240.90
FA (12:1) Decenedioic acidME9176090.740.730.920.620.801.050.980.650.710.861.070.640.901.061.090.782.072.371.061.541.721.231.471.070.981.031.180.781.131.201.680.861.011.121.010.880.640.900.970.650.580.881.030.730.601.001.050.630.901.491.621.320.96
5-exo-Hydroxy-1,2-campholideME9179360.480.350.480.170.630.790.770.660.810.600.690.521.451.661.591.571.942.091.181.492.391.211.791.291.551.201.461.411.501.311.350.931.000.890.841.150.540.710.590.500.650.670.710.660.330.990.740.811.451.691.671.611.49
Ile-Ala-ThrME9175690.870.440.830.360.521.311.180.910.990.570.480.481.601.700.920.742.182.550.911.391.580.831.371.371.770.971.131.361.511.481.580.650.820.850.601.390.610.870.570.950.630.550.670.570.411.050.850.571.401.551.541.771.63
1,8-Diazacyclotetradecane-2,9-dioneME9176860.870.400.790.350.471.291.170.801.100.470.490.491.571.680.900.801.932.470.811.371.930.751.511.341.621.081.141.391.631.561.730.630.710.840.591.520.690.950.571.010.670.560.600.570.370.920.940.581.361.621.661.701.76
3-Hydroxy-carbofuranME9176940.840.390.750.320.461.281.190.791.090.500.480.451.901.690.970.742.062.550.891.471.880.771.411.361.681.011.121.291.501.571.800.630.820.890.541.420.710.980.541.010.770.510.640.550.390.980.860.531.491.521.561.631.62
FumarateME9178640.600.470.650.460.580.821.611.250.700.831.301.060.820.751.541.141.151.291.471.551.311.401.741.510.770.591.091.101.201.062.141.521.080.851.201.290.580.530.740.620.610.491.540.820.370.870.931.381.161.371.271.291.05
UrsodiolME9177931.291.551.221.101.031.731.041.151.551.390.990.790.870.971.141.131.281.501.301.621.291.491.271.050.940.790.910.941.161.471.611.581.391.781.490.920.660.780.660.530.600.710.671.170.581.261.290.780.840.370.361.080.47
(S)-MalateME9176181.700.741.380.720.500.960.970.760.541.260.810.861.440.730.700.511.030.550.701.111.031.200.821.010.990.550.440.941.351.441.080.680.931.021.031.101.161.530.761.240.891.111.291.030.631.051.021.602.320.911.231.261.19
2-(Acetamidomethylene)succinateME9177831.581.261.320.821.201.401.151.051.720.961.251.130.770.510.490.820.791.360.800.750.680.860.870.690.540.630.750.620.510.530.710.511.311.241.061.180.651.030.710.780.820.930.981.670.811.401.411.041.581.471.431.411.04
Ala-Asp-Asp-GlnME9178411.651.251.100.840.961.020.490.971.430.941.060.720.690.430.370.831.491.150.520.861.191.291.151.001.201.060.710.480.981.011.031.071.951.731.231.610.521.440.670.791.010.890.831.191.061.401.171.241.330.830.900.911.14
D-GlucoseME9176801.751.661.391.100.850.970.680.941.181.121.101.040.720.660.660.791.030.920.820.941.031.111.361.390.970.840.750.831.150.891.090.971.511.371.251.530.771.190.810.670.910.820.821.150.721.161.281.161.251.381.291.211.13
PG(32:1)ME9176761.741.611.411.110.871.030.681.011.231.171.151.020.750.660.660.791.100.760.821.021.071.021.481.290.830.890.750.831.150.891.120.971.521.391.291.540.771.200.820.730.910.820.821.150.761.161.291.171.191.251.151.161.12
dAMPME9179780.990.530.710.310.731.170.600.931.120.721.130.740.840.860.950.991.391.161.311.521.081.201.281.391.290.931.101.131.651.491.771.631.751.251.381.400.541.050.770.400.560.640.740.800.551.080.940.771.130.450.420.711.02
GentisinME9177230.960.630.690.330.851.190.640.831.090.791.090.790.961.021.011.031.141.071.231.471.020.941.281.371.210.931.131.231.541.461.711.581.571.221.401.420.611.020.750.390.550.690.720.780.650.971.000.681.230.650.710.681.10
cis-AconitateME9176660.860.600.680.961.131.250.811.221.060.980.980.840.750.820.740.801.261.051.131.441.121.171.411.391.040.620.630.741.271.181.261.141.421.171.501.350.610.940.770.610.380.520.651.240.791.290.870.881.151.261.051.111.12
2-oxobut-3-enanoateME9177580.490.430.460.500.901.241.081.091.140.631.130.691.080.941.000.901.661.061.031.201.401.061.111.051.111.011.171.011.181.131.341.221.711.121.431.480.870.890.730.670.650.740.831.140.720.850.860.971.451.061.031.121.23
2-OxoglutaramateME9177870.490.390.500.470.961.231.150.940.960.631.000.740.800.940.960.871.451.080.961.261.220.911.201.111.221.121.341.051.331.151.381.051.551.071.331.440.770.830.880.660.680.760.930.930.720.930.880.931.321.041.101.071.32
2-OxobutanoateME9179950.790.950.781.681.030.841.100.811.101.140.801.351.451.441.111.190.770.971.590.820.751.320.951.020.811.031.250.950.750.991.171.280.750.950.930.950.770.721.091.480.870.860.771.201.660.791.100.901.241.091.311.151.18
N-AcetylneuraminateME9177690.911.041.031.851.121.020.941.051.030.910.961.020.750.811.011.021.020.870.811.111.031.001.150.811.220.890.781.091.090.981.101.010.940.920.950.941.170.990.990.961.101.061.060.952.051.071.010.900.741.100.951.000.93
MannitolME9178261.260.590.900.720.821.180.740.890.810.911.091.001.020.830.810.911.560.891.101.300.790.981.261.671.070.670.781.201.231.011.040.721.461.081.391.321.001.051.000.790.871.061.050.91NA0.971.020.800.491.371.641.731.17
Asp-Asp-Asp-ProME9178370.900.841.060.711.081.301.390.891.080.791.040.881.141.190.671.101.061.320.830.951.030.931.250.701.060.831.141.141.010.940.501.160.731.270.700.941.070.930.841.130.911.090.970.990.690.911.150.922.100.940.930.930.98
FA hydroxy (18:2)ME9178020.541.110.870.691.081.071.021.081.401.340.811.030.920.920.940.841.041.350.901.231.191.041.021.401.241.141.071.290.951.111.191.151.301.430.891.250.510.511.060.801.371.031.000.881.111.101.020.990.431.381.001.501.08
(1S,3R,4S)-3,4-Dihydroxycyclohexane-1-carboxylateME9176911.240.870.971.140.871.130.791.120.661.111.331.140.730.861.050.710.970.951.071.221.020.781.021.201.201.000.821.051.430.880.750.901.640.971.111.140.791.350.870.830.771.121.050.950.791.410.951.182.161.371.291.110.93
Lithocholate3-O-glucuronideME9178561.281.020.920.940.990.971.001.200.861.020.870.910.801.081.120.941.081.051.040.841.140.941.021.071.240.820.910.961.021.100.920.891.000.880.981.180.931.120.980.840.991.010.951.270.700.971.061.051.790.950.990.971.11
PG(34:1)ME9176411.100.950.950.930.921.320.720.950.920.931.040.950.810.790.860.740.970.951.020.960.881.210.941.160.940.840.790.691.121.090.980.901.371.151.131.160.950.990.900.870.730.820.661.650.651.161.131.121.391.241.201.261.13
(S)-2-Aceto-2-hydroxybutanoateME9177141.291.041.060.761.050.970.850.950.501.250.791.241.071.181.181.100.991.590.880.981.060.991.201.250.960.981.110.850.871.090.961.291.011.261.081.181.220.891.121.571.151.001.150.860.551.131.380.930.811.221.301.401.03
BicozamycinME9180000.980.730.820.720.910.830.820.811.040.890.980.900.640.780.820.750.800.700.761.030.900.850.880.820.820.790.900.870.800.800.790.680.960.950.880.821.040.740.840.670.820.890.790.750.760.790.960.970.841.421.321.330.85
ClodronateME9177190.841.210.821.221.281.041.180.930.971.051.010.800.820.971.000.861.101.181.031.271.150.950.760.851.200.871.050.980.991.061.090.950.891.031.070.831.060.911.061.051.031.321.021.001.001.370.981.150.621.011.081.120.83
Cyclic ADP-riboseME9178290.961.091.030.561.201.120.821.181.100.991.011.140.731.001.181.000.860.980.990.991.081.011.020.871.021.100.991.060.931.121.100.961.031.041.111.021.191.111.051.111.321.081.181.010.431.111.011.060.651.271.461.241.01
Gentisate aldehydeME9177090.931.150.950.831.091.091.021.071.081.161.081.111.081.081.111.150.961.040.951.100.991.211.051.061.091.071.141.020.991.081.011.131.091.061.081.111.051.071.091.071.061.051.001.030.671.071.101.091.171.461.391.431.17
FA (18:2)ME9176650.850.930.980.811.161.251.010.971.261.280.960.961.020.881.120.850.991.021.031.220.961.130.871.000.861.081.030.920.961.140.890.920.871.061.100.761.001.021.000.921.010.831.041.020.831.041.021.120.870.991.061.071.23
(Ac)2-L-Lys-D-AlaME9179941.010.950.931.320.940.960.911.050.890.970.920.980.960.920.880.970.850.831.130.960.920.950.940.920.920.981.060.870.840.930.990.890.951.050.921.140.940.990.900.981.020.921.111.120.910.830.991.020.861.391.311.231.02
PyrophosphateME9178630.920.900.961.081.130.950.901.070.890.891.060.860.910.950.960.890.971.061.091.110.870.870.960.960.990.930.971.040.931.021.030.890.911.051.280.871.141.100.960.850.951.081.111.021.141.051.090.961.021.221.091.121.04
PyruvateME9178051.090.980.970.851.060.981.061.011.100.941.011.061.031.011.021.031.090.991.090.980.961.020.910.961.060.990.971.071.031.031.010.970.950.971.070.991.031.051.051.111.140.991.010.970.911.121.031.061.091.061.171.010.99
LactoseME9176190.910.720.930.710.781.241.320.950.940.920.820.811.191.181.090.871.221.300.961.051.230.971.181.231.191.061.120.961.231.171.150.861.060.920.821.330.830.990.780.990.860.790.820.830.801.011.150.800.951.081.081.091.07
beta-Alanyl-L-lysineME9176820.981.051.250.960.961.111.130.970.851.061.160.970.901.081.120.910.861.061.010.960.931.071.040.920.881.111.080.930.931.101.100.920.911.131.030.930.981.031.100.950.841.111.140.960.851.111.140.990.491.061.201.020.96
TrimetaphosphateME9176620.791.061.240.800.891.101.210.790.691.161.260.810.911.191.370.840.771.111.140.950.911.211.180.880.761.151.410.790.941.151.300.930.891.271.130.860.831.021.090.850.711.181.300.790.771.181.300.810.591.091.291.020.81
(S)-2-AcetolactateME9177310.880.871.010.650.971.121.100.790.821.001.120.761.011.141.321.001.091.241.261.071.171.301.231.100.911.071.230.961.061.251.331.011.071.181.171.060.750.951.020.690.661.021.120.820.751.091.120.810.781.191.311.020.89
(-)-MentholME9176700.920.891.060.780.871.151.140.820.781.040.980.810.991.311.160.871.011.361.041.021.431.191.270.920.861.031.180.901.021.111.210.900.971.060.991.090.800.960.970.790.701.020.990.800.731.071.160.760.841.311.361.331.08
trans-Hexadec-2-enoyl-CoAME9178400.930.891.080.810.931.101.110.910.870.921.040.890.991.151.120.820.911.050.970.941.121.151.190.990.881.011.121.001.050.991.110.850.971.090.921.050.831.001.010.990.890.991.020.810.841.101.220.861.031.241.361.301.04
20-Trihydroxy-leukotriene-B4ME9178521.381.061.210.761.021.000.750.931.260.821.110.910.690.640.820.791.331.240.821.111.230.801.181.041.000.860.800.841.280.910.920.941.191.271.351.181.281.201.040.701.201.181.180.740.601.220.991.070.401.211.221.161.03
FA (14:1) tetradecenoic acidME9178551.360.861.240.550.980.970.720.971.220.791.320.730.670.620.790.761.531.200.791.081.190.781.141.270.900.860.770.981.230.880.930.911.121.061.311.041.021.580.930.681.001.221.140.830.581.180.921.031.211.301.351.281.11
LysoPA(18:2)ME9175401.16NA1.090.841.001.090.871.071.011.061.181.060.810.480.930.941.200.910.841.141.070.901.091.241.080.940.941.021.281.010.980.911.201.051.091.171.091.201.050.871.081.091.131.010.631.091.091.161.081.241.181.231.14
3-(4-Hydroxyphenyl)pyruvateME9177541.150.821.230.830.911.100.901.050.970.991.230.800.840.880.950.661.170.880.921.231.050.981.280.961.010.991.431.121.181.261.110.771.140.871.021.290.961.140.951.101.021.091.091.000.850.961.061.050.981.050.941.231.33
Gamma-GlutamylglutamineME9175431.271.031.190.641.051.140.911.121.051.111.231.110.850.770.970.991.300.970.881.191.040.981.141.351.130.980.991.081.341.051.030.951.261.091.171.291.141.251.080.911.131.171.181.050.771.121.141.221.141.301.231.281.19
2-C-Methyl-D-erythritol 4-phosphateME9175510.280.180.270.060.280.670.280.410.820.280.400.150.450.720.500.491.872.611.231.283.191.912.281.951.020.610.610.801.682.301.901.441.931.301.542.890.120.370.180.120.240.250.300.320.301.190.950.251.401.671.721.651.41
D-Glucosamine 6-phosphateME9175800.09NANANA0.410.790.220.401.050.360.610.320.320.420.300.461.351.310.920.832.301.572.631.901.000.630.520.631.752.151.861.372.701.541.512.380.180.410.250.080.090.220.210.240.461.140.890.371.322.032.132.001.34
Phe-TyrME9175750.09NANANA0.420.880.280.441.050.430.570.230.340.480.320.431.261.430.900.782.141.572.441.790.950.610.570.581.892.242.031.402.731.601.582.380.170.380.240.080.090.200.200.220.441.100.870.391.401.972.171.951.30
Glu-ProME917984NANANANA0.330.510.410.390.650.380.580.331.031.140.611.041.852.321.431.573.491.692.782.030.820.620.910.941.131.311.811.241.230.941.171.630.130.270.140.140.130.080.140.120.280.580.540.381.481.621.581.741.32
2-OxoglutarateME9176290.510.210.280.100.370.710.490.530.730.410.760.481.241.030.721.091.612.491.211.342.942.283.702.710.880.510.920.831.720.971.661.111.861.431.692.730.220.510.320.180.240.250.360.380.260.950.970.521.721.791.731.761.38
2 -(Butylamido)-4-hydroxybutanoic acidME9176360.510.210.280.100.370.710.480.530.890.450.760.501.231.030.721.091.592.131.121.342.872.023.302.690.890.620.970.971.691.131.661.152.041.431.962.670.220.510.320.180.290.280.410.380.260.950.970.511.771.791.731.751.38
FA (18:1)ME9179110.630.270.390.180.440.750.530.560.740.440.730.521.261.010.781.221.572.231.151.272.631.983.452.580.890.550.921.071.611.011.541.041.731.351.752.500.290.580.370.250.390.440.520.490.310.941.010.561.731.701.671.701.35
11-O-Demethylpradinone IME917799NA0.22NA0.210.871.191.180.820.770.360.520.511.821.851.861.791.521.491.791.530.581.160.810.701.571.071.721.190.861.201.171.020.700.610.530.580.910.971.010.690.690.860.891.010.330.800.520.351.151.461.311.261.00
FA oxo(14:1) cyclopentanebutanoic acidME917807NA0.25NANA1.291.111.020.900.780.320.300.301.811.532.011.831.671.791.271.330.621.200.720.781.281.121.761.400.951.180.921.120.710.670.590.580.530.951.120.710.470.690.780.99NA0.840.310.351.271.341.311.340.93
Imidazol-4-ylacetateME9177300.890.14NANA0.541.040.610.660.900.541.200.501.370.891.171.761.580.951.551.701.140.561.351.481.980.971.691.741.070.671.320.751.210.710.471.250.781.290.750.52NA0.460.700.40NA0.410.34NA1.911.301.030.920.84
[PI(16:0)] 1-hexadecanoyl-sn-glycero-3-phospho-(1^-myo-inositol)ME9175710.720.370.38NA0.830.770.580.870.720.580.860.662.291.561.631.751.361.241.901.621.070.860.981.371.561.151.911.800.750.711.001.100.910.710.510.760.561.080.990.86NA0.460.610.600.240.140.530.112.451.471.351.250.47
N-Acetyl-D-mannosaminolactoneME9179370.550.510.580.160.290.270.330.270.250.170.230.130.800.880.951.242.022.031.161.371.310.871.400.921.771.812.381.791.851.701.952.071.110.640.741.080.210.300.300.140.931.471.801.660.220.850.400.461.151.361.461.431.30
N-Acetyl-L-glutamateME9179250.480.510.500.120.230.300.460.290.280.130.210.160.811.130.851.252.022.111.101.361.470.751.400.791.771.642.161.682.091.711.861.720.950.600.591.160.230.280.280.150.801.371.521.500.210.790.380.371.451.811.961.851.42
3,6-Dideoxy-L-galactoseME9179440.420.660.710.290.190.320.320.180.240.140.160.101.411.392.091.882.312.791.711.601.240.961.140.591.641.272.331.701.671.472.051.641.110.510.631.020.080.100.140.070.660.821.120.900.240.980.570.511.211.471.501.531.22
[PG (18:1)] 1-(9E-octadecenoyl)-sn-glycero-3-phospho-(1^-sn-glycerol)ME9179010.460.490.530.250.120.220.400.120.27NA0.13NA1.161.431.741.621.892.411.471.241.320.871.030.521.371.161.901.441.511.351.671.350.990.510.530.94NANANANA0.500.640.850.760.240.840.500.461.221.721.831.841.21
Azelaic acidME917757NANANANA0.380.990.330.900.800.630.710.531.231.150.800.871.611.542.671.251.161.701.280.990.790.670.631.010.881.111.141.801.061.140.951.06NA0.320.240.220.220.530.500.880.451.010.510.704.201.471.581.540.75
N-Succinyl-L-glutamateME9178780.570.280.45NA0.750.810.460.670.770.290.940.320.931.210.851.121.510.972.321.641.571.341.871.511.010.741.190.901.111.321.571.931.501.081.461.250.500.600.19NA0.240.400.490.571.040.830.870.472.821.011.010.890.84
HypoxanthineME9179710.490.310.370.170.570.620.440.470.670.450.750.450.840.641.061.331.681.551.162.061.491.481.851.771.030.851.301.241.361.081.891.671.450.931.321.400.290.530.380.200.290.480.600.670.290.820.700.463.201.791.941.951.22
N2-Succinyl-L-arginineME9179960.410.270.270.150.540.720.570.540.690.560.700.470.990.841.131.461.521.721.561.841.571.841.651.680.920.751.370.991.221.471.801.821.260.871.281.230.280.570.380.320.300.400.270.460.260.730.680.503.011.631.811.840.92
PE(34:1)ME9179930.410.270.270.150.540.720.570.540.690.560.700.470.990.841.141.461.521.721.561.841.571.841.651.680.920.751.370.991.221.471.801.821.260.871.281.230.280.570.380.320.260.400.550.580.290.730.690.503.021.631.811.840.51
Glu-ThrME9179070.490.280.290.250.490.820.350.540.660.440.660.361.080.851.011.171.911.482.001.861.511.531.781.771.040.811.231.191.441.201.761.511.660.971.171.370.290.540.330.210.320.440.560.800.480.740.570.443.471.601.501.551.23
Pro-ArgME9179670.420.310.260.200.550.740.420.570.700.470.650.450.891.041.021.311.621.622.041.681.421.501.701.601.160.570.981.291.111.291.770.881.220.901.181.330.300.500.390.220.350.500.580.570.420.670.680.443.821.871.831.961.08
FA hydroxy(18:1)ME9179420.500.380.360.340.560.840.390.580.640.580.750.451.321.040.861.291.451.041.381.540.741.051.331.491.561.221.951.780.971.051.181.711.080.860.880.960.410.640.660.340.460.741.121.090.210.520.750.572.741.631.731.951.32
PhenylpyruvateME9178661.030.570.650.870.831.060.790.580.880.960.800.841.041.010.840.751.571.091.681.531.321.111.371.670.661.031.081.021.131.031.141.170.971.040.821.330.620.990.640.530.790.820.840.650.670.930.780.772.621.471.731.291.30
3-Methylbutanoic acidME9179350.40NANANANA0.530.380.220.340.280.520.321.541.020.620.722.001.102.312.041.050.751.311.840.850.760.761.081.481.261.090.791.450.550.921.17NA0.500.470.30NA0.480.641.07NA0.580.46NA3.570.681.601.981.25
Ile-AlaME9179090.300.110.220.330.290.830.600.530.290.280.530.281.821.591.611.822.361.272.612.181.681.401.371.471.350.801.851.851.441.101.611.201.060.521.110.990.220.320.350.360.260.380.801.170.240.520.360.424.351.281.311.451.51
alpha-IroneME9177410.560.750.440.630.500.94NA1.030.760.410.720.281.471.190.460.582.011.121.211.271.341.461.692.011.020.990.651.011.800.921.481.041.701.011.141.46NA0.580.30NANA0.640.341.10NA0.910.93NA0.810.911.111.470.87
(S)-ATPAME9178610.940.600.810.26NA0.85NA0.700.950.610.900.510.690.880.960.761.291.181.221.792.431.601.481.640.890.760.680.981.750.931.511.591.521.371.321.29NA0.880.24NANANA0.640.97NA0.720.600.610.890.440.840.730.81
3-EthylmalateME9176430.810.510.680.450.590.750.680.590.770.550.590.611.241.060.880.811.192.111.031.211.911.231.911.621.260.720.970.851.411.242.040.951.250.710.871.460.370.570.490.530.620.671.072.570.520.931.090.641.651.951.861.981.37
ArecolineME9176470.790.600.720.460.570.690.750.570.750.560.580.631.151.120.850.751.161.801.011.061.881.572.111.581.230.720.940.861.371.211.990.931.220.700.881.420.380.550.510.520.610.651.042.510.500.911.060.681.752.231.892.051.33
[FA trimethyl(13:2)] tridecadienoic acidME9179170.430.740.500.320.600.920.670.780.770.730.800.610.871.101.151.050.881.401.581.401.472.561.711.720.600.881.011.021.131.342.131.741.171.051.611.150.420.530.670.520.500.500.411.180.600.621.260.352.940.890.971.041.00
Leu-Pro-ProME9179800.520.670.470.740.550.880.620.830.850.730.700.471.301.481.200.910.911.171.921.421.452.301.981.750.710.860.980.801.301.301.911.551.341.121.481.180.530.530.630.620.360.300.441.181.200.681.100.451.111.031.041.181.24
Gln-Phe-Pro-ProME9179460.300.140.320.100.560.970.680.540.740.500.590.321.281.471.761.272.742.751.561.973.001.932.181.591.311.041.451.041.251.351.600.911.310.850.990.930.360.500.380.270.300.340.410.280.310.910.730.420.910.921.361.201.13
Glu-Ile-SerME9176110.350.26NA0.330.410.370.330.390.350.390.460.361.020.951.591.792.152.202.062.052.372.281.531.601.060.941.691.401.101.081.841.331.120.371.241.050.350.290.670.32NA0.650.470.72NA1.050.740.931.170.810.950.841.13
OrthophosphateME9175390.080.070.15NA0.350.650.820.360.440.210.330.181.332.321.531.111.662.911.411.532.771.052.151.311.270.971.561.341.861.281.901.150.700.500.631.080.210.210.260.200.310.340.510.360.160.480.330.261.552.171.971.921.78
UDP-N-acetyl-2-amino-2-deoxy-D-glucuronateME9175350.090.080.15NA0.360.680.860.370.460.220.340.191.101.811.181.121.733.031.471.592.881.092.241.361.330.881.241.071.941.331.981.200.730.520.651.130.220.220.280.210.320.360.530.380.160.500.340.271.622.262.092.001.85
10,11-dihydro-20-trihydroxy-leukotriene B4ME9179430.440.160.560.120.480.961.020.540.680.340.510.211.782.041.811.552.363.101.961.892.791.252.091.391.521.011.561.080.990.961.590.960.850.530.610.760.270.440.380.190.240.300.350.180.180.410.370.171.241.451.571.501.34
L-PhenylalanineME9179640.340.160.350.110.541.031.040.570.740.390.520.261.431.921.261.302.122.841.401.442.541.361.731.231.501.051.281.031.311.411.931.100.820.680.731.060.300.440.390.280.330.300.360.240.250.600.500.321.341.831.911.641.44
Ala-ProME9179620.170.140.200.080.280.390.270.260.330.240.360.192.321.712.082.142.102.361.981.621.271.421.421.081.511.151.851.431.341.071.531.310.800.470.720.810.180.250.260.160.420.700.790.820.250.540.500.311.262.392.392.480.95
OphthalmicacidME9176140.170.140.250.080.280.390.270.260.340.240.370.192.341.732.102.162.122.382.001.631.281.431.431.091.521.161.861.441.351.071.551.320.810.470.730.820.200.280.270.160.420.700.800.820.250.540.500.311.272.262.282.210.96
8,8-Dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b^]dipyran-4-oneME9180120.270.180.240.170.420.610.600.440.430.370.520.211.311.172.212.292.061.682.411.931.481.591.451.161.380.982.451.841.131.022.051.340.830.461.090.810.240.300.350.230.330.430.850.570.140.420.300.291.791.641.701.711.11
Cys-Cys-Cys-GlyME9179380.160.130.180.070.520.750.610.530.620.370.510.311.391.491.661.532.192.451.651.841.861.521.681.301.601.171.351.291.661.671.621.361.110.680.850.950.280.370.340.230.440.550.680.610.280.860.460.331.181.571.531.491.11
3-sulfopropanoateME9175820.250.160.290.130.420.590.520.490.500.300.510.301.581.431.921.652.251.811.961.912.051.591.871.491.551.121.881.431.491.191.631.460.990.550.870.860.310.450.440.280.480.570.870.580.290.520.520.431.121.421.421.301.03
UTPME9179020.370.260.370.180.370.490.440.370.440.290.420.201.291.291.901.972.122.552.061.891.891.731.741.381.531.211.961.381.471.391.991.651.010.631.020.850.180.250.290.180.450.700.870.780.290.670.520.400.961.131.081.141.01
PantothenateME9179470.700.350.840.280.360.680.620.450.530.320.500.251.831.782.151.991.892.412.091.802.021.121.831.241.521.131.691.370.940.871.290.950.660.500.650.680.280.430.400.270.350.490.590.390.180.450.410.241.331.921.931.811.25
CarphenazineME9175730.500.280.570.220.350.520.400.330.530.330.440.231.711.421.771.571.852.292.141.662.141.782.221.511.430.951.381.121.131.041.671.380.830.480.700.930.160.240.220.130.390.560.740.560.260.770.530.321.251.962.022.031.08
S-Adenosyl-L-methionineME9175770.480.280.580.230.340.490.380.320.490.330.440.241.751.471.761.561.912.272.121.682.191.832.181.591.450.941.351.101.131.021.651.330.860.490.730.990.160.230.220.130.390.560.760.610.260.800.530.331.271.921.911.961.04
meta-O-Dealkylated flecainide lactamME917561NANANANANA0.870.270.650.31NA0.550.320.760.721.121.141.201.072.271.591.031.101.631.770.810.681.291.041.221.341.550.801.270.661.611.32NANA0.30NANANA0.301.04NA0.620.540.31NA1.810.961.011.15
5-Dehydro-4-deoxy-D-glucarateME917599NANANA0.27NA0.56NA0.53NA0.460.41NA0.940.670.961.191.501.811.801.460.991.331.271.331.210.611.071.370.691.241.741.111.130.560.621.13NANA0.31NANA0.460.410.50NANA0.48NA1.311.611.551.381.03
Phenylalanyl-TyrosineME917603NANANANA0.530.790.370.390.40NA0.770.281.030.981.131.251.461.871.781.741.071.091.391.431.230.491.491.201.321.572.061.711.090.370.871.07NA0.360.21NANA0.280.660.69NA0.350.300.361.041.531.541.580.88
meso-Tartaric acidME917652NANANANA0.310.440.400.370.340.240.370.241.401.091.191.311.821.713.332.131.521.642.431.671.200.801.471.181.611.632.191.961.390.601.301.090.170.250.220.200.190.260.270.460.370.470.500.370.651.431.271.371.17
L-beta-aspartyl-L-leucineME9179570.970.521.100.430.310.420.340.290.410.230.340.161.030.791.861.371.632.232.821.951.931.262.171.631.200.741.301.291.441.242.501.970.810.480.771.290.080.110.100.060.380.440.760.430.280.890.520.331.241.611.671.731.14
N-Undecylbenzenesulfonic acidME9175850.990.521.140.410.320.390.380.310.420.230.380.171.070.701.741.281.642.102.631.911.911.272.181.601.240.701.291.361.461.192.382.020.870.550.871.420.090.120.120.060.370.470.740.490.270.930.530.361.201.671.611.731.21
2,4-diacetamido-2,4,6-trideoxy-β-L-altropyranoseME917795NANANANA0.400.960.380.560.560.380.660.490.990.760.930.891.901.691.561.781.612.032.041.630.830.630.820.641.451.471.681.711.491.091.621.360.190.190.260.210.330.340.520.600.270.920.580.550.061.791.932.111.16
Met-ValME9178340.620.470.570.370.570.650.670.670.640.590.700.521.170.861.011.032.142.211.641.462.622.842.291.921.050.801.150.941.161.251.481.191.510.971.291.390.410.530.560.420.470.540.691.240.490.720.700.601.341.441.411.511.12
N5-acetyl-N5-hydroxy-L-ornithineME9178151.100.430.880.100.390.670.390.630.570.340.520.311.601.401.631.632.002.362.051.952.262.202.451.961.140.821.301.091.571.411.941.771.500.871.421.460.160.280.220.150.280.350.530.520.280.950.600.361.241.561.621.631.11
Val-ValME9178160.240.090.11NA0.390.770.460.490.700.390.590.341.241.211.261.471.522.061.521.702.161.582.221.891.160.861.471.391.951.221.961.541.250.761.201.540.200.420.260.190.290.250.360.380.220.670.570.351.281.461.431.481.51
Arg-Ile-Ile-TrpME9178270.110.080.110.040.470.610.490.450.730.460.760.481.371.081.271.421.651.901.761.682.342.122.401.960.860.601.110.921.451.341.891.581.700.931.571.400.200.340.230.160.240.360.500.410.350.730.530.441.261.561.831.651.08
FormylpyruvateME9177330.100.070.090.040.470.660.440.400.720.470.740.401.391.021.121.551.691.901.801.732.272.232.331.950.870.611.100.911.541.481.811.571.710.961.641.450.170.280.190.110.240.350.460.420.340.770.520.391.341.661.701.741.07
Ile-Gly-ValME9176510.430.330.420.150.500.700.360.460.830.520.670.401.270.961.161.221.631.942.211.571.872.032.281.690.950.610.980.741.171.031.901.601.390.911.181.270.190.340.250.160.240.340.400.400.380.960.760.531.252.212.122.151.01
Oleoyl-CoAME9176400.400.320.420.140.470.700.380.470.860.560.660.391.331.071.161.221.612.122.101.572.111.932.401.640.960.640.920.751.201.091.961.661.380.871.131.340.190.330.250.160.210.330.390.390.380.940.740.481.142.032.022.001.13
Methyl 2-diazoacetamidohexonateME9177790.380.290.290.170.660.850.640.670.790.630.750.531.191.121.241.502.022.092.142.062.181.932.172.051.030.851.241.141.521.572.061.811.641.121.641.540.350.570.400.270.310.400.510.660.580.910.780.551.150.960.941.021.12
N-UndecanoylglycineME9177560.080.050.050.040.400.960.450.660.670.440.740.421.341.070.800.852.352.032.592.311.872.311.861.820.910.700.760.761.821.301.501.801.861.081.801.390.240.350.250.260.220.330.370.690.660.800.550.551.421.401.401.471.19
L-TyrosineME9179580.090.040.120.030.441.000.770.550.560.250.390.211.592.281.251.431.332.211.281.661.721.631.771.441.150.761.111.061.791.471.961.410.910.711.021.240.180.290.220.120.580.551.181.220.411.030.950.471.351.511.531.491.30
LysoPA(16:0)ME9175960.080.040.13NA0.380.900.730.510.510.260.410.221.522.291.181.381.341.981.261.501.721.481.651.441.100.811.111.051.641.441.991.500.960.741.071.240.180.310.200.160.450.611.131.240.420.990.900.501.491.511.511.541.31
BendiocarbME9179330.370.400.440.321.120.940.760.730.870.550.580.580.901.390.991.151.481.851.311.181.231.951.060.911.170.711.111.251.251.591.401.271.481.341.261.180.630.590.620.520.350.450.670.500.701.250.760.571.871.331.751.400.98
RaffinoseME9178331.040.840.751.580.530.810.540.550.610.390.550.391.201.051.151.201.611.701.831.461.701.261.961.511.060.891.161.081.381.351.531.201.490.881.111.020.300.720.480.270.420.570.660.710.750.600.580.341.341.421.351.530.60
LysoPE(18:1)ME9178960.610.360.440.250.580.700.480.550.730.510.890.470.850.600.751.001.481.221.581.531.300.812.061.651.601.001.481.761.861.161.631.521.550.761.191.500.290.610.360.270.420.640.810.840.290.600.670.731.451.821.621.831.34
AllysineME9176120.750.400.660.360.430.820.460.940.620.450.570.361.600.900.850.961.581.131.831.591.361.231.392.381.020.851.031.321.521.101.671.251.180.630.781.450.431.030.510.600.360.600.801.230.400.600.610.561.721.601.611.661.23
Asp-Cys-Cys-SerME9178830.750.290.470.430.570.750.480.580.500.480.880.561.411.040.791.151.450.951.861.790.980.641.371.931.370.971.281.751.461.351.771.321.440.880.971.510.340.690.410.430.330.600.801.420.390.620.580.771.501.441.531.641.38
3-Deoxy-D-manno-octulosonateME9177210.860.770.770.390.590.880.470.760.690.450.750.460.990.831.001.171.511.431.091.781.300.861.541.721.250.720.811.261.181.261.441.001.400.771.071.280.360.840.690.140.630.831.011.140.440.650.480.331.981.901.841.661.61
2-Dodecylbenzenesulfonic acidME9175951.150.500.530.390.571.010.400.690.690.470.810.531.151.040.941.151.541.361.471.391.421.221.781.621.361.031.091.221.250.941.381.121.400.810.991.120.410.920.630.290.460.810.851.160.340.670.590.430.992.091.851.861.11
[FA trimethyl(13:2)] 10,11-epoxy-3,7,11-trimethyl-2E,6E-tridecadienoic acidME9177721.000.490.600.290.480.980.420.590.620.410.820.471.050.850.911.031.681.231.381.531.341.241.701.871.180.891.081.361.371.081.481.521.571.011.261.410.400.950.470.220.460.670.851.210.420.770.630.590.281.991.701.801.44
Lys-SerME9176150.590.410.430.280.801.000.710.700.840.720.920.651.191.221.311.401.590.761.251.171.281.571.801.391.390.981.311.221.611.061.431.171.590.991.311.310.520.770.600.320.450.520.670.690.580.780.800.561.671.231.321.161.02
2-6-10-TrimethylundecanoicacidME9176740.920.590.560.300.590.660.770.660.860.590.750.671.121.201.471.401.691.921.721.641.772.031.951.521.211.001.401.111.391.311.661.502.081.331.591.810.290.590.440.290.470.540.610.750.530.991.100.871.091.161.161.151.12
BenzoateME9176900.890.560.560.310.570.660.770.680.860.620.780.731.161.221.441.421.551.851.661.601.661.981.861.501.221.041.451.061.371.311.711.512.031.271.601.870.300.580.480.320.480.550.610.780.541.041.050.901.181.191.191.181.19
Ala-Leu-Val-SerME9178120.880.360.350.190.440.810.650.551.090.371.050.461.130.861.281.081.671.561.541.711.631.711.961.560.870.811.051.041.151.331.641.641.551.111.381.290.250.710.530.220.380.730.341.020.521.260.710.631.251.371.131.161.03
beta-Casomorphin (1-6)ME9175681.080.530.630.420.560.960.370.790.920.630.970.520.930.840.821.001.661.341.471.491.651.421.461.731.210.821.130.951.541.331.521.221.971.251.531.330.400.830.480.310.380.560.571.270.510.900.770.521.271.040.941.071.19
Ala-Lys-Met-TrpME9178500.390.330.340.210.820.910.490.610.830.360.820.581.391.011.471.551.801.711.941.841.530.631.311.301.641.321.151.461.551.282.001.661.240.701.081.100.340.660.590.310.340.620.730.880.311.090.830.551.231.261.391.141.19
PhenylacetylglycineME9177740.900.520.720.400.500.950.700.650.720.520.580.471.321.771.501.221.772.251.611.831.611.141.751.500.910.981.321.171.801.432.111.261.040.851.011.250.480.720.480.510.420.570.680.620.480.740.820.561.061.431.561.591.41
PG(30:1)ME9177370.830.590.630.440.671.060.640.730.690.520.610.451.311.551.441.221.582.111.561.891.511.341.681.331.141.141.461.351.721.492.181.391.060.940.941.270.420.670.550.470.480.630.810.730.400.760.830.480.981.401.591.451.32
Xanthosine 5^-phosphateME9175880.820.450.590.360.571.070.530.660.600.540.630.461.361.461.681.321.612.171.611.931.501.241.861.391.251.041.431.461.691.622.281.421.160.881.001.120.380.630.390.800.430.590.750.780.350.880.760.481.011.411.701.401.18
DeoxyriboseME9176020.390.430.280.260.720.710.740.540.800.620.600.511.671.341.391.631.232.161.981.581.311.731.531.201.160.981.611.181.081.391.761.711.130.791.031.000.330.450.450.340.390.540.590.980.540.670.730.341.201.371.411.461.04
1,6-anhydro-N-acetylmuramateME9180180.230.180.240.140.810.760.720.840.690.500.730.461.451.151.451.581.541.581.901.561.711.601.661.371.190.821.501.141.531.511.941.591.390.781.251.320.360.500.520.410.510.660.790.740.320.600.500.371.041.271.411.260.96
IndoleacrylicacidME9180250.220.170.180.120.740.860.720.750.710.500.770.491.441.241.711.691.681.881.971.661.611.671.761.321.050.991.561.151.461.411.881.781.360.861.301.140.400.510.540.350.430.520.760.800.300.710.450.431.031.231.351.261.08
D-GlyceraldehydeME9178730.480.300.360.170.550.850.590.580.770.470.690.441.301.201.381.411.741.931.361.691.241.011.521.571.430.981.551.521.731.621.851.591.210.881.041.290.340.640.450.270.470.530.640.680.440.810.700.481.131.401.291.301.15
IndolepyruvateME9178620.850.350.500.140.670.740.570.840.810.550.810.431.291.211.271.311.742.001.831.761.451.731.631.561.420.951.310.951.501.451.891.501.211.031.191.270.250.570.480.190.500.510.650.740.630.910.710.471.271.141.041.101.08
5-MethylcytidineME9179220.510.390.460.310.410.840.680.780.630.640.760.621.571.401.541.741.972.101.941.761.611.381.421.391.541.161.521.341.361.241.841.661.140.820.950.970.390.520.690.360.450.620.710.730.410.830.850.441.261.081.021.051.09
penem CGP31608ME9177960.840.440.430.190.690.950.620.730.730.500.720.541.461.331.641.811.711.881.781.721.501.271.451.251.531.231.481.421.371.401.701.581.110.711.020.940.240.630.480.380.410.580.690.630.580.780.600.511.141.071.211.171.14
FormylfusarochromanoneME9179590.290.220.340.120.671.030.680.620.770.510.610.411.251.331.381.241.852.221.321.532.051.621.761.371.300.931.250.961.321.511.751.211.270.971.141.070.340.450.410.280.410.390.520.420.370.930.660.511.111.801.761.681.11
Glu-Ser-TrpME9175590.330.360.360.210.730.900.780.740.740.610.700.471.261.301.411.421.771.891.371.491.701.541.511.291.361.071.261.081.281.601.621.281.291.021.151.180.480.560.580.390.490.540.720.580.380.860.660.541.091.321.371.331.03
N-AcetylornithineME9178090.350.260.25NA0.380.830.620.630.800.540.730.451.160.861.281.111.482.041.711.601.701.901.471.641.090.971.371.251.391.251.841.331.341.161.261.600.310.590.490.250.310.540.830.840.270.860.790.510.661.341.331.291.14
2-Deoxy-D-ribose 5-phosphateME9177000.600.440.430.250.580.940.560.600.810.660.810.561.080.930.961.161.661.731.921.711.711.741.821.690.970.730.950.901.571.351.921.501.541.061.411.390.440.690.420.350.360.460.500.580.620.810.780.500.841.301.351.311.05
Glu-Pro-SerME9180050.530.410.390.350.560.890.460.610.600.590.690.431.110.971.191.191.671.532.041.631.721.541.661.541.160.861.091.391.521.311.561.421.420.951.261.210.460.760.510.260.380.530.641.080.550.920.660.520.881.371.511.351.16
FA(16:1)ME9176010.470.290.310.200.580.850.500.580.750.570.690.471.171.041.221.371.541.941.901.641.681.731.721.601.180.891.331.081.261.451.941.681.301.041.151.270.330.530.400.260.330.430.610.630.390.800.730.430.671.751.711.621.00
Val-Gly-ProME9176600.520.360.340.290.580.800.630.590.730.520.710.501.341.181.291.401.901.881.831.771.811.841.931.791.271.001.471.221.521.491.981.531.480.921.291.410.380.580.480.390.480.560.630.730.450.890.740.511.381.631.551.591.15
FA hydroxy(8:0) hydroxy-octanoic acidME9177611.500.830.830.480.650.540.470.620.690.570.870.521.120.941.091.401.581.551.641.721.251.011.501.521.311.061.471.501.191.061.751.331.020.900.951.060.490.860.590.370.620.800.851.140.380.500.690.411.181.601.511.530.99
ThymineME9177290.860.510.550.280.560.810.440.700.650.490.790.481.120.971.511.511.801.761.791.861.421.141.591.731.460.781.611.011.351.211.901.511.150.741.081.170.470.810.470.320.450.570.720.850.360.490.580.470.841.821.721.671.07
Hexose phosphateME9176261.160.600.670.300.560.910.550.680.720.480.770.431.180.961.481.511.891.291.451.861.341.191.571.641.631.241.701.961.341.081.441.141.170.660.731.020.420.880.600.360.580.670.740.840.290.570.590.361.201.271.161.200.99
PhytuberinME9175500.790.510.480.220.540.870.530.680.740.470.830.441.221.061.381.531.661.561.561.901.410.861.581.601.581.151.921.801.361.201.781.401.050.740.791.130.380.800.490.370.410.470.690.770.270.370.540.311.271.421.601.471.08
(R)-LactateME9175550.740.430.500.260.690.920.700.670.710.490.760.481.211.131.451.572.091.591.471.991.181.201.331.311.391.071.641.401.211.351.771.351.100.720.880.900.470.730.560.430.420.540.690.860.340.520.540.511.171.601.411.321.25
(1-Ribosylimidazole)-4-acetateME9178590.720.440.390.360.660.630.650.600.770.650.820.561.351.111.081.501.481.561.921.420.981.171.611.571.541.132.031.411.391.472.002.021.120.861.031.330.290.620.500.450.360.600.720.690.290.530.720.550.641.191.231.171.09
2-Hydroxy-2,4-pentadienoateME9177650.630.540.600.470.790.860.820.730.750.870.610.691.661.471.861.881.631.751.771.691.071.301.161.211.571.141.721.601.501.311.921.631.000.780.681.020.720.830.660.620.550.740.770.790.500.700.770.651.231.311.111.211.09
Glu-ArgME917548NA0.22NA0.170.361.010.280.660.750.590.610.471.151.001.011.281.421.721.481.651.081.081.291.481.030.911.241.151.361.671.171.241.180.880.981.05NA0.600.39NA0.250.480.620.340.220.800.650.671.512.292.262.271.02
D-Ribose 5-phosphateME9177400.330.310.280.240.780.980.720.700.880.630.700.500.981.121.121.551.801.861.771.611.241.871.260.951.260.961.341.310.981.091.001.231.140.990.970.880.400.530.540.490.560.490.690.500.521.050.670.481.392.122.012.091.11
Orotate(Fragment)ME9179450.390.290.370.190.580.760.500.500.640.490.600.431.521.311.591.461.761.771.381.451.451.681.391.221.411.001.321.031.361.311.411.231.230.861.070.970.370.480.450.280.540.650.720.650.380.900.640.571.302.042.052.050.99
N3-(4-methoxyfumaroyl)-L-2,3-diaminopropanoateME9178740.680.540.470.230.430.83NA0.760.650.380.800.330.281.160.551.301.991.681.701.761.581.502.001.881.030.671.171.051.141.481.901.111.460.710.941.200.130.730.41NA0.510.590.680.800.450.690.740.331.311.701.611.571.39
PhenylpropanoateME9177420.520.390.350.210.550.760.460.600.700.450.720.470.960.791.051.221.761.701.801.711.441.621.821.770.960.731.131.091.361.391.891.691.500.881.291.420.330.520.390.240.380.450.570.640.450.760.710.461.432.152.062.171.09
Val-Val-ProME9180130.470.360.370.250.580.860.540.690.740.560.750.541.000.931.091.221.591.541.671.671.571.731.841.771.000.791.051.091.381.351.841.611.501.001.341.490.350.540.420.280.390.490.530.790.490.810.710.532.212.142.172.221.16
CAPSME9179890.460.300.280.150.570.900.350.550.670.470.790.431.020.791.001.121.881.501.971.801.721.651.931.741.010.741.101.081.531.321.741.501.650.981.231.400.300.550.380.240.270.400.550.710.440.750.660.511.721.701.621.701.19
9-mercaptodethiobiotinME9180080.550.350.400.270.650.930.560.690.730.580.720.491.021.051.181.041.751.641.601.501.591.561.591.681.010.761.021.071.411.251.651.491.360.981.171.250.440.590.480.310.340.540.550.730.570.830.730.471.711.781.671.661.04
Ala-Ala-ProME9180040.610.340.420.280.610.870.530.640.820.620.780.540.960.981.051.071.651.621.501.411.571.491.501.651.050.771.031.071.541.411.581.501.450.991.231.220.410.610.370.350.380.490.640.830.540.850.770.521.781.651.571.721.16
α,α^-Trehalose 6-phosphateME9175790.510.320.360.220.570.890.590.500.500.470.840.490.961.021.131.221.721.481.691.671.281.421.951.771.330.811.151.091.501.141.591.141.500.761.011.170.350.630.470.280.400.580.650.95NA0.880.710.521.431.921.541.721.22
3-Oxododecanoic acidME9176790.580.330.380.270.660.860.590.650.770.570.780.510.900.991.171.381.501.581.671.721.381.241.701.431.020.971.501.311.451.191.931.601.330.721.061.280.350.680.500.340.500.440.730.730.400.560.790.491.571.571.561.691.13
SulfoacetateME9176750.430.330.290.220.630.820.470.650.620.550.800.541.141.041.271.301.621.601.621.680.971.331.521.821.260.861.421.231.211.341.531.461.260.890.971.280.390.540.470.330.380.530.750.920.450.700.730.451.661.881.841.941.10
[FA (16:2)] N-hexadecyl-ethanolamineME917777NANANANANA0.46NANA0.61NA0.49NA0.960.520.740.821.260.890.841.291.671.061.281.490.940.501.080.771.310.721.670.701.050.570.640.97NA0.51NANA0.390.410.410.61NA0.710.33NA0.932.892.692.561.26
PhenyllactateME917808NANANANANANANANANANA0.21NA0.760.401.351.371.300.891.531.071.451.161.201.020.41NA0.881.130.390.431.530.950.630.290.460.67NANANANANANANANANANA0.22NA0.842.532.212.070.65
(S)-LactateME917728NANANANANA0.460.22NA0.200.170.19NA1.651.391.941.832.851.931.541.861.561.270.881.030.820.571.200.920.820.741.121.250.560.220.750.580.200.580.240.270.160.240.250.23NA0.200.19NA1.283.023.333.350.84
PA(32:2)ME917625NANANANA0.310.340.170.150.330.340.400.110.740.530.900.771.541.952.261.781.831.642.081.460.610.440.760.661.331.202.091.720.890.480.930.97NANA0.09NA0.130.400.530.500.621.500.970.531.042.382.332.350.94
PentanoateME9178770.36NA0.21NA0.480.590.220.430.560.230.460.490.810.790.771.092.232.561.291.642.823.082.311.750.900.590.990.711.421.001.281.131.460.481.141.090.140.340.25NA0.170.330.420.270.210.490.480.411.232.352.072.580.89
2-OctenedioicacidME9176221.120.690.45NA0.470.89NANA0.720.560.690.400.870.790.931.201.171.120.921.150.740.711.031.151.150.681.211.301.131.171.331.531.060.861.001.10NA0.840.59NA0.400.660.650.49NANA0.36NA0.942.742.672.540.84
Phe-Gly-Pro-ProME9178890.240.17NANA0.230.50NANA0.540.260.450.221.190.821.861.330.751.511.511.722.691.671.731.331.120.601.091.101.000.621.681.050.670.531.111.070.240.270.240.220.190.380.280.400.370.300.580.381.453.203.553.381.22
D-ErythroseME9175440.330.200.220.080.430.760.610.500.680.380.540.350.881.500.971.081.371.901.071.502.610.981.871.301.060.761.211.161.731.271.751.301.030.610.831.520.270.470.320.220.290.320.530.530.210.510.560.351.802.842.992.851.59
CoAME9175640.620.400.550.250.250.450.330.250.320.210.330.151.161.151.261.141.932.351.841.452.891.752.621.421.250.991.341.231.341.251.361.120.870.400.730.820.120.150.170.150.340.450.430.390.200.560.310.211.263.143.203.171.02
Octadecanoic acidME9175600.710.450.590.300.280.450.330.290.330.200.340.171.191.111.241.071.932.281.921.502.741.822.581.541.370.971.361.121.301.121.421.100.910.440.740.790.110.160.190.170.320.480.490.430.220.580.360.221.172.933.123.061.05
4-Methyl-2-oxopentanoateME9176460.450.280.290.120.430.610.340.440.530.370.550.351.330.911.021.071.692.051.381.552.051.212.091.391.060.721.161.091.120.931.441.161.080.660.861.170.250.490.380.210.290.380.460.540.220.430.540.292.153.663.463.500.83
(R)-2,3-Dihydroxy-3-methylpentanoateME9179690.510.300.320.160.450.630.350.450.550.380.580.361.380.941.061.101.752.131.301.602.121.152.161.441.100.741.200.991.160.971.491.211.110.680.891.210.250.460.340.210.300.440.470.620.220.450.560.300.593.793.593.630.86
Glycerol 1-propanoateME9176720.430.320.490.130.450.610.430.410.530.380.490.311.241.441.351.371.882.281.741.491.981.711.571.201.380.991.281.131.491.361.931.321.190.720.870.970.250.410.280.130.380.540.680.620.330.570.410.331.152.202.382.411.08
Tyrosyl-ValineME9179410.370.280.390.160.340.570.420.340.470.290.390.221.261.321.461.412.102.571.611.552.081.591.721.281.391.021.351.181.551.501.721.311.150.640.900.970.190.260.280.190.390.470.610.510.200.610.380.301.192.532.542.421.07
N-Acetyl-L-aspartateME9178680.160.150.160.100.470.660.430.370.490.410.600.381.381.091.441.311.671.931.751.601.511.831.921.481.330.921.461.191.291.321.731.591.210.701.151.170.230.320.350.210.420.550.690.630.340.780.580.471.502.182.202.151.08
N-Acetyl-L-phenylalanineME9178670.160.150.160.100.470.660.430.380.490.380.600.391.371.061.451.321.681.941.721.611.521.781.941.441.340.921.471.201.421.331.701.521.220.711.161.180.230.320.350.210.420.550.620.630.330.780.550.441.532.242.202.131.11
Glycerone phosphateME9178710.180.120.150.070.470.610.490.430.460.330.470.241.211.071.581.412.011.971.531.631.991.591.891.341.330.921.701.321.541.561.981.511.120.621.071.000.200.280.280.180.430.520.790.670.260.720.490.401.142.292.212.231.00
N-Acetyl-L-glutamate 5-semialdehydeME9178690.180.120.150.070.470.660.500.470.500.310.440.241.381.121.641.391.982.051.671.611.871.621.811.331.280.921.771.301.581.521.861.501.110.621.001.000.220.310.270.170.450.530.830.650.260.730.500.391.152.192.152.161.03
2^-HydroxydaidzeinME9176270.170.13NANA0.510.630.320.310.500.350.390.261.651.151.821.461.741.761.421.101.301.541.260.961.391.031.591.301.190.931.401.290.860.550.730.960.180.380.410.230.540.730.780.810.430.620.450.491.282.712.793.240.97
Lys-ProME9179750.540.390.500.200.450.650.520.440.560.360.460.291.411.501.381.471.992.271.371.441.681.221.421.091.541.131.291.181.331.171.591.150.750.570.710.930.330.470.420.280.530.550.590.440.230.570.510.391.292.822.842.661.11
Ala-Asn-SerME9179500.320.230.320.140.340.450.310.270.390.260.380.191.551.211.721.552.082.251.751.611.651.801.591.201.501.061.661.201.351.241.641.351.050.520.810.800.150.220.230.130.430.620.770.610.230.560.420.301.232.752.972.710.96
ApigeninME9179040.330.220.340.130.310.430.300.270.360.290.380.201.471.151.691.482.042.101.671.611.621.681.601.211.491.091.641.231.351.211.571.381.100.500.880.830.160.230.230.120.450.610.810.670.240.520.430.331.272.912.942.920.98
Alanyl-ProlineME9177160.390.270.380.240.480.550.480.420.550.480.510.411.671.081.611.552.262.021.731.631.871.861.741.431.420.821.601.231.131.081.811.311.310.631.050.990.360.450.410.370.510.610.720.450.370.580.600.432.202.622.632.761.11
Jubanine BME9180140.280.230.320.180.570.810.450.540.630.530.650.441.651.281.321.441.491.451.631.371.261.741.491.161.230.861.390.991.151.011.301.251.630.811.141.000.440.630.590.430.290.500.580.800.330.670.520.382.292.452.462.861.14
19-oic-deoxycorticosteroneME9178210.450.280.340.270.840.820.620.460.890.700.810.521.391.251.261.431.481.781.761.401.841.481.081.270.721.041.161.131.031.161.681.571.040.630.810.830.320.380.610.310.320.660.730.550.280.850.660.381.892.642.963.030.92
[PR] 1^-Hydroxy-4-keto-gamma-carotene glucoside/ 1^-OH-4-Keto-gamma-carotene glucoside/ (Carotenoid K-G)ME9178460.840.250.270.180.600.730.380.640.560.280.690.491.120.991.011.481.521.781.661.741.241.161.701.441.370.941.491.411.281.171.711.531.100.650.611.020.250.590.540.260.330.490.590.580.210.690.570.311.172.832.822.820.89
AcetoacetateME9177980.620.430.560.200.580.690.290.360.660.480.690.551.021.261.301.511.471.531.771.271.231.361.511.391.110.931.341.261.130.931.901.501.320.931.071.140.270.650.410.200.500.580.730.850.260.660.580.321.162.522.582.411.03
[PG (16:0)] 1-hexadecanoyl-sn-glycero-3-phospho-(1^-sn-glycerol)ME9175450.490.370.400.170.650.780.580.640.710.500.730.441.141.091.291.411.531.401.661.641.331.251.571.421.210.781.261.201.131.171.561.361.240.800.991.160.290.590.440.150.390.520.600.700.290.610.510.531.432.413.002.510.97
Leu-Val-ProME9179520.170.170.190.080.610.790.570.600.660.440.690.481.521.251.501.311.431.601.621.391.291.761.541.201.060.811.350.921.301.201.551.591.380.801.131.130.320.420.530.330.420.510.670.630.210.480.470.351.512.903.072.981.08
Succinate semialdehydeME9178130.280.200.280.140.620.780.590.520.660.410.630.311.171.131.431.581.671.751.521.351.611.501.571.471.150.931.711.571.251.321.791.451.210.701.071.160.270.440.440.290.360.380.400.300.320.780.490.411.292.702.782.890.96
(S)-3-Methyl-2-oxopentanoic acidME9176730.280.24NANA0.610.760.430.470.510.310.610.580.941.051.211.151.521.281.471.651.070.911.621.231.481.051.661.591.180.972.081.600.980.700.840.860.240.510.310.280.390.250.530.34NA0.260.31NA1.153.122.472.911.04
D-Sedoheptulose 7-phosphateME9175700.420.360.300.220.820.990.790.770.460.330.780.641.180.961.351.721.371.431.781.891.020.951.471.471.611.061.811.761.021.001.481.470.800.720.400.900.400.700.590.330.310.300.640.93NA0.380.480.281.492.222.122.161.13
mercapto-2-propanolME9178490.810.340.35NA0.490.430.460.500.750.260.750.301.140.981.351.461.541.521.451.831.140.811.231.241.340.991.601.521.181.041.591.391.110.760.951.04NA1.010.260.390.700.780.360.51NANA0.45NA1.151.852.041.940.91
Asp-Glu-Glu-GluME9178480.850.260.32NA0.480.660.540.420.710.310.570.290.950.861.521.051.601.461.281.221.141.031.451.091.050.750.871.010.790.781.061.400.770.761.041.01NA0.400.33NA0.320.580.360.42NA0.400.55NA1.123.713.823.940.69
4-HydroxybenzaldehydeME9177200.500.530.560.280.450.410.360.390.500.430.510.411.250.841.041.291.301.321.431.141.271.501.551.171.431.221.511.250.840.941.201.091.180.750.980.900.310.450.490.290.821.001.060.970.390.830.640.521.372.973.033.140.99
Deoxyguanidinoproclavaminic acidME9177070.510.530.560.280.450.410.360.390.500.430.510.411.250.851.041.301.311.321.441.141.271.181.320.981.431.231.511.250.840.941.201.101.180.750.980.900.290.450.490.290.771.001.060.970.390.830.640.521.393.253.523.090.95
FA hydroxy(6:0)ME9177700.930.700.580.360.530.810.440.540.920.590.840.521.050.881.201.261.291.081.161.430.980.911.301.351.310.991.441.240.900.821.201.111.270.930.841.100.420.930.590.400.470.660.760.910.310.480.790.351.183.043.032.920.96
Glu-Pro-ValME9180010.940.710.580.320.540.810.440.630.940.570.860.541.030.901.221.281.311.101.181.451.000.921.311.371.300.950.881.250.910.831.221.121.280.940.851.110.430.940.600.380.470.670.770.920.350.490.800.351.163.083.072.960.97
Ala-Ala-Asp-ProME9180110.820.430.430.270.530.720.350.570.730.480.830.571.130.831.041.181.581.421.301.521.151.111.331.621.140.791.131.161.070.881.251.091.380.910.961.100.420.780.590.450.450.800.770.840.330.630.610.411.652.882.922.830.82
O-Acetyl-L-homoserineME9179700.770.450.510.230.540.750.380.600.750.530.830.491.110.771.051.281.441.291.131.411.060.991.461.351.270.921.271.211.150.931.401.271.390.890.941.120.370.750.510.320.410.560.660.780.290.450.630.371.463.083.253.270.91
FA (8:0) octanoic acidME9177730.370.270.390.160.640.710.500.520.880.600.840.500.760.690.760.811.521.621.241.221.891.642.251.661.070.790.980.891.201.211.331.121.541.041.141.480.350.540.410.250.340.400.440.420.461.110.760.611.202.862.862.760.96
Proclavaminic acidME9177670.370.270.390.160.640.710.500.490.880.600.840.500.820.690.760.821.521.621.241.221.891.652.251.661.070.790.980.891.201.211.331.091.541.041.141.480.350.540.420.250.340.400.440.430.461.110.760.611.182.862.862.760.96
L-ArginineME9179790.270.260.34NA0.360.910.350.360.710.560.670.570.910.931.141.051.391.351.381.201.301.741.411.500.880.780.780.521.171.171.471.221.291.170.921.300.310.350.30NA0.550.640.790.780.341.050.730.761.403.042.772.880.99
Ala-Gly-Pro-ProME9180070.350.230.250.200.420.920.400.460.800.350.700.540.881.051.041.281.431.491.441.771.321.781.831.480.890.731.090.751.271.471.491.751.530.861.321.530.370.420.270.220.330.260.300.690.300.840.690.431.532.973.043.061.16
PIPESME9179290.260.260.310.140.731.060.770.770.810.520.860.630.920.870.810.801.401.371.271.461.201.431.681.310.920.690.880.671.261.121.861.411.680.921.441.280.400.570.510.310.310.330.410.430.400.810.680.601.233.483.483.260.98
PE(36:2)ME9179920.430.300.210.110.620.680.650.730.890.520.680.481.010.841.171.181.631.331.341.651.081.531.611.350.930.761.140.961.121.171.491.461.360.981.081.170.200.480.360.290.350.440.500.580.500.670.710.451.473.143.223.110.90
O-Acetyl-L-serineME9177030.640.400.400.220.550.810.430.570.620.440.590.381.261.081.221.151.581.521.491.401.361.361.371.301.140.811.071.071.221.201.561.211.240.740.951.090.320.540.410.280.340.500.630.600.370.630.700.411.573.583.363.330.97
SecobarbitalME9179230.570.340.310.230.550.750.380.620.680.550.640.450.860.860.961.101.511.451.391.221.341.451.431.430.970.840.951.021.191.061.501.321.290.891.151.190.290.540.360.230.340.400.520.560.460.860.700.411.353.523.593.550.88
CPXME9179600.360.340.510.250.640.680.510.670.950.830.550.561.161.321.221.210.951.080.951.040.870.881.120.721.441.121.471.161.371.141.261.101.141.151.031.160.520.480.580.380.970.971.391.630.591.541.070.931.381.711.981.851.14
UracilME917781NANANANA0.430.580.400.681.000.810.980.461.060.981.251.711.421.521.121.391.370.970.921.081.140.841.361.260.831.151.281.141.070.981.020.850.410.540.48NA0.310.691.050.890.361.320.780.490.822.021.792.110.89
ADPME9178910.750.500.480.260.811.341.000.910.760.430.680.481.181.440.851.231.891.460.991.691.030.690.960.941.040.780.990.800.980.881.290.890.940.720.750.990.460.890.550.470.680.751.071.260.470.930.950.661.332.442.552.491.26
Trp-SerME9175900.600.360.420.150.600.830.550.550.730.670.930.980.992.140.930.731.691.240.670.940.800.461.391.231.711.021.031.101.070.711.110.741.180.820.771.260.400.690.470.500.560.560.500.650.461.101.001.061.333.432.893.141.16
GlycerophosphoglycerolME9178721.540.891.050.71NA0.72NANANANANANA0.88NA0.440.761.16NANA0.78NA0.861.311.551.141.000.811.101.19NA0.730.631.380.730.700.92NA0.93NANA0.841.471.331.77NA0.79NA0.561.110.971.161.140.93
NADP+ME9178860.95NANANANA0.55NANANANA0.66NANANA0.290.941.560.521.311.491.240.781.401.551.25NA0.601.001.580.461.100.520.930.760.940.89NA0.39NANANA0.810.741.55NANANA0.302.391.051.261.270.97
Glu-Ile-ValME917671NANANANANANANANA0.48NANANA0.46NANA1.101.871.241.250.500.671.011.191.181.011.041.051.071.200.521.680.921.31NA0.980.81NANANANANANA0.29NANANA0.33NA1.841.280.381.171.17
6-Acetamido-3-aminohexanoateME917704NANANANA0.550.60NANANANA0.71NA0.840.621.151.131.410.881.331.43NA0.490.991.161.420.660.961.501.470.981.551.021.180.530.790.91NA0.640.51NANA0.44NA0.55NANA0.47NA2.141.361.191.620.82
PG(34:3)ME917831NANANANANA0.67NANANANANANA0.860.520.821.131.110.911.251.401.250.771.141.570.740.351.110.940.901.320.961.011.290.520.821.01NANANANANANA0.350.39NANA0.33NA2.741.361.271.400.79
N6-Acetyl-L-lysineME9177110.850.52NANANA0.75NANA0.58NA0.65NA1.040.640.850.800.80NANA0.90NA0.521.010.840.94NA1.660.900.741.032.040.801.200.560.750.60NA1.570.49NANA0.750.66NANANANANA1.192.252.102.380.66
Ile-Ala-IleME917581NANANANANANANANANANANANA1.291.511.700.981.530.970.531.00NA0.790.880.791.891.181.080.980.890.830.830.980.20NANA0.23NANANANA0.600.240.71NANANANANA1.031.631.621.420.68
UrateME917875NA0.41NANANANANANANANA0.70NA1.110.550.851.061.51NA0.730.81NA0.521.411.361.400.871.680.970.900.610.920.740.53NANA0.56NANANANANANANA0.65NANA0.42NA1.111.952.022.100.54
FA hydroxy(18:0)ME917860NANA1.251.321.000.281.120.611.001.020.131.75NA0.560.50NA1.031.300.571.411.301.380.670.72NA0.481.720.820.941.221.201.330.80NA0.440.60NA0.65NANA1.051.300.452.001.940.31NA1.521.860.740.840.861.00
N-Formimino-L-glutamateME9180160.570.520.350.730.530.771.150.691.761.310.851.340.650.591.530.500.971.752.111.661.722.011.100.940.360.38NA0.340.961.231.511.941.151.891.901.220.350.470.440.48NA0.720.320.672.580.890.720.662.511.031.181.160.78
XanthineME9179340.140.040.100.040.140.230.260.200.290.200.330.130.630.731.422.342.383.733.042.831.851.301.671.430.960.612.052.001.562.163.832.291.010.561.111.350.040.060.110.040.100.190.370.850.100.620.310.140.701.111.151.330.87
Asp-Leu-Pro-ProME9179560.04NANANA0.110.240.220.170.200.140.240.110.490.561.171.781.883.064.412.892.221.421.831.800.500.261.281.321.201.784.161.990.690.320.810.77NANA0.07NANA0.040.140.350.120.230.230.070.670.991.141.110.79
PG(32:2)ME917578NANANANA0.060.190.240.160.220.120.260.130.470.491.131.611.902.684.242.861.771.511.751.570.490.261.311.361.041.503.961.790.660.290.720.77NANANANANANA0.160.360.120.230.240.050.650.930.971.070.74
L-HistidineME917865NANANANANA0.400.230.150.550.190.100.091.891.350.390.311.002.580.600.763.641.653.911.680.670.330.630.491.830.841.130.330.680.410.302.23NA0.08NANA0.13NANANANA0.360.42NA3.221.241.431.341.41
2-Dehydro-3-deoxy-D-glucarateME9176000.520.130.370.060.151.241.020.340.680.110.150.092.583.140.700.512.684.870.811.593.270.572.381.611.590.600.781.172.141.822.720.360.410.360.231.650.250.510.200.330.200.210.240.180.090.380.310.102.082.362.412.392.30
dTDPME917616NANANANA0.140.380.390.180.180.120.18NA1.121.530.760.792.053.991.331.312.751.111.650.891.200.700.850.711.781.201.890.900.750.560.801.39NA0.120.13NANANA0.13NANA0.590.220.181.221.491.581.361.39
Trp-AlaME9179280.210.150.09NA0.190.420.360.250.310.210.260.081.001.450.920.702.454.561.751.693.221.592.361.121.660.921.080.862.311.372.261.360.740.490.781.440.170.200.090.080.080.190.190.080.170.630.350.231.541.801.941.961.70
dGDPME9175570.400.210.480.260.460.480.440.450.530.490.480.510.690.610.730.763.003.162.002.074.624.113.393.130.630.490.740.690.910.891.300.761.581.001.641.530.300.360.410.340.330.470.380.610.220.530.500.351.141.501.521.451.19
FA hydroxy(20:3)ME9179390.01NA0.02NA0.330.580.460.400.440.360.410.300.280.180.200.212.683.021.891.474.533.903.552.610.150.130.300.111.261.151.730.811.911.131.701.810.080.110.100.10NANANANA0.090.360.190.161.011.221.251.261.05
Val-TyrME9179400.01NA0.02NA0.310.630.450.390.430.360.400.290.270.180.200.222.942.971.861.574.463.843.492.570.140.130.270.111.241.131.700.801.871.111.811.930.080.110.100.10NANANANA0.090.360.180.181.001.201.231.241.03
Decanoic acidME917687NANANANA0.350.700.440.370.510.430.550.331.210.960.951.152.542.383.372.422.933.002.842.050.630.360.730.590.981.121.360.961.290.660.980.790.210.330.310.26NA0.130.150.190.270.430.350.240.431.281.221.241.04
FA(16:0)ME9176500.180.110.180.070.230.340.340.280.370.270.420.291.091.051.481.482.062.722.491.992.872.164.522.730.760.510.980.850.760.641.411.011.160.611.851.930.110.190.180.150.140.190.330.310.160.630.520.311.281.771.721.661.14
CytidineME9180030.040.040.050.030.450.590.400.520.600.470.580.321.311.100.921.121.582.242.812.452.662.932.771.890.660.390.700.640.950.971.431.041.090.681.040.950.310.350.380.300.120.130.180.270.220.410.360.223.802.172.162.001.20
FA oxo(16:0)ME917749NANANA0.11NA0.15NANA0.140.160.370.140.740.440.860.761.781.012.261.272.273.972.371.870.310.210.580.430.360.350.980.890.990.301.390.89NA0.110.120.12NA0.12NANANANA0.11NA1.843.073.133.350.60
trans-AconitateME917712NANANA0.11NA0.15NANA0.140.160.370.140.730.480.740.771.551.301.611.192.314.032.411.900.320.210.590.440.360.350.990.901.070.260.950.77NA0.110.12NANA0.08NANANANA0.11NA1.873.123.173.400.61
ScytaloneME917818NANANANA0.320.31NA0.580.391.440.28NANANANANA0.240.441.020.510.360.570.620.61NA0.772.22NA0.332.591.541.810.701.050.580.750.390.191.124.90NANANA1.82NA0.250.76NA2.141.020.891.241.25
3,4-DihydroxybenzoateME9177020.430.800.200.730.790.540.370.460.321.330.450.441.681.811.420.520.430.561.990.901.010.501.111.060.541.832.040.650.501.701.601.251.131.500.371.200.560.331.153.451.240.250.382.371.470.420.890.463.321.551.501.360.88
Suberic acidME9178030.261.180.300.740.990.490.740.920.491.060.520.371.511.450.510.610.260.280.820.541.180.331.331.320.121.692.080.780.392.021.741.431.111.430.371.230.520.501.372.611.590.270.192.781.590.321.050.932.481.001.111.031.08
FA (17:0)ME9177010.301.170.682.630.321.761.260.321.941.500.450.520.480.572.93NA0.640.592.260.330.381.560.730.860.900.420.731.311.520.371.191.500.451.100.720.970.400.470.382.173.190.600.301.261.500.460.430.612.551.411.271.121.18
RishitinME9177850.920.630.443.060.620.841.690.500.570.850.390.841.891.191.400.330.390.691.290.161.081.771.052.840.610.260.871.280.531.340.632.330.970.522.821.000.400.490.641.561.450.710.790.601.810.521.340.493.290.710.840.741.56
BPH-674ME9178361.46NANA1.02NA0.35NANANA0.45NA0.79NA0.461.32NA1.20NANANANA0.660.421.280.93NANANA1.050.390.610.37NA0.901.040.70NA1.19NA0.77NANANANA1.461.210.400.864.010.921.211.331.23
Glycyl-leucineME9177341.010.720.730.65NA1.92NA0.510.790.600.570.450.630.751.43NA0.712.34NA0.70NA0.501.230.610.440.500.560.540.580.730.640.810.612.140.600.530.520.650.460.681.940.650.820.98NA0.701.480.815.091.291.821.881.72
PhosphoenolpyruvateME9179180.910.910.661.550.770.860.810.460.650.520.360.611.191.331.250.800.791.161.480.780.770.980.830.551.381.611.130.970.580.670.770.930.500.720.480.660.470.480.370.600.991.021.031.891.090.601.470.706.332.462.012.121.90
Serinyl-SerineME9177921.010.730.831.050.531.050.830.670.670.540.430.650.820.650.820.820.671.200.540.820.790.540.510.781.421.661.171.000.800.861.010.560.690.890.490.810.420.590.430.431.131.191.492.431.120.701.090.926.532.542.072.192.03
Valyl-PhenylalanineME9179000.440.26NANA0.621.260.460.730.750.440.850.410.960.630.951.611.400.710.991.740.750.420.961.341.691.021.261.770.850.671.470.780.890.630.740.900.541.190.700.370.180.390.580.84NA0.280.370.226.271.591.941.831.38
L-gamma-glutamyl-L-isoleucineME9177430.530.340.360.220.570.840.440.500.730.620.700.410.830.730.821.111.471.551.491.381.381.241.521.510.820.810.921.001.261.131.401.191.400.961.161.280.190.630.370.270.370.420.540.630.430.750.630.557.411.431.351.460.93
UridineME9179270.780.580.851.020.731.160.840.820.760.700.800.891.341.120.680.661.111.191.511.161.030.820.820.830.900.630.780.791.111.131.480.801.120.851.090.890.760.630.741.120.630.580.571.321.541.250.830.867.300.971.051.151.42
Alanyl-TryptophanME9177760.740.640.303.350.940.951.110.380.450.480.520.881.381.262.220.750.480.641.310.870.690.720.450.500.360.961.100.620.861.031.772.720.660.980.850.990.210.220.411.070.650.640.271.473.951.191.630.593.281.231.301.391.56
FA (8:1) octenalME9177710.810.660.542.480.811.251.060.590.490.690.460.751.050.981.820.620.531.322.640.490.810.900.680.540.730.620.640.541.160.941.652.050.651.100.751.040.230.270.471.100.620.750.200.923.000.880.540.664.221.831.761.892.20
2-AcetolactateME9177380.320.900.322.660.770.821.060.500.590.660.471.061.731.482.971.270.310.711.940.680.571.000.790.510.411.221.390.770.530.921.261.370.580.960.610.800.250.300.541.411.020.650.141.852.650.631.000.593.391.721.691.852.17
3-(4-Hydroxyphenyl)lactateME9177150.670.820.573.790.590.791.150.540.690.750.540.761.381.152.230.880.651.071.460.660.690.900.780.520.661.121.210.730.680.791.271.520.700.980.610.850.410.430.590.981.030.820.541.581.730.760.890.704.921.510.691.761.75
NonateME9177100.700.890.523.440.620.791.270.410.460.840.430.751.451.572.750.950.550.981.330.600.660.680.780.420.611.190.960.940.770.771.001.320.590.930.540.910.290.360.490.850.940.940.391.802.050.800.930.704.421.841.771.642.04
5,6-Dihydroxy-3-methyl-2-oxo-1,2-dihydroquinolineME9177223.281.361.910.971.171.760.891.341.530.901.260.950.640.440.330.740.990.940.670.650.920.630.750.830.610.600.530.640.710.500.680.351.411.501.181.090.761.520.680.810.931.021.093.331.051.401.141.542.201.090.981.191.08
(2S)-2-Isopropyl-3-oxosuccinateME9177901.350.560.411.420.321.000.860.340.971.210.940.682.672.081.861.401.160.921.010.590.480.950.401.231.421.100.940.940.900.340.530.720.980.780.540.890.380.780.711.020.670.780.812.081.711.120.970.904.340.931.221.101.41
dADPME9179132.271.731.561.471.251.441.251.151.691.071.111.110.760.590.490.840.801.271.080.750.700.810.860.600.570.710.700.590.620.540.700.491.271.330.941.060.761.270.741.210.890.920.951.901.501.251.280.943.680.970.981.050.99
gamma-L-Glutamyl-L-cysteineME9179081.861.361.340.811.121.270.941.221.880.911.080.870.800.480.520.750.841.040.910.830.620.660.670.610.520.740.650.600.590.560.830.561.051.270.800.890.741.070.600.700.820.870.802.010.951.301.290.904.440.961.121.080.90
N-AcetylglutamineME9177751.940.890.841.250.991.270.460.690.971.520.790.960.680.511.740.840.850.510.590.840.560.730.741.400.720.710.420.851.750.770.961.060.830.951.301.020.961.460.560.780.980.940.751.671.240.980.790.803.411.371.241.832.10
FA hydroxy(7:0)ME9176781.170.741.101.020.801.210.931.280.741.030.840.981.040.940.800.771.220.580.560.630.650.651.311.241.000.720.590.911.410.900.720.840.861.221.061.040.961.270.951.440.401.050.821.671.450.870.911.104.101.331.341.261.56
GalipineME9176951.140.991.080.770.921.000.851.130.980.871.010.930.800.750.860.991.070.760.760.921.090.890.951.000.930.850.800.991.060.940.950.830.971.091.090.991.021.040.980.831.131.050.981.180.800.980.981.054.131.060.981.011.12
SedoheptuloseME9177350.621.001.271.010.691.150.880.490.641.691.151.081.820.971.480.920.930.681.140.570.650.600.590.731.48NA0.430.711.140.550.891.070.641.111.151.000.691.010.431.410.591.020.371.880.710.591.110.613.631.531.612.001.87
SubaphyllinME9179141.210.760.741.570.610.961.320.720.921.900.680.831.191.033.150.500.780.911.140.580.841.130.800.730.860.790.440.741.181.010.861.520.670.691.150.820.940.900.681.100.970.680.840.831.070.840.730.653.971.211.471.371.54

Factors:

F1Sample source:Combination_1h | raw file name:COM_1h_1
F2Sample source:Combination_1h | raw file name:COM_1h_2
F3Sample source:Combination_1h | raw file name:COM_1h_3
F4Sample source:Combination_1h | raw file name:COM_1h_4
F5Sample source:Combination_3h | raw file name:COM_3h_1
F6Sample source:Combination_3h | raw file name:COM_3h_2
F7Sample source:Combination_3h | raw file name:COM_3h_3
F8Sample source:Combination_3h | raw file name:COM_3h_4
F9Sample source:Combination_6h | raw file name:COM_6h_1
F10Sample source:Combination_6h | raw file name:COM_6h_2
F11Sample source:Combination_6h | raw file name:COM_6h_3
F12Sample source:Combination_6h | raw file name:COM_6h_4
F13Sample source:Control_1h | raw file name:Control_1h_1
F14Sample source:Control_1h | raw file name:Control_1h_2
F15Sample source:Control_1h | raw file name:Control_1h_3
F16Sample source:Control_1h | raw file name:Control_1h_4
F17Sample source:Control_3h | raw file name:Control_3h_1
F18Sample source:Control_3h | raw file name:Control_3h_2
F19Sample source:Control_3h | raw file name:Control_3h_3
F20Sample source:Control_3h | raw file name:Control_3h_4
F21Sample source:Control_6h | raw file name:Control_6h_1
F22Sample source:Control_6h | raw file name:Control_6h_2
F23Sample source:Control_6h | raw file name:Control_6h_3
F24Sample source:Control_6h | raw file name:Control_6h_4
F25Sample source:Leu10-teixobactin_1h | raw file name:TX_1h_1
F26Sample source:Leu10-teixobactin_1h | raw file name:TX_1h_2
F27Sample source:Leu10-teixobactin_1h | raw file name:TX_1h_3
F28Sample source:Leu10-teixobactin_1h | raw file name:TX_1h_4
F29Sample source:Leu10-teixobactin_3h | raw file name:TX_3h_1
F30Sample source:Leu10-teixobactin_3h | raw file name:TX_3h_2
F31Sample source:Leu10-teixobactin_3h | raw file name:TX_3h_3
F32Sample source:Leu10-teixobactin_3h | raw file name:TX_3h_4
F33Sample source:Leu10-teixobactin_6h | raw file name:TX_6h_1
F34Sample source:Leu10-teixobactin_6h | raw file name:TX_6h_2
F35Sample source:Leu10-teixobactin_6h | raw file name:TX_6h_3
F36Sample source:Leu10-teixobactin_6h | raw file name:TX_6h_4
F37Sample source:Polymyxin B_1h | raw file name:PMB_1h_1
F38Sample source:Polymyxin B_1h | raw file name:PMB_1h_2
F39Sample source:Polymyxin B_1h | raw file name:PMB_1h_3
F40Sample source:Polymyxin B_1h | raw file name:PMB_1h_4
F41Sample source:Polymyxin B_3h | raw file name:PMB_3h_1
F42Sample source:Polymyxin B_3h | raw file name:PMB_3h_2
F43Sample source:Polymyxin B_3h | raw file name:PMB_3h_3
F44Sample source:Polymyxin B_3h | raw file name:PMB_3h_4
F45Sample source:Polymyxin B_6h | raw file name:PMB_6h_1
F46Sample source:Polymyxin B_6h | raw file name:PMB_6h_2
F47Sample source:Polymyxin B_6h | raw file name:PMB_6h_3
F48Sample source:Polymyxin B_6h | raw file name:PMB_6h_4
F49Sample source:Pooled QC | raw file name:QC_1
F50Sample source:Pooled QC | raw file name:QC_2
F51Sample source:Pooled QC | raw file name:QC_3
F52Sample source:Pooled QC | raw file name:QC_4
F53Sample source:Pooled QC | raw file name:QC_5
Data matrix
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