Clustering data with hclust algorithm for (Study ST001947)

(Analysis AN003169)
MetaboliteStructureF1F2F3F4F5F6F7F8F9F10F11F12F13F14F15F16F17F18F19F20F21F22F23F24F25F26F27F28F29F30F31F32F33F34F35F36F37F38F39F40F41F42F43F44F45F46F47F48F49F50F51F52F53F54F55F56F57F58F59F60F61F62F63F64F65F66F67F68F69F70F71F72F73F74F75F76F77F78F79F80F81F82F83F84F85F86F87F88F89F90F91F92F93F94F95F96F97F98F99F100F101F102F103F104F105F106F107F108F109F110F111F112F113F114F115F116F117F118F119F120F121F122F123F124F125F126F127F128F129F130F131F132F133F134F135F136F137F138F139F140F141F142F143F144F145F146F147F148F149F150F151F152F153F154F155F156F157F158F159F160F161F162F163F164F165F166F167F168F169F170F171F172F173F174F175F176F177F178F179F180F181F182F183F184F185F186F187F188F189F190F191F192F193F194F195F196F197F198F199F200F201F202F203F204F205F206F207F208F209F210F211F212F213F214F215F216F217F218F219F220F221F222F223F224F225F226F227F228F229F230F231F232F233F234F235F236F237F238F239F240F241F242F243F244F245F246F247F248F249F250F251F252F253F254F255F256F257F258F259F260F261F262F263F264F265
Chlorogenic acid1ME4490250.110.390.210.180.030.591.450.061.553.510.100.340.292.630.530.010.300.300.240.071.739.710.170.370.090.250.170.260.140.520.550.130.130.140.110.190.150.390.230.240.820.291.600.640.330.250.081.230.190.910.150.170.190.350.450.115.750.130.162.420.690.190.490.781.734.981.433.11NA0.092.970.211.950.241.080.262.380.050.100.330.060.260.342.370.262.142.310.280.080.390.080.433.173.720.090.570.333.220.190.133.430.331.780.260.130.360.570.180.460.170.260.010.130.270.300.261.270.230.380.3438.863.320.400.190.711.350.180.670.570.400.170.321.750.090.170.060.570.140.080.340.080.180.720.860.630.10NA0.030.490.451.360.211.590.950.260.150.090.120.460.990.450.080.250.930.310.840.241.300.140.121.270.020.390.161.113.410.210.230.070.120.381.400.150.410.070.110.120.133.620.430.381.018.090.240.430.400.331.530.150.614.710.1812.610.100.531.080.180.060.310.160.070.130.180.570.240.090.301.250.150.160.528.470.136.060.590.170.600.094.130.790.300.110.600.150.872.080.280.060.1915.390.240.220.450.210.060.510.180.060.050.08NA0.310.681.370.030.290.270.110.070.150.080.390.210.060.24
AsparagineME4489990.410.730.121.280.073.015.581.260.021.010.050.170.152.201.700.070.520.232.821.010.710.070.280.610.240.090.900.032.310.371.750.790.160.331.401.072.350.120.110.400.060.240.150.260.170.050.041.792.020.030.241.560.200.900.090.862.501.060.400.591.980.952.920.090.680.783.191.80NA1.610.402.290.520.210.120.070.820.090.960.112.210.620.790.981.280.025.150.142.230.222.181.570.070.100.021.880.040.300.262.232.460.030.250.232.510.193.480.990.020.020.372.890.800.402.100.140.270.041.372.972.160.100.870.021.990.391.590.061.161.100.750.460.301.542.210.040.031.390.021.940.030.800.140.491.772.691.120.621.890.191.230.940.020.440.080.040.060.930.160.061.320.300.381.670.160.250.160.100.080.430.021.180.110.040.5538.480.070.080.001.703.080.050.040.250.050.170.360.070.180.370.111.242.620.011.751.980.053.480.250.111.120.443.170.201.111.030.290.211.540.910.020.950.260.090.010.650.350.030.160.040.930.110.061.063.540.083.712.272.700.110.460.030.130.840.330.480.040.310.251.051.390.090.080.030.790.070.090.040.030.1914.280.070.100.031.200.010.510.600.260.300.410.011.782.260.12
CyanoalanineME4489880.400.200.100.850.083.744.730.880.020.770.040.120.182.721.640.070.650.182.370.730.480.060.360.410.140.051.130.031.560.351.100.460.050.150.911.113.820.110.130.280.070.160.160.260.210.070.041.581.370.030.172.040.160.520.100.603.480.580.290.581.190.632.740.060.280.685.121.76NA1.030.372.110.380.170.080.060.570.140.220.081.360.550.210.840.740.027.600.122.070.093.381.350.060.110.001.090.060.200.223.781.930.040.190.143.090.182.500.720.010.010.243.690.740.423.580.140.200.022.493.271.340.080.850.012.010.370.860.040.430.500.680.160.180.941.000.020.050.990.012.560.050.330.100.231.435.560.630.711.610.120.610.970.010.240.050.060.060.910.120.051.310.380.211.090.120.230.160.050.080.250.010.890.210.060.3018.690.050.080.032.014.050.050.030.110.040.120.220.040.190.290.060.653.130.021.411.210.033.830.280.110.440.374.170.130.650.810.160.060.730.810.030.510.180.100.010.350.240.030.160.060.510.090.040.237.550.115.602.394.260.130.430.040.150.900.340.300.040.240.200.591.220.090.040.031.060.080.080.030.090.2140.980.080.040.030.680.010.570.330.280.340.020.001.442.340.04
Caftaric acidME4490241.090.020.372.037.101.660.290.320.630.390.350.770.440.160.7110.230.140.560.730.040.240.170.110.260.270.060.230.150.670.040.090.220.020.921.250.410.06NA0.170.070.040.180.070.04NA0.762.018.050.100.050.680.020.080.660.170.090.020.1921.8311.100.480.139.980.46NA0.360.990.01NA0.520.810.030.092.174.731.630.010.230.600.180.64NA0.67NA0.010.392.980.550.490.210.501.940.29NA0.948.760.010.140.010.301.100.011.020.210.300.520.270.070.360.190.382.801.160.741.670.430.790.4012.450.740.210.390.980.300.840.680.200.94NA0.260.410.520.010.780.243.632.760.050.07NANA0.450.410.640.971.730.420.490.512.750.910.550.179.790.060.700.050.980.110.130.320.290.130.26NA9.370.380.142.440.910.250.050.100.480.44NANANA0.020.97NA3.700.100.450.060.010.605.710.190.81NA0.59NA0.120.750.720.160.890.521.900.000.56NA0.170.171.180.200.060.290.370.390.480.300.10NA0.440.280.021.000.620.540.540.060.750.450.390.440.160.400.730.380.200.140.440.53NA0.33NANA0.650.030.08NA0.374.710.320.280.100.080.090.050.540.050.410.40NA0.67NA0.140.210.440.100.010.360.41
Chlorogenic acid 3ME4490430.280.110.160.090.250.030.170.73NA1.000.200.652.090.900.220.230.241.030.430.761.282.860.160.050.581.11NA0.210.381.111.380.850.260.560.860.370.470.870.350.391.710.370.762.180.890.230.370.930.850.220.680.220.491.220.460.594.360.530.140.194.480.070.131.040.922.11NA0.851.541.200.710.870.700.821.770.460.400.190.110.670.611.510.230.880.371.41NA1.48NA1.090.120.354.210.560.620.460.400.650.48NA0.340.274.160.660.51NA1.950.682.110.200.850.280.341.250.061.212.371.310.450.3913.2312.591.600.830.691.800.701.590.180.15NA1.572.260.321.200.48NA0.080.690.490.290.843.270.760.53NA0.030.340.220.306.551.720.690.270.29NA0.581.010.560.160.230.120.120.250.610.540.330.840.610.221.050.091.910.290.150.550.910.371.000.110.771.760.320.140.400.180.930.071.190.500.511.680.800.193.751.070.325.010.940.490.230.831.480.63NA4.970.450.081.480.290.160.060.301.152.090.360.740.550.260.70NA7.590.760.050.190.83NA0.402.590.721.170.101.970.371.430.820.740.050.8113.600.770.021.560.560.170.020.280.16NA0.05NA0.130.202.02NA1.350.710.020.270.510.310.970.62NA0.16
Sinapic acidME4490180.542.090.890.730.470.750.660.940.230.620.580.840.421.360.850.520.240.501.720.170.240.270.371.260.330.372.440.650.440.680.880.150.330.340.580.290.960.310.440.270.340.530.301.400.470.571.800.800.370.450.300.380.950.380.880.184.930.470.510.350.560.830.580.310.930.260.320.50NA0.610.540.591.260.842.900.550.840.601.470.300.530.634.142.430.190.258.730.491.140.380.430.430.230.660.428.510.750.961.290.500.310.230.190.650.680.361.250.220.390.490.620.660.710.921.340.491.080.210.340.920.580.260.410.280.570.880.620.290.650.390.311.460.350.111.230.430.980.440.930.650.460.490.451.080.600.930.450.770.280.881.551.750.410.270.250.421.370.880.410.230.440.875.590.630.390.680.372.640.680.820.270.567.820.370.41NA0.220.200.430.701.180.440.140.549.775.610.510.420.350.690.300.339.010.340.870.420.470.620.180.540.990.610.540.390.410.51NA6.182.242.650.840.220.810.410.270.220.280.480.440.530.501.000.343.590.740.354.910.340.820.230.440.648.111.890.902.350.360.600.520.362.310.560.250.450.460.221.700.230.1410.83NA0.541.230.600.730.230.803.050.380.150.710.390.480.410.64
PhenethylamineME4489960.350.150.970.300.031.440.820.680.884.900.772.412.311.460.080.900.040.790.570.051.100.170.040.451.750.401.057.870.140.030.310.360.060.230.060.790.750.300.070.370.294.211.530.913.121.110.072.65NA1.201.700.650.080.051.090.110.030.033.190.115.423.140.050.440.720.262.470.54NA0.160.210.440.080.360.051.640.100.030.062.160.140.060.380.261.450.200.330.080.300.110.070.640.055.311.390.410.102.370.030.371.170.080.032.410.470.060.080.862.226.500.040.150.460.041.192.474.612.620.070.153.682.864.300.350.080.060.220.050.910.440.690.060.650.060.060.060.063.210.732.183.500.083.171.094.570.870.052.511.494.150.691.160.420.060.060.030.040.320.060.290.520.040.790.250.060.731.650.070.092.390.021.220.000.090.441.062.490.590.060.144.450.060.120.030.600.090.0912.430.060.392.901.020.250.275.014.710.060.111.163.401.020.161.871.210.080.440.040.040.280.060.071.500.234.251.721.700.910.050.910.630.062.300.331.000.170.310.100.413.121.723.670.090.870.220.740.363.670.110.100.121.110.273.250.362.840.080.140.150.120.020.191.590.071.490.190.170.040.020.240.130.020.011.230.570.35
trans-4-HydroxyprolineME4489930.971.780.821.5112.140.882.660.360.891.160.420.730.970.721.410.710.380.550.850.250.471.260.870.320.450.430.800.360.490.430.890.921.231.060.980.740.350.380.410.330.130.250.360.690.750.570.351.691.350.780.401.820.291.430.680.321.600.410.270.640.930.951.070.770.830.651.041.98NA0.770.850.400.712.670.331.571.190.920.760.810.910.730.620.290.450.310.671.150.482.160.690.703.430.530.460.640.370.500.380.220.710.521.501.030.801.120.930.880.550.480.910.310.832.091.000.690.870.5412.861.611.280.390.880.131.340.631.641.070.430.950.880.770.360.561.172.252.960.620.580.101.371.590.351.191.680.550.360.691.080.480.880.460.290.470.430.191.090.310.690.571.022.790.280.720.420.390.890.410.440.500.353.880.620.770.58NA0.380.334.431.920.881.380.380.350.301.250.321.151.410.780.711.970.490.160.860.980.361.021.031.131.580.621.071.221.051.360.850.449.561.190.330.440.484.480.560.750.550.621.430.370.830.580.570.941.490.311.291.041.240.290.590.340.270.950.820.550.500.520.390.360.500.880.610.280.440.420.750.670.172.48NA0.630.210.860.743.391.500.330.840.710.761.931.172.281.61
gamma-Aminobutyric acidME4489942.140.700.100.250.470.151.200.270.233.540.570.681.150.660.380.240.301.050.860.130.540.980.771.060.900.510.570.601.890.990.930.380.290.320.950.771.080.890.540.560.100.350.370.200.140.920.300.580.791.440.241.180.141.070.781.472.080.311.250.152.631.691.160.890.611.560.150.468.841.011.350.560.672.161.060.301.110.401.020.240.170.492.180.870.500.370.870.990.231.661.520.641.251.690.960.550.530.280.301.200.762.323.310.411.852.144.590.461.140.610.390.800.780.391.360.982.270.980.430.543.793.342.110.750.550.240.390.621.030.420.330.430.080.540.690.830.461.270.131.420.980.271.430.350.621.700.131.330.241.023.230.890.200.600.650.180.183.191.030.701.580.210.831.760.130.271.530.550.061.420.330.270.880.750.6920.920.320.530.470.891.790.300.630.170.090.640.191.041.891.751.081.500.210.332.021.120.262.380.511.021.320.317.390.170.733.500.220.210.330.191.220.360.440.110.080.391.210.210.191.880.482.570.182.942.750.290.920.502.821.241.541.240.130.310.540.830.840.110.070.990.210.290.410.910.871.640.190.600.661.020.200.240.331.630.170.040.380.571.411.100.480.161.070.790.22
Quinic acidME4490391.092.651.631.731.780.610.510.86NA0.150.570.630.460.210.782.041.694.411.740.450.231.331.071.840.360.830.161.400.930.390.010.671.81NA0.491.020.480.141.370.111.050.300.260.180.463.170.870.660.380.34NA0.901.960.150.590.100.031.682.010.640.530.660.110.271.571.130.290.070.430.451.070.812.302.075.840.691.121.470.660.000.030.781.751.380.000.170.030.900.12NA1.261.760.240.841.400.331.871.591.350.340.360.010.100.100.700.900.670.250.081.351.470.201.440.401.130.963.040.351.541.790.710.111.480.250.481.650.160.410.281.510.961.322.090.340.090.280.680.922.461.351.050.120.353.351.470.100.080.140.462.412.370.670.340.200.770.051.380.250.440.021.120.921.930.780.641.352.731.910.981.360.361.022.620.440.0816.250.171.250.370.405.000.580.020.700.911.460.200.400.321.510.061.703.163.910.730.120.300.020.350.670.380.890.092.592.840.052.030.940.530.350.041.750.263.020.550.780.110.250.130.330.213.510.011.940.455.680.560.510.370.671.231.841.691.030.652.080.651.020.380.102.561.840.080.510.290.331.060.390.000.07NA1.230.510.010.280.041.270.541.590.840.160.010.330.112.17
AllantoinME4490080.550.210.300.900.493.341.770.650.270.940.120.691.101.532.770.570.620.463.650.630.171.070.710.362.280.470.300.723.820.420.851.710.470.320.691.301.320.650.380.810.142.55NA0.160.560.290.171.120.490.050.250.510.272.150.310.551.900.180.502.032.380.772.510.310.133.173.190.84NA0.400.391.521.310.670.120.171.010.240.590.203.310.480.240.450.720.237.420.563.680.812.141.441.020.080.111.450.680.741.511.182.651.721.530.371.820.721.910.740.150.780.380.733.180.282.550.871.880.371.601.562.120.851.320.070.370.170.640.383.150.582.080.250.071.060.620.290.591.280.180.341.700.421.230.892.062.881.961.990.630.590.272.100.370.810.390.420.231.520.201.471.200.860.542.550.290.240.450.140.090.780.161.031.010.610.3711.350.260.320.011.281.600.120.190.430.240.070.451.841.060.340.270.723.800.112.901.070.222.840.520.241.311.912.970.162.620.970.420.540.571.410.230.551.510.390.160.550.780.150.440.180.980.770.180.824.010.210.580.562.310.730.600.500.140.710.370.250.060.410.670.900.440.670.720.220.650.590.190.450.230.496.140.740.250.260.570.060.280.470.960.270.570.060.573.060.91
LeucineME4489820.850.140.741.800.920.931.580.850.611.540.731.040.992.591.070.661.740.980.841.580.410.380.530.890.470.210.520.340.740.470.520.810.080.360.450.691.220.730.440.200.190.310.341.393.050.661.020.840.770.980.391.140.951.720.351.024.451.030.610.871.751.321.000.810.611.401.391.06NA0.691.420.331.351.641.040.410.440.730.290.721.370.990.692.740.490.125.281.350.320.600.281.070.511.450.081.140.431.230.801.291.560.391.150.961.310.871.892.140.270.180.931.411.920.951.420.830.950.260.641.336.882.022.350.211.750.681.910.570.330.440.590.350.270.870.770.340.451.980.141.830.450.790.740.650.913.270.561.12NA0.840.830.700.140.150.300.350.701.820.300.831.671.061.131.870.310.820.730.120.721.070.200.900.690.800.3616.450.270.050.321.091.540.270.560.340.590.340.410.380.450.920.460.443.650.511.100.820.334.212.210.750.141.120.201.150.632.240.580.150.510.890.730.531.260.910.350.361.170.850.710.410.101.980.120.501.370.463.530.761.681.460.950.660.711.101.072.980.560.920.660.681.000.270.260.502.040.590.880.230.470.820.830.630.220.730.480.390.980.380.531.62NA0.211.611.210.16
Linoleic acidME4490171.622.212.250.360.771.931.850.820.280.92NA1.85NA0.550.910.251.030.770.461.620.590.861.072.400.100.900.070.260.960.391.770.971.050.070.470.610.730.131.000.870.550.481.510.050.811.161.220.211.810.060.680.981.790.840.850.573.360.071.340.03NA0.091.69NANA1.501.080.30NA1.381.011.390.591.170.350.821.351.210.070.310.731.325.030.94NA0.810.311.290.360.570.831.11NA1.960.630.030.982.520.050.751.000.450.571.040.650.660.941.380.161.131.351.722.190.310.761.630.491.060.240.18NA0.621.000.790.660.680.901.480.871.170.601.680.901.241.830.510.290.571.181.111.06NA0.421.840.410.961.280.190.361.87NA0.050.891.060.771.602.410.881.400.060.420.891.081.930.941.421.210.281.272.101.080.420.361.700.9112.901.101.37NA0.311.570.160.081.302.820.381.690.171.130.520.201.070.301.511.021.110.370.840.710.89NA1.270.100.691.590.081.121.330.97NA1.101.220.411.29NA0.850.17NA0.760.371.231.671.870.850.720.670.960.381.151.480.921.050.761.001.670.220.311.971.180.570.150.661.370.350.460.641.180.60NANA2.801.081.630.381.310.671.320.240.52NA0.630.501.750.731.48
sn-Glycero-3-phosphateME4490031.320.871.390.570.311.972.740.740.211.340.241.190.210.851.300.391.381.400.741.790.941.221.212.191.811.880.260.282.531.171.651.160.980.841.050.921.780.990.540.580.861.220.830.440.491.330.470.231.511.110.740.711.941.080.900.501.250.650.960.330.211.271.300.410.230.821.020.30NA1.061.111.821.011.370.240.350.881.070.620.571.270.410.261.040.630.393.941.000.961.171.471.480.121.291.460.620.511.591.130.981.020.810.371.231.211.111.631.790.190.541.341.310.980.451.490.701.430.530.341.290.390.580.340.510.560.900.860.361.242.070.850.960.750.651.350.220.571.120.462.171.010.460.511.500.341.581.170.320.421.470.380.690.911.460.921.031.500.800.820.640.400.460.711.310.960.921.570.230.841.640.630.330.621.350.6220.290.840.750.320.291.730.480.231.790.890.731.200.210.631.681.011.341.311.290.351.730.250.890.261.470.201.162.030.541.450.640.980.211.180.841.031.120.460.500.160.300.880.320.810.900.921.620.331.061.070.710.600.711.281.500.310.710.800.761.510.620.471.281.261.021.050.480.980.690.411.420.880.520.420.120.350.701.180.401.280.761.310.361.370.281.420.701.930.910.78
RaffinoseME4490311.630.800.330.740.770.4111.003.820.981.340.220.090.290.500.141.430.750.460.780.721.000.170.600.821.983.150.470.321.140.780.580.420.220.392.370.510.841.511.000.350.190.550.410.640.380.420.621.250.821.590.090.610.580.910.480.140.881.801.040.150.410.630.060.865.360.340.640.78NA0.650.732.231.370.450.770.270.901.090.251.020.121.264.783.161.111.203.354.100.220.490.540.380.040.570.252.322.000.870.950.610.560.913.160.800.430.590.311.101.250.211.880.281.471.090.320.281.370.400.700.551.831.160.410.580.821.562.010.861.292.490.871.074.380.653.311.040.301.400.361.760.030.750.640.813.451.220.501.780.130.624.650.330.420.131.480.390.810.180.390.170.753.060.320.420.791.261.230.873.380.680.350.650.170.770.159.500.570.351.430.342.470.960.303.000.412.271.620.640.230.340.171.120.340.870.371.110.960.770.120.550.080.201.671.490.680.591.210.301.160.060.610.250.521.040.660.260.271.160.320.490.200.801.992.060.180.290.270.480.700.150.520.121.312.850.730.440.850.220.240.641.230.591.430.930.560.351.060.740.100.170.130.370.171.301.621.210.920.420.640.130.350.701.312.460.29
TuranoseME4490210.922.650.552.100.591.570.841.251.211.311.511.480.390.791.380.38NA1.570.450.900.390.410.781.962.031.510.222.011.060.370.410.960.741.211.141.56NA1.122.260.690.340.290.240.900.221.640.880.960.110.770.281.620.691.430.091.740.382.030.780.711.421.730.381.07NA0.270.560.74NA0.270.990.63NA0.411.761.550.411.031.010.880.871.11NANA0.800.993.290.480.921.270.941.480.930.301.561.170.841.550.84NA1.260.511.020.840.290.260.930.371.521.001.141.242.440.970.720.401.230.73NA1.931.191.261.990.440.381.192.390.841.020.630.681.040.610.271.571.080.420.820.641.480.861.680.661.830.781.420.750.360.242.620.580.671.050.610.91NA1.520.580.180.561.270.95NA1.290.250.341.241.610.301.770.631.180.260.750.75NA0.820.120.520.341.081.301.041.040.680.681.570.890.441.171.350.25NA0.850.750.831.111.43NA1.481.460.641.411.350.600.952.290.670.780.50NA0.251.240.411.760.201.051.350.4016.960.782.180.54NA0.450.141.11NA0.640.220.181.131.47NA0.221.110.340.970.770.331.261.420.680.321.010.480.931.07NA1.010.521.211.250.410.430.550.470.531.080.240.160.660.210.450.65
Maleic acidME4489850.122.440.880.270.870.071.571.660.630.051.240.321.801.800.690.101.110.052.30NA1.340.740.060.270.901.260.940.130.720.391.490.450.310.990.470.101.000.740.450.481.230.201.212.130.731.400.450.181.231.750.701.231.280.521.240.323.730.570.270.200.570.281.341.120.590.480.781.05NA0.680.930.510.710.030.260.171.671.502.410.750.500.731.720.940.862.560.311.071.430.890.291.560.971.650.770.840.160.321.100.890.290.390.420.281.161.350.320.911.611.210.351.020.780.610.531.531.610.800.080.640.490.120.441.80NA0.750.461.730.521.310.851.580.260.841.120.650.970.342.460.040.040.090.250.030.540.710.340.761.541.002.362.130.711.911.131.010.832.351.190.100.250.440.290.071.091.950.902.390.520.081.711.200.450.550.86NA1.061.33NA0.240.390.420.860.760.474.310.400.17NA0.791.140.270.331.340.070.360.880.780.100.560.910.480.100.590.710.275.590.970.862.122.611.990.350.951.081.220.741.190.842.200.530.050.610.581.300.611.700.590.170.570.331.523.371.401.971.301.250.060.300.532.010.561.171.650.900.590.860.982.314.6114.000.042.441.151.130.251.982.720.181.880.981.011.380.570.59
Nicotinic acidME4489830.940.100.701.421.23NA1.860.620.270.581.11NA1.291.231.340.520.91NA1.611.261.200.520.730.350.930.801.460.03NA1.101.661.431.020.991.360.240.160.661.12NA1.300.83NA1.530.272.360.030.581.090.590.531.610.041.480.810.442.800.400.470.920.430.751.510.040.38NA2.410.87NA0.311.112.091.61NA0.051.422.421.191.550.511.081.172.920.580.750.572.860.971.140.761.951.510.431.432.610.050.720.430.671.650.041.050.560.461.391.450.530.690.370.780.720.341.380.121.600.710.530.480.562.281.590.201.081.431.090.690.33NA1.161.490.850.420.990.210.230.821.270.110.581.150.461.540.930.741.221.250.681.361.340.341.451.050.951.070.720.580.460.090.990.291.700.490.062.661.850.621.190.170.811.340.710.370.421.190.74NA1.61NA0.141.82NA1.090.451.530.142.150.421.260.991.871.400.453.590.870.320.380.491.453.130.290.400.30NA1.572.050.380.420.381.081.711.010.350.431.210.610.85NA0.180.411.691.100.330.471.160.100.540.740.750.020.52NA1.121.141.391.100.590.960.080.692.480.410.070.720.850.76NA0.490.882.730.7711.150.85NA0.862.600.59NA1.450.790.880.871.091.951.740.07
Chlorogenic acid 2ME4490280.530.901.240.310.211.980.220.140.280.691.161.790.733.370.660.052.823.030.250.360.781.010.170.290.390.130.071.930.240.830.640.490.421.240.740.110.191.020.270.441.531.241.413.271.661.410.521.220.710.220.710.450.450.300.720.190.270.811.452.311.121.050.861.262.800.521.881.90NA0.824.271.024.440.893.102.660.460.021.050.520.130.120.610.711.421.170.591.850.340.990.141.792.930.810.930.501.054.010.310.334.610.050.301.240.440.092.510.301.591.170.190.050.100.670.340.722.400.681.232.971.921.801.460.721.311.860.160.260.202.871.060.175.010.040.310.320.050.580.280.980.092.100.862.370.310.690.150.180.560.251.180.632.681.920.530.660.250.170.910.620.340.190.620.290.452.532.321.100.850.401.640.221.060.140.473.400.100.590.010.110.532.030.031.910.140.350.940.990.921.862.092.634.840.191.312.882.000.610.161.540.390.831.370.040.230.551.050.042.360.220.180.850.983.811.030.912.280.370.280.630.264.290.203.090.070.640.190.530.380.720.630.602.540.311.172.530.720.200.170.443.280.292.011.030.220.050.690.150.180.360.070.640.052.430.490.320.540.410.350.500.120.440.510.351.22
AdenosineME4490202.680.470.051.420.721.770.820.130.514.020.250.431.020.720.420.391.510.131.500.961.200.220.611.681.121.010.230.250.580.821.260.481.000.250.080.770.210.741.190.090.140.390.371.770.460.581.530.980.201.050.571.780.401.531.261.086.921.340.791.460.762.041.060.810.410.201.070.78NA0.340.440.711.380.330.240.372.550.230.391.110.340.869.250.520.880.135.061.530.330.620.601.230.720.990.850.480.410.632.250.970.493.431.240.200.911.360.311.180.420.660.371.011.340.241.280.921.570.541.220.932.401.221.100.532.231.440.320.180.663.121.460.251.730.860.450.870.390.390.185.201.351.090.480.530.702.180.131.981.650.431.650.430.231.640.230.510.450.343.270.562.650.910.371.920.280.520.870.541.811.770.230.321.161.440.46NA1.970.520.900.361.020.550.470.410.341.221.110.782.241.760.330.740.680.541.170.510.700.771.460.720.870.234.090.181.221.361.131.640.440.821.640.340.811.090.730.391.900.120.531.310.682.070.435.390.871.000.410.091.690.310.540.441.060.200.541.210.580.970.290.470.690.120.500.740.470.790.520.070.030.640.690.520.371.142.220.380.350.823.410.540.310.281.911.460.83
LysineME4490100.661.030.773.521.041.224.901.440.281.480.431.080.591.171.020.520.920.513.031.030.640.370.370.340.350.350.290.290.710.440.510.640.620.270.770.330.570.560.370.470.160.570.270.681.940.560.460.971.050.230.710.810.421.250.420.733.040.970.700.691.711.241.210.430.750.923.051.76NA2.411.660.930.770.840.640.531.070.440.950.711.520.291.670.760.920.5011.131.130.630.531.131.390.310.820.761.900.410.860.821.600.630.761.230.481.941.182.472.210.430.320.653.120.960.481.340.650.550.390.520.672.700.840.930.370.820.391.710.750.580.940.560.380.671.311.560.430.450.800.481.830.390.500.710.440.726.111.120.561.230.440.880.780.470.660.840.210.581.590.530.571.621.330.501.080.760.800.430.470.460.790.390.520.630.521.42NA0.610.520.071.021.040.420.570.610.400.620.780.740.560.691.150.811.760.391.540.560.385.831.290.642.050.70NA0.812.482.980.850.260.941.080.540.560.741.350.420.510.940.680.380.810.701.270.521.784.920.336.450.511.480.710.910.550.520.870.782.060.520.890.865.221.450.240.470.341.880.370.500.440.340.350.390.370.400.300.600.270.550.330.560.520.430.361.130.990.35
CitrullineME4490060.841.290.563.721.090.642.682.210.271.140.410.830.592.110.880.440.930.749.742.391.020.410.270.620.180.540.430.170.500.460.540.280.420.321.020.410.590.570.480.260.150.290.051.071.030.660.471.951.340.460.401.000.633.280.390.701.820.540.700.441.210.782.120.700.710.712.161.74NA1.810.820.600.601.330.420.501.100.570.770.491.300.382.220.970.630.384.562.710.751.002.061.600.331.300.572.410.861.180.512.630.400.781.631.303.121.203.212.400.400.210.273.220.400.661.570.580.520.340.451.283.320.590.790.350.770.370.960.350.271.950.460.250.720.730.760.290.420.430.731.720.490.840.620.120.413.050.320.900.800.810.540.600.341.071.590.230.750.810.470.581.041.370.230.461.441.820.960.570.321.480.510.840.790.720.68NA0.600.470.070.651.030.650.780.650.572.041.140.320.870.620.700.772.770.620.910.590.383.940.771.241.840.900.370.916.951.400.820.221.341.100.321.000.300.930.450.941.241.700.310.800.640.820.880.555.350.231.710.611.060.940.390.560.390.650.730.990.540.820.863.381.850.250.320.303.980.190.770.440.450.310.610.500.460.280.460.170.670.230.530.580.520.281.461.350.35
OrnithineME4490050.881.540.786.271.210.532.861.460.341.120.350.890.481.920.770.480.810.825.082.670.910.390.411.020.230.580.340.220.510.460.490.370.710.481.340.560.700.550.570.310.310.240.220.751.290.580.521.660.900.350.561.110.753.490.190.951.070.640.500.480.720.931.240.430.640.541.701.77NA2.240.920.500.641.320.530.580.930.390.920.531.190.301.470.850.730.455.482.510.481.202.311.600.360.840.551.810.571.370.492.230.390.891.080.832.701.161.902.050.380.200.473.070.520.791.280.490.440.290.681.353.780.490.490.320.770.511.550.580.231.970.430.301.200.591.020.250.410.450.501.910.471.000.410.420.333.330.560.740.801.100.570.400.391.111.830.241.000.740.540.621.181.690.370.531.731.551.240.780.272.010.480.920.520.900.73NA0.550.530.090.761.240.680.690.700.460.951.180.350.640.770.740.675.940.662.290.480.552.890.441.072.270.602.963.104.791.641.090.221.450.760.331.050.292.500.420.750.861.270.350.600.680.900.830.663.890.272.040.550.930.930.340.520.380.750.791.040.500.820.962.861.010.450.380.293.160.300.620.530.180.440.110.940.580.220.390.160.970.350.590.630.620.341.591.020.48
beta-AlanineME4489900.700.570.610.500.320.952.481.780.723.480.450.410.620.881.060.791.490.541.270.600.640.681.770.920.701.730.870.381.350.832.131.020.860.580.810.941.661.531.021.240.220.410.500.660.460.420.790.641.060.660.640.900.670.730.490.863.160.660.670.201.731.891.400.740.750.960.631.16NA0.920.380.420.831.250.510.580.730.660.740.521.850.810.750.821.240.333.071.170.343.511.271.621.140.730.411.070.610.520.560.981.930.411.291.971.451.172.701.980.460.311.260.841.130.951.460.580.930.420.941.454.521.231.260.291.030.660.940.750.400.760.571.320.660.750.880.590.232.010.511.400.450.880.771.702.213.210.241.670.421.631.390.580.981.790.840.670.511.931.240.412.380.791.101.140.750.350.671.030.940.590.550.750.461.490.56NA0.400.400.230.702.930.630.590.520.530.271.061.400.620.800.591.320.960.661.491.240.851.970.941.040.630.5312.270.820.902.160.650.271.160.680.540.790.190.210.570.800.761.230.900.580.841.680.951.780.641.001.580.651.442.330.680.460.482.260.600.330.570.450.512.100.670.400.330.311.220.400.620.860.300.520.550.530.510.540.570.440.930.420.851.010.620.301.220.610.36
Galactaric acidME4490150.550.530.541.331.600.330.761.030.301.540.740.670.841.441.880.440.501.950.861.900.570.730.720.570.632.030.440.950.501.650.260.421.240.320.431.081.250.481.250.800.360.700.932.294.341.501.260.180.572.381.080.741.800.810.330.880.530.900.341.340.971.640.360.231.730.590.230.572.130.540.504.002.340.991.160.501.092.810.400.531.890.531.342.572.290.601.170.820.431.130.340.841.242.930.930.612.071.080.800.550.782.71NA0.621.130.920.920.921.041.330.520.460.570.890.550.820.800.970.090.122.310.960.410.620.090.121.010.420.760.821.110.620.260.500.610.771.200.300.820.861.110.170.750.700.220.760.661.040.981.211.370.862.020.361.08NA0.64NA0.821.190.461.860.601.591.450.681.081.121.310.370.590.850.390.190.58NA2.010.552.070.651.130.442.251.230.681.560.801.250.210.900.680.471.131.431.340.410.071.650.710.303.871.042.180.801.541.180.821.390.591.382.720.440.731.641.680.510.591.160.611.031.261.710.401.010.49NA0.620.490.770.340.552.050.370.851.280.960.740.490.341.128.841.540.640.620.640.840.630.830.310.841.610.700.390.591.000.630.600.920.931.640.510.930.510.670.40
EthanolamineME4489811.460.320.562.300.631.111.190.711.701.770.560.730.950.861.140.722.220.591.160.730.670.601.230.860.851.321.441.102.440.610.621.730.440.330.591.380.960.620.76NANA5.00NA0.765.910.930.601.440.411.360.960.920.891.340.820.992.890.630.820.830.922.130.810.660.771.221.560.91NA0.510.630.871.070.770.440.790.530.860.230.780.680.502.170.720.380.613.151.800.430.420.480.780.341.220.450.850.690.910.740.691.311.010.870.601.070.910.821.080.640.700.721.092.350.591.310.991.060.521.070.901.581.211.070.601.230.422.760.880.550.790.650.600.734.600.591.061.801.420.581.181.030.650.622.341.141.95NA0.820.401.890.840.640.650.720.571.090.660.890.820.971.080.85NA3.450.410.910.960.390.721.020.34NA1.310.850.615.520.470.440.151.111.520.420.480.550.830.380.730.900.690.900.680.833.130.861.160.840.342.810.860.851.020.98NA0.460.620.990.690.380.340.740.700.470.810.660.700.461.181.542.180.960.432.060.391.220.730.921.700.671.241.550.720.600.880.570.720.400.471.130.811.111.310.560.600.760.640.760.830.650.750.680.800.700.570.780.610.600.740.391.040.530.260.371.261.300.41
Pyruvic acidME4489781.520.890.530.551.031.390.920.280.880.650.320.330.730.380.402.221.460.860.271.151.020.380.740.991.141.860.611.022.701.650.640.890.420.441.460.731.141.510.770.270.220.500.471.390.470.930.561.130.800.800.651.950.640.961.931.880.521.930.740.830.921.470.750.571.040.621.550.90NA1.460.442.241.731.820.531.091.800.460.440.761.020.991.051.231.611.480.101.170.381.010.751.790.611.390.510.651.420.561.441.791.081.460.961.310.671.520.280.882.220.540.450.961.951.410.330.801.510.740.841.770.551.331.461.580.940.690.721.041.950.680.560.451.701.351.200.930.340.610.520.541.670.721.330.832.070.610.351.540.791.381.150.320.400.300.720.910.920.501.131.310.740.460.580.940.650.651.900.910.771.330.711.560.290.760.399.892.110.860.651.590.581.110.590.480.470.462.040.321.310.470.970.401.490.820.450.410.580.380.610.590.660.440.830.330.860.680.700.481.120.441.461.120.600.581.211.170.671.211.701.730.820.980.681.671.610.891.180.542.281.170.640.891.280.840.680.900.580.940.391.000.460.590.530.791.061.361.120.940.770.840.321.940.941.161.901.361.800.480.990.881.590.681.061.421.00
Dehydroascorbic acidME4490070.660.990.790.900.891.391.161.090.381.000.730.870.410.720.381.262.150.810.500.661.630.950.640.750.991.220.361.461.071.431.320.830.570.821.041.251.302.070.730.900.832.060.630.201.240.880.222.390.970.480.991.420.891.690.871.290.491.530.950.401.411.870.361.081.520.621.220.919.011.380.280.720.732.140.741.410.870.920.490.860.740.220.481.651.191.110.601.110.691.990.841.030.461.880.550.861.350.660.591.101.450.861.281.141.010.980.461.491.610.560.531.202.401.080.371.422.141.130.372.310.210.791.101.000.801.061.120.501.260.860.220.560.711.271.271.220.320.301.070.460.691.580.651.701.580.530.650.881.181.600.260.800.680.571.350.720.640.660.471.100.501.590.940.790.812.461.130.280.761.810.591.190.340.700.320.691.491.17NA3.030.691.470.400.550.770.672.320.381.170.452.470.722.460.980.631.601.960.481.181.040.330.660.300.960.620.330.860.201.850.511.490.770.231.241.240.670.461.101.221.290.520.711.291.640.840.450.470.621.690.471.370.871.421.960.751.090.891.290.930.290.320.421.021.440.950.381.200.650.720.490.250.481.160.880.720.572.290.360.281.370.641.490.860.520.37
GalactinolME4490262.351.160.460.891.280.422.971.900.441.110.320.180.821.820.491.731.710.302.850.560.550.510.571.321.050.960.451.051.030.830.410.990.450.531.642.310.790.801.740.240.360.450.511.080.370.500.491.900.581.900.341.100.542.400.340.120.732.681.960.410.770.090.061.030.860.481.260.31NA0.500.901.442.070.790.930.250.871.520.680.830.121.712.111.461.351.003.971.980.540.560.510.960.080.920.541.480.641.272.060.591.420.561.710.400.820.460.281.361.590.681.220.190.920.790.840.741.840.551.330.501.351.291.261.021.582.280.671.070.613.261.640.841.880.750.991.170.852.030.251.540.060.600.380.892.711.551.101.470.092.024.000.950.560.110.740.330.690.180.460.171.532.990.450.340.591.040.831.392.571.160.220.930.582.670.182.241.190.710.521.352.400.840.313.230.810.962.700.440.350.530.242.650.600.930.961.870.781.480.471.560.110.421.010.670.350.521.282.170.420.261.120.260.430.550.250.270.290.960.290.840.362.163.141.100.260.560.430.310.690.301.430.471.021.640.700.741.260.390.411.531.680.690.972.301.440.320.680.520.190.160.060.890.082.021.230.470.710.720.860.160.150.580.723.180.43
XylitolME449001NA1.19NA0.89NA1.760.76NA0.56NA1.26NA1.19NANANA0.932.770.380.841.641.16NANANA0.740.561.081.210.540.880.750.790.490.73NA0.650.490.810.581.052.080.890.55NA1.45NA0.760.701.770.81NA0.171.030.690.360.700.81NA0.971.16NA1.010.700.67NANA0.43NA4.51NA0.232.971.60NA1.052.51NA0.93NA0.23NA1.13NA0.790.491.991.281.160.231.101.000.621.330.950.941.10NANA0.821.130.501.310.671.190.64NANA1.090.87NA0.57NANA0.950.973.040.672.291.601.49NANA0.76NA0.650.581.010.530.73NA0.350.430.380.420.400.682.461.010.88NA1.040.910.831.401.36NANA1.381.491.61NA1.291.141.000.500.771.330.79NANANANA1.830.340.70NA0.48NA2.350.321.05NANA0.42NA0.91NA0.870.77NA1.020.610.96NA1.070.900.580.210.830.760.90NANA1.720.200.901.140.79NA0.441.11NANA1.34NA0.840.261.300.500.851.56NANA1.231.87NANANA0.871.76NA0.481.571.52NANANA0.371.551.090.820.390.840.830.320.90NANA1.012.043.970.490.61NANANA0.520.770.481.57NA0.580.410.840.92NA0.53NA1.280.290.491.930.980.65
alpha-TocopherolME4490270.680.241.290.010.022.632.900.91NA0.84NA1.04NA0.691.35NA2.030.590.630.961.020.880.441.381.251.270.010.012.790.950.720.520.400.440.150.510.770.760.011.610.664.182.000.020.631.25NA0.511.151.070.730.431.911.360.832.110.690.560.64NANA2.320.620.73NA0.681.62NANA0.870.472.100.951.71NA0.020.320.910.440.451.790.020.431.080.510.191.850.472.442.610.412.19NA4.280.691.900.682.011.130.471.661.030.263.680.480.442.701.41NA0.910.431.331.88NA1.021.311.701.06NA1.10NA0.610.020.300.010.362.430.301.620.851.260.890.530.190.91NA0.450.930.501.391.10NA2.202.510.022.550.490.02NA0.500.030.850.590.540.850.891.530.520.482.04NA0.031.320.890.340.851.18NA1.012.820.96NA0.891.690.63NA0.860.97NA0.021.310.22NA0.741.090.183.05NA0.510.662.160.544.321.240.021.93NA2.630.021.31NA1.740.680.011.070.021.060.012.210.690.990.630.010.01NA0.010.600.371.340.800.750.53NA0.011.381.530.990.632.710.56NA0.431.780.842.211.520.322.240.950.670.410.010.890.630.020.750.820.350.35NANA0.733.410.010.371.291.600.010.570.012.260.161.110.420.66
SitosterolME4490301.251.151.450.01NA1.852.650.74NA1.41NA1.32NA0.620.89NA1.421.020.701.510.941.140.691.841.631.72NANA1.560.891.111.020.630.520.220.890.900.730.010.821.090.781.18NA0.431.40NA0.411.230.890.900.311.890.890.761.140.630.491.12NANA1.151.110.86NA0.730.78NANA0.630.831.800.461.100.010.030.431.640.840.551.65NA0.310.720.290.460.340.731.041.940.602.22NA1.581.271.060.421.770.700.441.170.400.231.610.660.651.871.46NA0.751.221.362.26NA1.110.951.200.83NA1.05NA0.32NA0.25NA0.300.910.411.581.371.001.410.820.161.38NA0.430.970.551.711.43NA0.881.73NA1.421.38NANA0.990.040.821.161.050.770.642.630.550.650.930.01NA1.030.520.501.231.89NA0.492.261.28NA0.791.501.050.080.910.58NANA1.570.24NA1.231.170.292.44NA0.591.121.381.081.071.22NA1.70NA1.55NA1.55NA1.551.68NA1.33NA1.94NA1.060.600.501.19NANANANA0.940.441.130.721.031.54NANA1.241.190.990.751.391.12NA1.041.810.421.360.890.271.891.050.760.50NA1.930.580.011.060.990.680.33NANA0.671.51NA0.431.271.38NA0.55NA1.110.431.270.420.98
StigmasterolME4490291.692.370.98NANA1.222.750.67NA0.89NA1.39NA2.302.13NA1.031.171.951.100.871.090.661.001.221.01NANA0.940.790.800.820.810.880.150.810.710.71NA0.590.850.370.56NA0.341.08NA0.441.450.590.960.651.200.800.520.832.050.320.86NANA0.691.740.81NA0.920.60NANA0.411.460.951.140.99NA0.030.791.220.650.481.11NA0.280.930.240.300.751.001.421.000.681.32NA1.221.350.891.111.671.360.440.790.380.260.970.641.162.571.10NA0.681.481.401.65NA1.560.731.150.73NA0.57NA0.49NA0.28NA0.380.950.571.391.310.921.421.380.211.28NA1.661.100.841.341.17NA1.041.29NA1.220.88NANA0.80NA1.841.170.920.470.661.410.510.420.70NANA0.581.170.800.911.35NA0.481.170.84NA0.881.161.51NA0.670.46NANA1.950.41NA1.321.232.031.90NA0.351.211.371.270.830.74NA1.63NA1.96NA0.91NA1.261.37NA1.21NA1.46NA0.651.230.430.99NANANANA0.970.380.750.580.884.35NANA0.910.801.000.721.010.87NA1.131.010.331.210.850.331.210.851.262.17NA1.400.42NA0.840.720.940.29NANA1.040.72NA0.370.790.99NA1.23NA0.930.531.220.410.79
Glucaric acidME4490141.120.40NA0.790.893.10NA0.680.772.730.160.730.680.721.080.22NA0.123.260.770.191.070.590.791.360.810.800.711.230.410.860.800.760.580.891.120.640.780.720.540.491.330.401.031.570.620.570.540.671.291.000.990.690.230.970.821.760.680.671.571.151.671.150.671.130.400.850.25NA0.710.542.353.111.351.031.060.571.050.600.771.600.64NA0.911.510.401.840.223.160.541.310.840.741.030.841.351.770.911.240.871.111.992.210.490.410.131.410.151.030.850.600.811.630.601.291.000.461.102.011.154.271.680.930.780.320.371.590.121.680.590.930.680.400.970.760.680.940.200.150.910.480.831.061.040.341.881.590.110.161.302.351.321.410.520.82NA0.651.180.442.231.690.830.122.530.661.090.920.830.701.110.520.901.010.450.62NA1.390.200.681.161.200.710.800.940.180.800.961.010.550.720.580.741.210.741.801.240.973.350.510.680.710.725.320.631.331.551.120.660.150.851.680.431.020.480.180.590.140.750.660.810.222.980.573.770.430.621.310.241.561.220.691.070.710.781.180.590.990.490.712.662.560.830.530.400.711.130.720.76NA0.711.611.630.600.361.020.730.430.381.130.740.651.070.115.000.51
cis-p-Coumaric acidME4490111.392.620.430.410.801.011.300.640.911.181.580.471.030.831.540.560.180.651.560.730.660.451.010.881.090.501.270.671.300.900.511.450.520.760.770.960.710.800.701.160.491.352.211.150.910.860.770.411.231.530.950.770.710.390.680.392.100.191.471.430.700.891.350.470.211.140.631.09NA0.141.731.201.721.090.221.033.000.860.641.241.092.590.440.612.190.260.921.041.150.690.521.020.954.141.421.060.900.761.500.760.421.260.340.361.460.530.700.661.001.090.250.950.750.680.770.971.111.220.450.220.510.761.131.040.550.460.270.791.890.550.870.331.490.420.240.291.000.790.482.271.550.301.160.560.540.851.691.410.560.811.182.210.660.640.570.230.830.750.861.431.080.760.521.380.660.891.460.550.450.880.650.55NA0.531.23NA2.651.490.601.191.320.691.271.110.552.490.700.640.470.932.490.732.100.611.830.420.371.190.471.022.631.462.040.490.770.510.600.440.912.460.410.440.740.510.550.460.472.840.891.091.590.930.361.060.601.410.680.661.700.270.641.160.960.490.612.371.003.833.380.971.740.311.450.720.970.660.550.840.530.923.301.790.860.910.510.420.653.820.790.440.651.620.600.751.52
GlycineME4490320.921.080.731.000.481.482.880.836.451.230.440.760.833.090.970.801.081.181.681.111.231.511.710.600.430.550.710.561.590.581.540.640.840.390.931.691.620.900.471.440.320.451.010.711.220.460.490.961.180.451.321.380.660.830.552.530.620.820.510.613.181.041.100.801.143.240.751.060.431.260.940.740.780.620.590.690.590.390.920.662.020.910.640.852.770.452.260.991.182.181.581.661.490.640.381.100.380.860.891.253.270.550.380.941.020.641.091.390.580.480.821.620.800.661.530.821.300.522.351.802.340.942.530.371.690.644.351.230.380.841.021.370.510.771.050.780.291.100.471.090.740.960.821.122.871.600.371.590.960.651.390.790.430.740.770.350.320.750.610.510.601.080.931.190.451.000.410.690.430.320.440.990.450.540.70NA0.340.640.310.842.770.900.530.560.240.300.951.340.310.560.810.550.680.282.301.700.521.431.120.711.351.042.400.690.862.310.560.331.810.860.460.940.410.310.351.070.680.690.510.441.031.090.890.952.950.752.151.151.560.731.310.850.500.700.680.470.651.190.841.050.940.490.340.471.380.390.540.570.380.951.180.650.610.560.740.441.720.360.630.940.600.301.020.780.42
GlutamineME4489980.700.270.781.600.580.861.311.000.561.100.800.761.671.031.080.411.650.700.541.511.290.740.570.940.441.191.220.241.251.372.001.180.300.671.541.191.971.950.650.590.540.300.541.371.060.510.421.382.090.571.301.591.192.140.652.062.850.860.280.421.280.851.711.291.650.951.323.37NA1.240.950.781.111.140.501.130.961.030.590.880.740.920.561.601.020.624.002.460.280.821.040.920.420.91NA0.800.830.780.603.050.900.581.010.971.060.960.801.571.470.090.630.650.751.360.651.531.460.610.701.081.971.542.700.321.251.350.680.720.550.780.430.391.020.710.720.400.310.700.240.910.281.211.180.290.931.430.231.311.020.530.820.690.310.990.561.060.711.751.010.540.641.960.530.591.000.660.290.481.550.590.300.780.590.790.56NA0.610.88NA0.731.070.960.990.890.220.411.580.830.751.050.771.057.010.601.850.900.641.660.170.950.911.492.330.490.783.160.770.210.960.731.010.740.360.541.330.821.900.530.740.970.621.820.231.270.980.990.411.101.021.941.900.710.682.811.960.370.730.500.300.530.690.600.410.771.130.260.781.031.120.671.880.410.461.200.610.201.830.480.441.890.320.352.070.900.23
IsoleucineME4489840.930.100.851.240.690.821.280.910.601.880.700.961.132.111.340.861.320.890.821.180.360.480.580.770.530.241.180.220.680.440.620.79NA0.290.560.871.670.820.520.420.350.540.491.233.250.731.130.870.830.950.611.160.831.600.420.983.300.930.690.942.571.431.030.780.641.611.661.02NA0.621.030.391.611.551.000.590.280.770.190.871.551.430.663.140.490.126.591.120.400.960.330.960.681.38NA1.120.521.210.831.241.530.371.180.961.470.752.411.430.300.120.911.241.821.031.790.881.030.320.981.445.732.092.970.251.400.632.030.530.280.330.840.340.280.680.760.430.442.750.131.920.450.890.780.840.973.680.641.30NA0.980.940.960.140.150.290.410.602.660.310.801.800.741.752.260.350.760.68NA0.650.790.210.900.850.860.25NA0.280.710.321.131.950.301.020.630.570.220.520.490.630.790.400.304.430.461.290.820.424.442.060.700.121.111.751.290.652.640.450.170.360.830.790.521.540.970.380.371.040.790.760.420.092.110.251.151.710.752.650.981.721.591.000.790.721.021.001.440.680.720.731.110.780.620.300.651.660.730.730.360.570.881.370.770.190.750.480.570.980.310.621.43NA0.191.531.150.12
TyrosineME4490121.131.230.551.731.081.702.791.100.582.140.560.971.301.721.220.811.481.001.891.320.831.020.430.760.430.680.520.700.950.770.720.620.670.400.830.440.910.950.620.500.490.740.551.272.060.900.721.331.340.500.961.110.632.481.121.352.311.150.740.720.870.800.940.951.221.621.171.04NA1.101.121.080.971.440.920.980.840.720.910.730.921.340.880.930.870.642.530.770.960.791.011.360.441.130.801.170.651.550.921.180.850.851.871.081.411.041.972.070.840.550.921.901.150.981.441.101.090.930.690.971.172.810.780.680.790.602.110.850.771.260.640.720.751.011.380.770.490.530.621.420.610.712.160.791.240.710.880.980.891.442.460.900.620.741.080.650.641.210.840.681.540.941.551.552.390.880.770.720.730.870.490.820.520.621.09NA0.830.740.210.761.670.630.960.870.910.550.900.990.770.991.001.400.700.570.800.720.643.441.590.870.921.200.310.981.520.560.780.441.141.020.900.761.371.000.780.761.131.130.680.801.130.790.630.621.710.722.170.541.371.611.190.840.631.150.900.640.930.921.010.710.790.530.630.640.710.640.690.750.690.590.500.880.640.780.730.520.950.540.851.820.720.521.100.970.49
ValineME4489800.650.250.881.160.642.101.610.590.561.960.780.991.292.931.220.851.141.101.301.430.890.800.801.000.600.390.680.531.170.801.010.730.180.431.070.841.431.180.340.580.260.620.461.411.980.871.191.001.530.631.041.340.611.670.341.942.681.200.470.680.711.371.101.061.231.841.321.08NA0.841.050.691.121.480.920.760.670.880.521.061.631.150.632.311.140.265.201.610.940.810.871.180.621.230.311.200.641.411.031.062.120.441.331.271.900.701.961.040.890.221.261.051.311.061.871.051.420.541.211.860.732.411.130.441.420.761.600.910.490.390.600.920.600.791.350.730.410.580.271.640.290.701.481.021.340.870.381.32NA0.851.431.170.370.270.550.630.642.210.440.560.950.861.171.830.680.660.690.450.720.940.270.890.620.530.56NA0.310.650.191.002.790.921.960.330.370.420.870.881.360.970.681.013.340.261.191.130.563.141.370.590.561.280.350.801.001.690.650.311.030.911.060.620.790.760.750.461.270.800.760.690.551.900.391.691.361.522.350.882.041.291.190.610.801.601.051.000.720.740.681.650.920.550.480.531.600.410.770.490.640.871.060.160.620.980.730.471.000.550.461.530.210.271.551.360.27
SerineME4490330.760.740.771.130.591.402.080.84NA1.550.611.170.942.460.810.581.001.302.000.910.700.610.680.610.560.470.590.621.040.741.150.690.470.490.931.151.230.710.340.520.160.410.221.550.920.670.550.761.210.311.091.120.801.090.381.780.880.770.610.694.091.431.220.881.351.491.081.180.420.920.960.851.000.760.851.050.710.691.230.672.031.091.020.850.770.893.431.241.592.242.441.290.500.710.541.630.461.381.041.502.080.610.541.201.680.801.581.270.930.560.782.320.890.421.780.921.610.881.251.173.411.472.960.591.130.731.930.650.650.750.691.170.510.911.300.760.301.280.591.460.290.921.331.122.703.250.411.031.210.650.901.210.540.840.580.340.411.140.650.600.901.320.711.210.530.620.660.870.390.560.460.380.670.640.86NA0.450.460.430.692.390.390.440.600.410.550.980.700.430.740.850.841.870.553.431.110.841.331.860.861.081.315.140.591.361.940.920.371.620.960.321.170.440.380.311.290.830.790.780.480.781.440.461.391.651.242.700.701.430.971.280.800.981.170.730.870.980.730.811.221.730.340.590.481.700.200.620.520.340.451.160.300.640.910.620.200.540.430.791.050.270.391.290.670.35
HomoserineME4489910.520.640.991.451.121.451.361.370.871.100.770.860.791.621.940.680.390.911.890.650.880.560.640.880.430.861.130.250.841.140.940.620.100.640.990.661.130.860.790.750.450.600.361.461.200.591.210.600.740.630.900.800.911.240.291.381.020.550.501.122.100.921.140.841.550.541.591.67NA0.720.900.650.960.871.161.480.631.050.160.711.421.100.461.171.390.582.971.730.821.741.241.080.540.64NA1.500.640.940.661.191.020.540.570.721.552.122.631.060.950.200.860.680.431.294.070.430.990.541.091.292.660.931.200.281.180.681.360.560.570.840.690.780.510.661.690.740.341.140.421.040.321.460.610.601.262.171.291.480.921.390.920.741.090.711.230.300.621.800.560.741.402.840.690.941.010.820.360.811.190.670.520.980.660.770.88NA0.500.530.190.431.260.731.211.020.450.610.901.460.541.010.781.101.970.561.790.761.223.200.830.651.960.646.741.131.433.440.560.191.651.500.840.930.741.100.721.140.940.730.510.650.831.550.971.071.660.473.100.650.730.731.090.530.521.071.040.410.710.810.842.181.780.760.410.481.510.570.820.640.320.951.340.840.820.820.590.270.790.690.631.590.170.580.890.880.13
ThreonineME4489891.031.590.661.320.741.432.590.780.691.330.871.010.902.031.191.221.290.840.810.970.750.540.871.580.980.660.930.501.450.811.131.330.150.671.281.271.641.270.810.580.480.980.681.191.020.640.880.810.830.750.821.510.971.100.431.251.871.070.740.991.551.301.020.700.831.311.771.35NA0.941.161.351.231.051.370.640.811.160.420.711.791.390.581.611.040.703.721.040.901.120.710.880.781.350.131.220.591.351.171.111.520.540.740.891.230.841.361.120.670.191.021.181.561.241.320.781.170.431.201.612.271.101.910.261.060.881.090.470.750.460.840.540.690.630.900.430.531.390.331.130.421.050.671.311.561.870.582.000.771.170.490.990.590.340.660.680.935.040.600.820.901.361.101.210.510.800.830.510.831.000.311.020.730.770.64NA0.460.750.300.961.680.660.690.610.510.370.910.610.691.350.890.461.530.681.870.830.562.591.030.850.710.985.191.260.941.910.520.141.370.960.670.420.710.920.500.380.780.760.800.440.691.260.651.342.140.752.331.251.221.430.910.891.051.531.120.870.761.100.850.790.720.740.380.861.130.650.770.730.530.740.850.730.390.760.800.451.180.370.751.04NA0.371.621.450.24
Fumaric acidME4489870.791.981.830.790.410.602.781.130.930.411.291.371.160.641.530.500.440.250.810.401.582.030.681.740.571.100.620.420.690.680.560.531.060.580.690.610.840.660.930.682.790.701.261.091.650.910.570.600.600.831.320.730.891.050.940.691.330.540.370.450.782.131.560.900.961.240.330.51NA0.290.510.580.610.550.831.451.951.292.520.510.240.761.790.620.381.210.311.312.061.621.320.880.991.281.200.640.821.450.442.950.380.341.860.651.250.580.811.080.990.440.690.540.700.950.641.320.831.420.240.923.161.060.741.150.431.040.570.580.382.321.040.760.900.471.110.890.800.191.401.830.340.871.040.550.440.250.700.421.041.311.261.040.832.161.770.501.784.010.600.320.310.870.800.651.060.780.960.630.522.130.581.210.850.630.80NA1.770.801.030.990.381.160.621.680.832.001.531.070.661.582.090.460.260.870.650.531.080.930.460.550.660.500.170.921.320.512.560.611.192.382.330.950.380.360.650.980.471.340.520.990.901.530.661.071.360.410.621.710.691.050.680.800.850.401.770.673.400.761.051.050.881.100.961.630.570.571.081.420.522.973.391.091.550.700.561.281.100.520.560.771.911.000.770.420.64
3-Phosphoglyceric acidME4490040.591.050.600.431.620.993.221.411.170.900.470.470.850.551.860.540.821.190.540.831.060.570.860.941.641.710.360.330.331.381.220.830.451.900.822.021.941.380.761.290.581.150.970.461.601.171.410.240.471.971.300.410.641.520.521.450.651.010.350.841.621.620.520.590.870.680.381.02NA0.990.490.731.041.420.390.840.931.950.240.820.880.170.080.821.690.990.720.810.850.910.692.751.041.510.970.450.410.640.371.761.541.120.851.252.070.771.231.171.441.240.430.440.300.701.021.022.231.400.601.841.610.940.390.780.410.690.900.810.951.071.990.510.351.020.730.530.620.830.671.751.380.991.091.130.831.680.960.491.231.721.361.261.440.721.320.771.032.481.400.670.780.650.610.870.581.380.433.771.730.631.170.650.170.461.71NA1.720.840.230.381.790.951.882.630.410.721.060.800.431.001.391.320.450.741.520.971.113.030.890.972.631.391.350.640.310.940.270.140.710.940.750.620.381.430.670.420.681.010.762.601.220.880.681.650.290.571.180.950.570.320.821.751.241.750.872.660.970.921.181.042.050.380.310.370.750.691.060.750.150.400.421.832.460.690.480.751.300.380.600.690.970.750.230.490.62
Oxalic acidME4489790.960.691.131.211.540.221.460.951.171.031.240.991.040.581.680.321.171.200.280.880.610.510.751.091.881.030.420.850.470.260.501.030.960.750.321.250.53NA1.400.820.280.340.840.882.600.901.610.57NA0.600.371.051.101.731.701.250.860.950.681.461.390.770.741.011.230.410.871.48NA0.831.040.481.010.961.190.880.432.080.640.661.330.890.830.771.661.231.020.640.440.600.731.321.600.810.850.620.191.390.972.242.001.131.700.761.420.641.760.561.061.171.040.780.500.531.200.640.521.120.861.313.081.700.770.380.671.291.710.690.641.311.510.600.100.500.660.560.880.900.691.581.221.471.771.780.100.980.940.611.341.811.450.221.190.300.771.801.061.171.512.341.031.150.761.050.620.660.901.171.010.771.041.190.240.710.92NA1.270.26NA0.640.510.931.881.650.770.580.821.060.461.490.720.360.570.780.710.871.173.42NA1.051.830.571.421.040.891.590.840.490.771.051.690.281.050.471.250.371.181.340.402.891.221.510.451.790.380.321.600.370.532.370.881.160.620.330.971.120.600.751.081.001.221.220.700.500.890.690.790.994.370.93NA1.590.900.890.681.150.360.330.911.240.950.790.350.981.01
Malic acidME4490340.902.562.790.950.570.511.410.81NA1.031.551.621.090.880.650.570.482.600.590.501.061.180.681.360.531.080.550.770.690.700.600.600.590.720.750.780.730.670.910.550.900.511.201.372.301.101.470.300.591.680.950.551.600.820.610.690.930.920.600.350.424.170.701.410.670.650.360.691.460.300.860.740.941.081.251.790.871.022.351.320.480.992.471.710.801.150.301.960.671.200.480.950.611.520.920.770.741.930.600.830.590.460.711.190.781.770.531.012.240.580.961.210.511.150.570.930.951.690.240.791.291.650.441.460.640.980.710.961.071.490.551.850.790.611.51NA0.510.621.730.680.711.140.950.670.660.390.791.010.970.661.300.441.461.111.390.551.381.440.760.380.281.590.900.651.110.970.871.680.941.051.220.890.640.540.65NA1.411.310.930.760.670.971.591.370.801.521.090.530.391.311.490.540.380.970.510.461.350.610.441.050.730.580.881.180.890.901.490.511.750.841.720.880.581.041.351.260.811.520.561.171.141.441.570.730.530.800.740.660.511.080.681.240.871.091.751.091.341.521.171.201.551.500.901.440.720.781.221.160.741.231.010.961.241.060.861.101.120.630.921.341.231.410.880.350.77
trans-Aconitic acidME4490360.792.663.031.210.650.101.260.88NA1.100.941.400.491.460.280.990.121.270.540.250.810.99NA0.960.901.350.381.580.430.930.340.791.730.840.220.860.350.670.880.510.780.750.630.920.450.693.830.190.370.780.220.701.170.600.360.370.940.990.360.950.371.720.271.661.470.320.250.870.950.610.110.231.220.404.172.900.451.142.340.991.392.542.061.940.911.290.141.700.191.580.480.740.830.650.520.050.671.701.520.360.380.660.491.220.290.671.020.632.921.102.701.280.881.290.580.310.831.500.351.121.022.160.381.240.601.041.021.741.620.880.633.191.061.242.191.401.560.741.260.480.671.790.571.070.290.460.550.830.800.832.480.392.660.660.940.292.250.700.380.300.581.040.710.740.630.270.841.120.990.822.030.480.840.760.80NA0.720.751.721.400.412.011.090.990.791.700.900.210.750.600.610.490.901.510.410.422.700.740.241.200.590.371.291.440.491.461.950.651.970.610.760.850.681.432.131.130.751.420.630.371.231.371.910.840.531.050.750.210.380.940.440.680.861.291.532.190.641.491.120.951.241.591.260.480.510.731.681.260.200.820.560.990.632.281.211.670.671.190.751.100.612.040.770.440.73
Maltose2?ME4490231.131.53NA1.470.112.960.140.611.250.820.710.810.740.610.781.740.791.150.830.45NA0.920.921.421.050.810.311.601.131.110.761.010.780.930.520.660.780.490.850.580.400.790.690.281.501.46NA0.650.630.770.641.821.112.190.540.830.340.680.791.201.401.370.600.770.861.170.901.99NA0.481.191.462.490.811.421.731.620.181.191.151.700.69NA0.640.970.95NA0.732.351.210.811.210.671.291.181.351.001.270.151.031.381.980.29NA0.911.111.900.691.311.240.841.434.111.060.981.220.681.010.691.40NA1.251.571.080.350.881.261.211.880.92NA0.991.370.891.11NANA1.230.761.351.621.151.011.801.131.560.560.181.321.350.750.700.890.801.100.791.220.780.611.050.700.810.451.760.320.551.09NANA1.160.261.190.461.080.53NA1.570.780.550.621.650.740.32NA0.831.271.211.450.250.800.880.710.501.260.810.850.370.700.860.761.210.960.740.871.171.751.610.630.540.980.120.87NA1.340.900.750.660.451.360.940.541.100.524.680.850.690.510.310.490.520.850.290.520.811.181.470.950.510.760.951.351.162.070.190.921.850.601.050.750.741.821.620.980.880.950.581.010.891.150.660.700.491.041.480.47
Caffeic acidME4490161.230.171.100.751.621.171.980.891.230.920.640.691.381.121.150.750.851.131.411.001.010.681.251.570.990.980.980.971.401.170.990.800.750.951.061.841.151.000.880.890.530.770.271.601.781.000.540.860.672.891.170.871.310.991.180.850.710.541.501.190.740.811.290.650.890.881.140.28NA0.900.631.681.010.840.331.35NA1.440.891.190.320.210.511.320.230.341.110.401.450.890.961.281.170.241.471.401.361.200.421.380.931.370.870.451.420.690.590.931.321.390.571.041.120.970.711.231.401.100.820.810.990.871.201.040.690.820.870.990.140.611.640.870.230.560.510.621.130.600.980.351.460.431.521.051.041.201.351.111.201.281.582.150.751.120.760.561.060.841.081.421.140.930.914.140.791.131.970.900.721.560.330.950.280.590.892.02NANA0.450.320.250.931.221.310.67NA1.060.790.830.970.310.910.960.811.020.850.701.740.950.92NA1.290.520.820.750.930.450.470.461.210.851.181.350.890.871.070.960.531.511.391.541.300.782.081.171.530.630.631.400.970.941.711.221.381.170.231.290.330.360.702.810.790.200.811.581.190.730.790.400.632.072.790.930.730.780.521.260.161.420.870.701.030.921.111.08
Glyceric acidME4489861.151.830.510.610.860.760.570.181.040.550.560.560.401.350.423.020.661.090.560.780.460.511.010.671.091.631.001.241.301.720.742.910.521.340.640.360.720.980.640.400.641.250.811.430.630.621.240.350.920.730.420.800.760.700.731.290.740.572.151.680.371.440.831.750.640.391.070.89NA0.521.431.210.701.470.930.991.270.891.151.451.371.901.751.500.980.700.821.730.640.670.701.940.931.900.810.942.181.321.571.051.142.240.570.450.340.840.570.871.081.050.760.801.801.620.440.330.991.100.980.910.670.740.350.870.560.760.751.560.701.250.781.160.691.271.220.810.870.500.930.350.720.980.610.940.880.841.011.540.921.231.160.461.410.700.400.570.870.822.471.080.800.630.582.380.461.220.890.670.640.671.640.961.170.581.80NA1.910.790.680.471.161.011.620.590.541.741.250.500.910.471.141.060.561.230.320.761.560.720.731.390.610.540.910.481.400.741.030.970.810.581.441.100.940.670.811.220.640.520.880.541.350.820.711.080.971.120.510.391.001.200.441.291.400.690.671.160.591.651.391.532.480.722.220.720.572.371.590.830.950.880.641.520.501.032.460.711.361.821.021.111.061.290.852.011.45
AlloseME4490091.210.930.571.880.971.211.110.780.770.780.530.621.111.061.141.080.821.271.011.481.071.780.440.380.380.470.700.550.640.601.080.570.840.471.030.790.610.400.890.360.270.340.730.841.261.020.811.481.011.741.091.220.881.421.071.372.331.120.710.971.730.850.800.981.371.180.740.59NA1.870.750.931.850.930.711.211.740.390.730.771.170.771.811.631.070.863.551.120.901.030.811.270.800.840.951.541.010.700.990.961.180.980.920.531.221.031.410.751.300.960.681.021.271.110.901.041.160.580.821.251.591.341.470.981.071.170.920.820.971.400.740.500.861.151.240.920.720.800.761.040.411.041.021.541.151.300.801.180.911.101.310.950.800.870.840.530.600.640.880.481.390.930.402.651.021.010.670.720.941.140.90NA0.741.090.57NA0.770.671.840.801.300.930.640.610.481.021.511.141.001.350.631.342.840.442.231.261.261.381.760.700.881.061.560.740.900.970.870.571.000.671.000.840.970.791.111.370.800.690.421.181.031.550.792.371.700.720.800.521.030.891.411.40NA1.230.941.271.210.790.731.161.191.070.520.720.861.050.950.790.670.72NA0.280.651.071.110.820.560.450.520.860.690.781.010.820.96
MaltoseME4490221.171.301.241.921.321.061.161.180.870.720.811.191.251.150.710.810.980.730.680.950.972.160.451.200.680.980.460.630.670.750.820.900.970.600.780.720.860.920.940.760.800.620.960.821.870.971.351.351.300.550.870.790.931.320.811.040.880.731.460.520.890.970.671.110.911.020.571.51NA0.941.200.721.470.971.451.030.971.100.911.150.680.761.860.780.910.861.371.480.541.240.771.040.800.510.930.851.071.630.820.850.891.200.831.061.100.901.311.361.230.470.931.061.081.420.881.091.220.761.602.810.771.251.350.542.002.280.731.220.810.700.601.151.140.830.971.790.590.880.710.940.682.381.010.950.940.600.660.971.262.591.340.701.750.991.090.961.140.780.870.550.930.980.750.961.081.431.490.690.940.870.710.730.591.520.56NA0.910.960.472.041.202.860.710.970.890.571.670.840.790.980.851.261.111.101.271.050.830.930.691.110.730.740.731.022.150.710.900.590.840.521.130.990.771.001.130.990.930.670.830.930.862.160.950.531.171.070.650.660.621.421.251.230.671.151.610.380.830.650.660.970.511.010.880.741.130.480.770.690.560.560.480.800.860.970.870.661.100.370.611.411.041.701.040.850.48
Threonic acidME4489950.971.550.941.431.851.250.780.620.850.950.911.011.010.740.871.810.411.031.110.960.951.140.700.901.380.960.570.500.990.821.141.110.751.201.141.030.850.811.320.360.830.590.680.971.280.681.380.740.841.440.940.840.852.000.540.821.110.741.892.460.460.792.130.740.700.600.590.97NA0.751.330.881.861.001.071.221.681.321.150.750.930.871.091.490.870.701.091.320.900.890.770.790.860.871.131.171.210.781.470.540.550.800.850.610.790.990.690.881.040.611.041.041.171.310.660.680.960.742.030.831.380.750.740.840.941.801.001.020.791.400.550.940.910.901.161.201.890.800.921.060.680.990.970.820.560.480.650.850.882.280.980.881.342.070.600.831.351.541.120.780.681.301.001.680.911.661.131.011.561.050.740.741.060.800.68NA1.150.842.810.591.091.850.940.880.631.200.961.850.911.370.710.990.850.910.870.561.091.140.701.030.711.071.220.671.080.631.471.770.780.890.991.000.691.020.861.090.710.670.600.980.821.480.421.540.680.800.690.540.491.340.630.870.640.971.280.700.940.760.820.781.440.921.051.101.080.811.080.730.570.761.101.040.680.771.200.830.930.790.791.250.871.321.250.860.89
Glutamic acidME4490350.690.910.561.810.820.711.160.61NA1.490.961.131.121.200.841.22NA1.360.741.511.071.421.061.320.781.630.970.451.201.132.111.030.810.711.350.971.581.801.020.480.570.700.911.171.051.011.150.641.890.790.901.181.021.17NA1.241.580.670.640.610.750.190.870.800.940.861.151.810.631.201.051.061.031.811.551.431.010.800.941.130.761.031.021.740.880.891.081.790.710.951.220.710.440.92NA0.581.060.610.871.480.731.070.860.670.94NA0.571.261.040.600.960.921.001.480.531.050.950.631.040.871.241.041.070.591.241.210.540.940.460.960.361.301.350.660.810.730.620.840.630.980.630.980.550.751.891.07NA1.701.250.831.52NA0.881.380.710.800.611.501.260.490.991.640.710.821.421.030.701.041.660.870.600.610.471.000.61NA1.231.120.440.821.350.971.131.220.410.991.140.660.990.880.890.891.960.781.040.570.910.790.970.800.851.362.080.900.892.551.150.460.911.071.150.780.551.381.111.390.970.910.861.210.751.230.731.360.691.010.590.710.99NA1.330.641.082.252.110.390.961.030.711.651.321.100.550.800.820.760.670.941.120.770.680.470.781.090.850.481.201.171.290.821.130.811.520.310.80
Myo-inositolME4490410.961.520.861.340.961.291.470.45NA1.240.570.801.180.940.561.160.731.261.111.430.890.780.751.110.811.280.770.670.790.981.240.550.660.851.941.220.660.831.260.660.820.621.060.591.151.040.700.770.931.190.670.910.901.300.790.781.151.131.221.430.902.140.820.641.280.581.370.690.511.031.700.871.570.931.390.481.421.370.600.960.561.201.831.051.291.012.141.100.680.790.671.080.370.830.620.721.031.031.931.190.610.901.360.530.701.030.630.911.440.671.311.322.001.120.471.210.870.731.121.221.660.881.401.121.311.470.681.021.810.790.471.651.580.781.590.620.500.680.870.920.401.210.761.301.301.140.671.400.520.961.001.070.781.070.570.791.061.001.130.721.991.730.580.591.141.231.161.161.610.950.591.031.221.060.83NA1.700.650.981.081.090.800.890.750.641.011.210.650.800.680.691.121.490.810.640.960.810.931.020.850.570.891.310.610.581.171.070.690.460.680.890.900.701.410.981.110.361.200.830.890.501.180.701.971.120.830.590.620.881.200.760.861.181.751.161.500.631.090.750.991.891.930.650.710.550.701.350.861.160.660.501.110.760.891.830.861.240.641.150.871.100.551.451.460.62
Glucose 6-phosphateME4490190.830.850.701.180.861.361.330.931.140.860.701.000.910.981.510.840.710.960.631.390.741.060.630.871.091.010.330.711.040.700.900.690.870.961.010.951.051.200.941.720.651.061.400.872.221.011.320.530.770.721.051.011.361.930.581.450.761.210.680.681.181.040.940.700.961.070.971.01NA1.450.841.370.981.400.920.870.791.050.561.090.790.510.351.011.150.721.991.140.550.981.331.370.781.040.941.030.751.061.260.961.231.001.451.111.441.051.351.021.070.540.640.860.570.861.230.911.240.821.281.381.681.230.690.561.290.711.630.861.100.980.860.840.520.780.990.650.521.280.731.250.841.220.880.980.941.501.421.030.961.421.360.670.940.990.920.580.720.970.720.960.890.751.022.071.371.190.981.501.251.420.701.020.300.470.93NA1.090.760.321.371.891.051.161.510.610.621.371.240.501.071.441.832.520.591.331.560.921.620.651.251.410.972.111.011.320.811.140.460.910.900.670.860.891.000.910.801.370.790.990.830.971.560.641.351.111.121.350.821.340.520.880.901.051.581.150.660.920.731.011.790.660.800.640.380.900.520.800.730.320.760.331.171.130.900.980.670.900.401.040.680.711.000.711.150.55
Aspartic acidME4489921.020.961.200.870.790.961.911.100.861.261.051.111.000.940.980.860.860.771.170.770.930.821.161.861.381.211.210.601.171.031.181.410.691.000.910.970.971.180.780.850.890.960.850.811.100.901.430.851.141.290.780.750.981.160.781.221.140.771.060.780.761.021.100.950.890.841.450.90NA0.761.071.051.031.061.230.921.181.190.901.031.110.940.811.141.000.940.701.010.751.020.700.750.791.170.821.391.041.511.080.950.861.040.930.690.980.861.381.370.980.640.890.900.941.340.730.951.020.890.501.051.081.230.710.810.810.900.761.001.000.830.750.880.870.861.050.840.920.760.960.730.870.891.260.970.930.781.281.130.981.581.020.890.981.031.061.161.201.461.031.820.751.361.220.830.930.970.840.891.150.831.100.811.211.270.95NA0.941.49NA0.711.130.980.930.941.071.011.200.770.970.890.940.980.820.970.830.930.971.420.831.080.700.881.660.780.841.050.850.720.990.900.820.760.881.250.890.801.021.150.971.020.721.230.770.960.980.851.031.290.840.990.890.791.131.321.190.920.920.971.230.881.200.840.950.830.591.021.221.131.420.87NA1.210.970.901.130.971.240.950.801.051.051.041.351.150.98
RibitolME4490020.930.921.011.030.931.011.031.040.941.050.981.060.991.001.100.930.950.941.020.951.000.941.040.941.010.991.070.891.000.951.061.060.931.030.910.930.881.031.00NA1.030.991.050.901.171.061.021.011.051.040.941.031.141.100.991.270.991.011.041.010.990.931.051.000.921.011.091.061.020.901.000.931.060.990.940.931.020.890.991.001.051.010.931.051.081.06NA0.951.031.001.011.020.980.931.00NA1.081.060.951.021.000.980.960.900.950.991.070.970.971.050.980.960.901.030.940.980.990.920.950.980.981.010.981.071.001.021.001.080.941.040.971.101.031.001.061.030.930.981.030.951.010.92NA1.010.981.011.020.981.050.960.991.020.981.161.061.031.011.070.981.080.940.960.980.980.961.111.021.040.920.921.191.011.021.151.031.020.981.091.000.900.960.941.030.991.010.961.011.041.021.000.901.060.971.020.930.910.991.070.980.940.930.920.940.960.950.920.981.010.980.940.950.980.981.060.941.041.080.971.101.070.961.000.921.040.901.030.961.060.991.071.061.010.961.181.050.901.021.051.030.950.920.991.001.010.910.980.941.00NA0.95NA0.951.000.941.110.921.071.011.050.961.090.941.111.101.08
GlucosanME4490000.540.860.980.651.171.531.701.220.962.650.870.540.980.270.760.740.590.881.120.760.840.730.901.281.292.131.020.582.310.611.041.270.671.100.910.621.071.010.620.660.420.340.330.630.451.280.570.931.252.680.680.671.121.060.721.270.510.770.471.790.560.620.861.270.570.550.900.75NA1.140.950.691.921.630.542.030.650.550.850.851.420.200.560.690.931.04NA0.880.521.171.420.680.840.731.511.911.090.391.371.360.651.091.060.930.990.720.811.421.021.370.460.800.731.680.420.801.030.691.451.321.280.640.690.611.220.950.940.541.840.770.630.670.691.541.080.530.390.391.150.291.280.950.720.991.010.551.252.001.801.130.880.530.730.940.710.910.751.261.421.130.550.720.430.840.850.630.600.761.260.520.511.142.211.340.79NA2.090.640.460.612.070.871.000.710.481.111.700.782.871.051.261.560.661.560.450.880.620.470.501.451.640.701.091.780.421.230.740.932.010.980.931.351.090.851.181.520.721.531.081.330.940.821.301.161.790.291.200.841.381.030.680.720.931.421.041.420.731.521.350.951.540.411.140.570.821.051.171.011.251.060.671.371.100.871.160.541.330.921.530.770.611.451.431.600.83
Oxoglutaric acidME4489971.171.230.621.141.931.141.360.330.980.950.880.650.740.620.401.841.910.880.501.050.800.530.930.711.141.840.620.911.951.460.710.830.650.601.000.540.831.351.010.260.220.840.401.480.521.020.950.581.201.170.571.670.830.911.182.080.461.970.541.460.861.780.490.751.030.591.551.09NA1.390.611.322.391.671.021.220.840.800.721.211.431.661.391.081.461.190.191.270.671.220.951.150.821.260.860.710.710.651.671.481.161.380.771.480.531.060.330.781.600.820.831.761.601.100.280.751.600.800.771.530.741.041.060.900.580.771.461.291.850.670.460.870.951.691.540.920.530.720.530.490.991.311.081.251.850.730.552.220.911.252.210.310.790.400.840.851.110.311.091.211.031.020.671.110.670.771.371.280.951.470.911.090.291.030.65NA1.880.570.401.080.471.010.900.510.340.721.690.811.130.731.500.441.121.220.580.721.020.580.760.861.060.740.790.840.931.080.570.581.080.591.001.341.000.881.071.700.660.850.931.930.820.740.842.251.040.890.640.351.570.820.740.901.351.130.580.820.561.490.661.270.830.760.950.881.141.281.310.750.880.890.241.280.881.501.471.001.131.010.951.031.090.671.131.220.80
Citric acidME4490380.621.440.930.560.880.580.990.62NA1.320.391.000.971.040.500.570.471.032.660.641.151.040.660.770.640.810.520.790.660.720.820.880.830.980.640.880.680.830.520.850.781.141.210.642.251.041.420.461.511.180.600.510.730.830.611.221.870.81NA0.630.682.420.790.800.970.810.980.751.170.680.550.631.891.080.902.050.891.491.601.382.400.61NA2.170.901.521.610.770.651.440.741.410.690.650.550.780.900.900.881.011.080.881.080.720.761.140.851.131.591.130.581.161.071.050.590.970.881.400.730.911.140.930.301.000.540.661.101.240.770.660.630.761.060.871.220.540.870.991.110.530.710.710.821.121.260.870.720.900.610.551.520.741.040.590.660.611.112.621.640.610.820.910.693.400.820.710.772.220.991.091.210.680.740.781.06NA1.340.780.800.790.940.731.930.770.781.120.960.490.720.780.720.541.530.840.630.541.563.020.600.811.281.031.200.351.260.701.270.320.650.860.971.410.781.221.691.410.631.100.911.561.510.950.501.220.991.441.430.631.181.160.760.960.701.861.421.350.890.990.691.161.210.960.900.690.580.761.021.390.560.763.351.381.250.610.961.011.410.620.861.261.621.430.750.620.65
Galactonic acidME449013NA0.261.560.870.630.901.630.890.741.221.070.920.590.920.520.731.010.131.570.981.280.860.540.871.371.090.640.440.880.811.291.381.240.461.111.111.221.300.850.691.000.681.130.692.671.241.230.270.731.520.650.620.401.021.420.621.321.510.580.451.250.720.721.310.940.680.600.81NA0.830.670.552.042.510.531.220.690.890.891.161.030.881.041.541.511.220.511.900.511.670.500.900.711.190.580.351.160.370.990.720.500.791.081.450.811.541.400.982.090.430.830.400.780.380.640.980.361.361.141.501.901.690.760.951.111.880.440.500.900.680.350.640.690.481.650.970.84NA0.740.500.371.690.300.440.770.691.040.540.710.511.181.121.330.851.300.670.162.781.290.920.781.990.811.630.731.070.701.252.051.711.341.170.710.670.60NA1.141.720.931.181.121.811.281.110.451.021.480.461.341.351.260.241.460.560.570.651.982.110.840.540.970.760.670.671.170.621.180.291.710.833.170.520.391.141.700.560.301.480.831.551.161.810.811.220.830.911.261.290.371.950.730.771.260.491.770.821.340.601.091.532.830.081.511.180.840.391.360.510.511.280.450.791.301.110.741.341.410.770.371.580.351.431.110.320.73
FructoseME4490401.020.780.461.030.921.071.460.97NA0.720.871.040.790.850.500.720.702.271.202.002.462.570.690.450.750.810.490.660.630.651.030.321.210.680.750.951.200.690.470.360.270.400.390.621.240.440.540.882.050.330.571.201.091.591.251.461.100.671.020.880.571.490.640.731.001.370.521.320.751.611.090.433.020.701.060.861.201.091.011.110.880.721.501.931.170.692.441.970.550.740.980.930.640.700.571.122.000.901.140.751.500.441.230.650.480.771.330.940.910.561.481.112.191.090.330.680.900.500.791.161.370.850.810.330.901.031.390.841.131.100.652.211.380.821.411.240.561.210.831.290.490.860.591.912.170.690.351.781.010.521.120.340.610.850.870.260.720.672.000.550.751.030.953.211.691.121.671.111.500.720.710.801.500.950.391.020.590.650.720.591.221.690.500.630.661.273.060.561.050.600.591.573.590.820.950.812.461.181.460.840.340.760.870.721.150.900.820.401.080.531.121.710.780.862.311.721.621.811.290.740.321.041.162.800.831.420.660.890.560.811.030.470.950.741.380.580.550.490.380.330.431.580.680.660.680.380.860.650.980.760.130.370.451.090.670.731.270.531.101.170.430.901.891.020.67
Shikimic acidME4490370.751.641.561.020.970.931.221.02NA0.820.761.560.891.250.411.230.852.380.960.541.371.560.721.140.941.160.710.900.591.100.750.480.960.960.800.680.871.000.690.330.480.400.720.451.451.280.670.990.710.520.760.772.351.321.011.070.391.211.410.750.501.130.550.881.280.690.441.850.660.601.000.631.301.083.291.001.281.590.591.841.021.381.513.350.820.400.171.060.410.890.681.011.000.360.720.571.321.401.110.460.850.630.280.741.030.780.490.960.870.600.900.450.941.290.600.831.470.550.961.730.610.750.620.641.412.150.330.591.231.130.901.841.740.510.610.700.511.631.900.780.821.690.661.611.010.390.410.591.251.060.890.470.900.670.661.030.850.271.260.300.560.520.821.041.540.730.901.480.641.130.921.011.570.690.51NA0.810.951.080.451.771.750.971.050.841.880.840.740.950.890.711.273.151.820.690.641.140.440.870.950.381.090.541.461.160.550.810.851.830.562.030.950.312.091.451.030.700.591.090.771.153.011.311.850.473.050.510.490.221.760.981.151.601.591.861.641.210.760.480.452.441.310.620.780.410.320.951.120.650.380.370.610.671.460.691.031.230.631.111.390.491.891.190.461.01
SucroseME4490420.690.980.701.080.701.551.310.642.060.490.831.131.220.780.391.241.381.380.591.270.941.290.610.940.781.530.610.501.651.111.240.840.520.941.780.982.161.680.720.610.900.531.181.331.791.020.590.881.030.500.650.860.872.380.741.350.671.470.680.300.950.970.650.851.620.900.911.070.881.600.611.061.151.611.260.751.190.590.630.960.520.731.284.921.220.741.521.170.581.010.670.790.830.750.840.691.410.600.921.140.800.771.081.080.921.220.550.581.570.470.741.180.951.760.430.771.690.721.541.691.151.040.960.780.921.220.771.061.000.690.310.911.370.601.590.900.520.560.920.690.721.760.820.911.240.540.561.340.830.870.750.671.120.561.140.980.640.711.180.530.660.771.090.521.890.970.811.091.050.540.580.870.910.690.79NA1.550.751.131.031.711.200.510.540.501.131.190.820.730.811.411.015.350.510.860.641.040.950.800.840.881.291.040.590.870.670.950.501.350.740.810.760.670.592.161.100.941.170.531.060.681.000.583.690.760.940.640.510.771.491.470.511.592.511.090.790.660.710.450.880.900.870.650.780.780.650.920.960.811.230.310.561.110.971.241.061.730.850.991.280.720.630.951.200.75

Factors:

F1Pedigree:Ames 10248
F2Pedigree:Ames 12729
F3Pedigree:Ames 12731
F4Pedigree:Ames 12734
F5Pedigree:Ames 12735
F6Pedigree:Ames 19000
F7Pedigree:Ames 19016
F8Pedigree:Ames 19284
F9Pedigree:Ames 19288
F10Pedigree:Ames 19293
F11Pedigree:Ames 19308
F12Pedigree:Ames 19309
F13Pedigree:Ames 19313
F14Pedigree:Ames 19314
F15Pedigree:Ames 19316
F16Pedigree:Ames 19319
F17Pedigree:Ames 19323
F18Pedigree:Ames 19326
F19Pedigree:Ames 19328
F20Pedigree:Ames 19330
F21Pedigree:Ames 20140
F22Pedigree:Ames 20190
F23Pedigree:Ames 21793
F24Pedigree:Ames 21796
F25Pedigree:Ames 21797
F26Pedigree:Ames 21798
F27Pedigree:Ames 21799
F28Pedigree:Ames 21800
F29Pedigree:Ames 21801
F30Pedigree:Ames 21802
F31Pedigree:Ames 21803
F32Pedigree:Ames 21808
F33Pedigree:Ames 21809
F34Pedigree:Ames 21810
F35Pedigree:Ames 21814
F36Pedigree:Ames 21826
F37Pedigree:Ames 21828
F38Pedigree:Ames 21829
F39Pedigree:Ames 21830
F40Pedigree:Ames 21851
F41Pedigree:Ames 21852
F42Pedigree:Ames 21856
F43Pedigree:Ames 21860
F44Pedigree:Ames 22440
F45Pedigree:Ames 22443
F46Pedigree:Ames 22748
F47Pedigree:Ames 22754
F48Pedigree:Ames 22763
F49Pedigree:Ames 23405
F50Pedigree:Ames 23450
F51Pedigree:Ames 23503
F52Pedigree:Ames 24610
F53Pedigree:Ames 24734
F54Pedigree:Ames 24752
F55Pedigree:Ames 24989
F56Pedigree:Ames 26116
F57Pedigree:Ames 26604
F58Pedigree:Ames 26771
F59Pedigree:Ames 26808
F60Pedigree:Ames 27064
F61Pedigree:Ames 27065
F62Pedigree:Ames 27066
F63Pedigree:Ames 27067
F64Pedigree:Ames 27068
F65Pedigree:Ames 27069
F66Pedigree:Ames 27070
F67Pedigree:Ames 27071
F68Pedigree:Ames 27072
F69Pedigree:Ames 27074
F70Pedigree:Ames 27078
F71Pedigree:Ames 27079
F72Pedigree:Ames 27080
F73Pedigree:Ames 27081
F74Pedigree:Ames 27082
F75Pedigree:Ames 27085
F76Pedigree:Ames 27086
F77Pedigree:Ames 27087
F78Pedigree:Ames 27088
F79Pedigree:Ames 27089
F80Pedigree:Ames 27090
F81Pedigree:Ames 27091
F82Pedigree:Ames 27094
F83Pedigree:Ames 27095
F84Pedigree:Ames 27097
F85Pedigree:Ames 27100
F86Pedigree:Ames 27102
F87Pedigree:Ames 27104
F88Pedigree:Ames 27105
F89Pedigree:Ames 27106
F90Pedigree:Ames 27107
F91Pedigree:Ames 27108
F92Pedigree:Ames 27110
F93Pedigree:Ames 27111
F94Pedigree:Ames 27112
F95Pedigree:Ames 27114
F96Pedigree:Ames 27116
F97Pedigree:Ames 27118
F98Pedigree:Ames 27121
F99Pedigree:Ames 27124
F100Pedigree:Ames 27133
F101Pedigree:Ames 27134
F102Pedigree:Ames 27135
F103Pedigree:Ames 27136
F104Pedigree:Ames 27137
F105Pedigree:Ames 27138
F106Pedigree:Ames 27139
F107Pedigree:Ames 27140
F108Pedigree:Ames 27141
F109Pedigree:Ames 27142
F110Pedigree:Ames 27143
F111Pedigree:Ames 27144
F112Pedigree:Ames 27147
F113Pedigree:Ames 27148
F114Pedigree:Ames 27149
F115Pedigree:Ames 27150
F116Pedigree:Ames 27151
F117Pedigree:Ames 27152
F118Pedigree:Ames 27154
F119Pedigree:Ames 27155
F120Pedigree:Ames 27156
F121Pedigree:Ames 27158
F122Pedigree:Ames 27159
F123Pedigree:Ames 27160
F124Pedigree:Ames 27161
F125Pedigree:Ames 27162
F126Pedigree:Ames 27163
F127Pedigree:Ames 27164
F128Pedigree:Ames 27165
F129Pedigree:Ames 27166
F130Pedigree:Ames 27167
F131Pedigree:Ames 27168
F132Pedigree:Ames 27169
F133Pedigree:Ames 27170
F134Pedigree:Ames 27171
F135Pedigree:Ames 27172
F136Pedigree:Ames 27174
F137Pedigree:Ames 27175
F138Pedigree:Ames 27177
F139Pedigree:Ames 27178
F140Pedigree:Ames 27179
F141Pedigree:Ames 27180
F142Pedigree:Ames 27181
F143Pedigree:Ames 27182
F144Pedigree:Ames 27183
F145Pedigree:Ames 27184
F146Pedigree:Ames 27185
F147Pedigree:Ames 27189
F148Pedigree:Ames 27190
F149Pedigree:Ames 27193
F150Pedigree:Ames 27194
F151Pedigree:Ames 27196
F152Pedigree:Ames 27261
F153Pedigree:Ames 28184
F154Pedigree:Ames 28290
F155Pedigree:Ames 28939
F156Pedigree:Ames 3940
F157Pedigree:Ames 6081
F158Pedigree:Ames 8083
F159Pedigree:Ames 8235
F160Pedigree:Ames 8260
F161Pedigree:NSL 22893
F162Pedigree:NSL 22894
F163Pedigree:NSL 28966
F164Pedigree:NSL 30038
F165Pedigree:NSL 30053
F166Pedigree:NSL 30867
F167Pedigree:NSL 30894
F168Pedigree:NSL 30904
F169Pedigree:NSL 53094
F170Pedigree:NSL 65873
F171Pedigree:NSL 65874
F172Pedigree:NSL 81599
F173Pedigree:PI 257506
F174Pedigree:PI 257507
F175Pedigree:PI 406112
F176Pedigree:PI 506246
F177Pedigree:PI 506247
F178Pedigree:PI 506248
F179Pedigree:PI 506253
F180Pedigree:PI 506255
F181Pedigree:PI 517974
F182Pedigree:PI 520774
F183Pedigree:PI 524969
F184Pedigree:PI 531084
F185Pedigree:PI 531085
F186Pedigree:PI 540745
F187Pedigree:PI 543916
F188Pedigree:PI 550440
F189Pedigree:PI 550454
F190Pedigree:PI 550461
F191Pedigree:PI 550465
F192Pedigree:PI 550467
F193Pedigree:PI 550469
F194Pedigree:PI 550472
F195Pedigree:PI 550473
F196Pedigree:PI 550483
F197Pedigree:PI 550490
F198Pedigree:PI 550518
F199Pedigree:PI 550522
F200Pedigree:PI 550555
F201Pedigree:PI 550558
F202Pedigree:PI 550566
F203Pedigree:PI 558520
F204Pedigree:PI 558532
F205Pedigree:PI 564682
F206Pedigree:PI 573098
F207Pedigree:PI 583350
F208Pedigree:PI 583351
F209Pedigree:PI 583352
F210Pedigree:PI 587124
F211Pedigree:PI 587125
F212Pedigree:PI 587128
F213Pedigree:PI 587129
F214Pedigree:PI 587130
F215Pedigree:PI 587131
F216Pedigree:PI 587136
F217Pedigree:PI 587137
F218Pedigree:PI 587138
F219Pedigree:PI 587139
F220Pedigree:PI 587140
F221Pedigree:PI 587141
F222Pedigree:PI 587142
F223Pedigree:PI 587143
F224Pedigree:PI 587147
F225Pedigree:PI 587148
F226Pedigree:PI 587149
F227Pedigree:PI 587150
F228Pedigree:PI 587151
F229Pedigree:PI 587152
F230Pedigree:PI 587154
F231Pedigree:PI 592734
F232Pedigree:PI 594047
F233Pedigree:PI 594048
F234Pedigree:PI 595542
F235Pedigree:PI 595550
F236Pedigree:PI 595561
F237Pedigree:PI 597927
F238Pedigree:PI 606329
F239Pedigree:PI 606330
F240Pedigree:PI 606768
F241Pedigree:PI 607521
F242Pedigree:PI 608765
F243Pedigree:PI 608766
F244Pedigree:PI 608767
F245Pedigree:PI 608774
F246Pedigree:PI 620767
F247Pedigree:PI 620773
F248Pedigree:PI 620774
F249Pedigree:PI 620784
F250Pedigree:PI 620785
F251Pedigree:PI 620795
F252Pedigree:PI 620797
F253Pedigree:PI 620828
F254Pedigree:PI 620837
F255Pedigree:PI 620842
F256Pedigree:PI 620846
F257Pedigree:PI 620851
F258Pedigree:PI 620856
F259Pedigree:PI 620859
F260Pedigree:PI 620860
F261Pedigree:PI 628485
F262Pedigree:PI 628503
F263Pedigree:PI 628507
F264Pedigree:PI 628514
F265Pedigree:PI 629124
Data matrix
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