Clustering data with hclust algorithm for Metabolomics-based profiling of the mode of action of Pathogen Box compounds in Trypanosoma brucei (part-II) (Study ST001275)

Reversed phase UNSPECIFIED ION MODE (Analysis AN002116)
MetaboliteStructureF1F2F3F4F5F6F7F8F9F10F11F12F13F14F15F16F17F18F19
N-palmitoyl threonineME3000010.030.430.040.040.050.410.860.110.130.120.040.030.030.060.0313.730.092.340.04
[SP amino,trihydroxy(20:0)] 2S-amino-5S-acetoxy-3R,4R,14R-trihydroxyeicos-6E-enoic acidME299952NA0.220.020.020.010.180.430.050.070.05NANANANANA7.900.051.36NA
N-eicosanoyl-ethanolamineME2999990.451.150.400.370.680.861.380.480.700.990.510.430.410.460.366.630.601.320.48
[PR] (-)-CarvoneME2999120.601.020.690.580.560.881.060.730.850.710.700.640.540.810.555.200.921.210.56
[FA (18:0)] N-(9Z-octadecenoyl)-ethanolamineME3000800.631.280.650.690.550.841.050.520.820.680.450.580.440.680.395.920.821.190.50
N-(11Z-eicosaenoyl)-ethanolamineME2999830.521.610.500.520.561.111.160.581.000.900.290.540.650.390.335.900.720.990.32
N-(11Z,14Z-eicosadienoyl)-ethanolamineME2999820.501.960.650.601.091.261.400.620.891.220.451.010.700.440.423.071.031.110.40
N-stearoyl valineME3000031.591.690.370.260.830.650.950.671.000.930.660.800.440.760.774.210.600.890.69
[SP dimethyl,amino(18:0/2:0)] 2S-dimethylaminooctadecane-1,3R-diolME2999540.640.541.050.792.180.840.630.740.673.120.430.450.471.480.510.571.831.270.51
Dehydroabietic acidME2999070.460.990.910.813.181.661.520.610.770.811.091.360.710.770.780.431.030.640.38
[PR] Tretinoin/All-Trans Retinoic AcidME2999130.501.390.980.711.802.541.600.480.390.681.702.040.850.560.650.211.180.690.27
1,9S,11R,15S-tetrahydroxy-13E-prostaeneME2999630.631.470.890.781.541.831.670.470.680.662.131.631.080.630.760.430.950.480.45
[FA (20:2)] hydroperoxy-eicosadienoic acidME2999350.541.650.980.701.561.941.440.470.580.851.722.011.140.540.620.361.180.550.34
[ST hydrox] 3alpha-hydroxy-5alpha-androstan-17-oneME2999200.412.080.940.581.731.821.600.410.430.760.741.571.450.830.660.301.640.660.25
4-8dimethylnonanoylcarnitineME2998250.741.851.240.781.051.621.670.410.801.011.010.991.190.530.540.921.000.890.61
Estradiol-17betaME2999250.861.211.340.741.181.331.090.810.751.310.891.590.830.860.490.691.521.060.52
[ST hydrox] 3alpha-hydroxy-5beta-androstan-17-oneME2999210.741.650.930.771.551.301.120.650.830.921.351.661.100.910.670.421.240.680.61
LysoPE(18:0)ME2998300.651.520.960.930.570.820.850.800.790.760.882.140.770.581.781.241.551.120.53
[LysoPC(14:0)] 1-tetradecanoyl-sn-glycero-3-phosphocholineME2998660.591.310.851.050.511.071.120.901.090.991.521.421.220.611.590.911.240.700.45
LysoPC(20:1)ME2998780.681.181.091.200.611.090.860.730.890.691.241.451.000.501.481.301.451.170.52
5S-HETE di-endoperoxideME2999651.071.040.820.380.860.880.910.780.920.841.692.301.861.180.830.451.030.790.76
PS(18:2(9Z,12Z)/0:0)ME3000480.780.741.071.240.691.241.131.031.090.911.451.211.410.821.360.550.761.050.67
PI(18:2)ME3000440.660.561.051.131.231.191.001.111.540.911.171.271.610.731.240.390.551.220.64
PI(22:4(7Z,10Z,13Z,16Z)/0:0)ME3000450.740.541.141.301.191.210.971.011.860.850.971.161.400.771.100.390.541.270.69
FA hydroxy(22:0)ME2999740.750.840.650.730.561.490.900.801.130.902.850.981.921.161.300.400.700.510.72
[SP amino,dimethyl(18:0)] 2-amino-14,16-dimethyloctadecan-3-olME2999500.771.070.870.760.831.350.971.221.160.931.480.751.391.071.260.720.950.710.76
6Z,9Z-Eicosadien-11-olME2999660.711.070.710.860.551.681.090.921.371.001.770.931.580.961.020.610.950.600.67
FA (22:0)ME2999720.710.980.720.800.531.611.030.921.310.962.150.991.741.001.150.480.830.590.66
PG(22:0/0:0)ME3000420.971.791.640.840.601.291.970.480.931.070.380.210.810.780.350.781.131.001.08
PE(P-34:1)ME2998510.601.221.010.820.600.811.541.751.991.350.450.590.500.640.710.991.420.880.61
Palmitoyl-CoAME2999320.781.020.991.101.221.721.431.351.070.930.670.800.781.360.910.450.891.010.46
N-(3-(15-methyl-hexadecanoyloxy)-13-methyl-tetradecanoyl)-L-serineME2999940.781.051.110.820.741.411.681.070.921.421.520.710.841.010.830.830.950.840.50
Prostaglandin A2ME2999000.871.071.181.300.781.261.311.081.441.500.730.640.621.110.520.670.921.150.76
[ST hydrox] 3beta-hydroxypregn-5-ene-20-oneME2999220.721.220.821.380.481.221.581.281.291.241.070.550.960.870.680.801.061.110.69
cholest-5,24-dien-3beta-ol 3-O-beta-D-glucopyranosideME2999690.810.972.120.790.651.031.091.121.261.070.711.030.791.050.690.931.320.700.60
N-(2-hydroxy-13Z-docosenoyl)-4E,6E-tetradecasphingadienine-1-phosphoethanolamineME2999850.721.161.530.970.711.441.071.001.081.260.670.480.570.72NA0.770.931.060.68
N-(2-hydroxy-docosanoyl)-pentadecasphing-4-enine-1-phosphoethanolamineME2999860.630.930.770.821.110.670.731.370.991.500.791.581.111.231.650.510.931.170.75
PC(36:4)ME3000180.650.930.550.801.480.590.591.820.891.760.581.331.281.090.900.771.001.470.80
PE(36:4)ME2997650.701.040.630.990.980.910.662.091.161.820.731.040.971.021.090.520.601.281.04
PC(P-34:3)ME3001011.421.281.551.211.471.090.441.271.351.100.580.750.300.370.950.660.511.411.31
LysoPC(24:0)ME2998851.391.381.340.871.770.850.650.940.580.830.440.450.500.840.631.241.141.391.56
PC(O-24:0)ME3000231.421.161.381.141.890.850.591.240.470.660.460.380.520.740.621.191.051.521.60
PC(O-22:4)ME3000221.721.111.461.021.900.680.620.700.580.640.520.590.561.080.761.090.851.381.54
LysoPC(22:0)ME2998821.551.191.401.051.640.690.670.710.680.660.490.600.560.940.721.301.201.411.33
SM(d32:2)ME3000691.621.221.601.251.420.860.710.790.720.640.370.470.491.000.541.071.141.481.39
N-(2-hydroxy-docosanoyl)-tetradecasphing-4-enine-1-phosphoethanolamineME2999871.241.041.361.211.271.180.600.530.830.580.400.460.400.660.741.191.551.511.35
PS(O-32:0)ME3000541.191.451.441.021.600.910.690.930.650.920.290.350.330.900.471.641.371.281.29
LysoPC(20:0)ME2998771.241.231.421.251.240.920.790.770.790.710.510.520.580.820.691.451.601.370.90
SM(d34:2)ME3000711.181.611.301.111.200.770.810.760.800.720.460.570.561.040.741.321.521.360.96
Cholesta-5,7-dien-3beta-olME2999241.271.391.111.011.070.750.861.030.900.890.480.550.581.070.821.161.441.351.13
N-(2-hydroxy-eicosanoyl)-pentadecasphing-4-enine-1-phosphoethanolamineME2999881.061.361.430.981.340.850.821.110.820.980.330.560.550.820.691.301.141.471.27
PC(P-38:6)ME2998481.111.411.261.021.331.010.800.860.900.870.360.510.611.030.811.111.171.281.30
O-Palmitoyl-R-carnitineME2999311.291.451.461.251.031.230.930.820.850.790.800.540.480.980.421.091.191.400.89
SM(d18:0/14:1(9Z)(OH))ME2998561.281.241.601.581.270.800.680.910.890.650.360.530.541.030.701.091.071.611.01
PS(O-34:2)ME3000560.860.951.451.441.001.080.921.651.120.870.530.640.670.670.860.790.871.611.12
[ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatrieneME2999600.640.872.031.541.061.610.701.590.880.980.520.570.440.720.491.090.971.161.11
Ganglioside GD3 (d18:1/16:0)ME2998410.951.541.050.841.150.930.961.100.841.160.330.420.390.660.662.091.321.550.91
Ganglioside GM3 (d18:1/16:0)ME2998420.881.641.130.841.261.040.871.150.831.340.400.410.370.720.721.501.421.300.99
SM(d36:1)ME2999030.810.871.290.891.211.340.901.320.831.560.800.660.740.810.900.840.891.031.25
PC(O-32:0)ME3000240.751.131.321.041.231.440.901.450.831.750.590.370.510.580.591.131.081.051.11
PC(32:0)ME2997260.741.191.440.911.151.350.901.340.891.530.660.460.560.610.671.131.181.041.11
PC(P-32:0)ME3000980.831.001.370.971.251.390.871.390.811.570.640.500.580.730.631.081.121.071.13
SM(d40:2)ME3000740.730.901.171.001.261.520.951.630.751.440.710.400.530.490.631.221.201.121.31
SM(d42:3)ME3000750.751.221.091.001.351.420.841.460.831.430.660.400.550.470.611.231.191.141.27
PC(30:0)ME3000120.981.351.290.921.070.930.901.170.971.000.580.600.670.950.841.131.400.861.20
PE(34:0)ME2997610.861.371.390.941.221.120.881.420.870.960.650.590.640.680.821.201.251.011.06
[PR] bacteriohopane-,32,33,34-triol-35-cyclitolguanineME2999460.811.391.381.041.471.340.871.390.721.010.420.330.420.520.611.231.221.321.38
SM(d18:2/22:1)ME3000670.901.451.150.981.331.320.811.340.760.920.580.390.580.550.611.241.521.081.22
SM(d38:2)ME3000730.691.471.130.891.181.220.811.340.841.200.630.400.530.510.631.511.461.281.19
PS(38:2)ME2998141.830.981.141.161.290.841.170.711.290.700.570.590.681.140.930.620.851.061.26
LysoPC(18:2)ME2999771.520.810.891.890.690.860.900.880.960.990.630.730.761.800.780.570.711.241.27
PC methyl(18:1)ME3000071.660.780.851.281.090.740.930.890.850.910.760.850.861.920.930.470.631.071.41
PS(O-18:0/22:1(11Z))ME3000521.450.620.781.051.080.810.770.731.260.691.091.011.131.921.320.400.501.031.34
PS(O-18:0/22:2(13Z,16Z))ME3000531.500.690.881.091.020.850.790.670.910.730.881.021.232.221.150.370.560.911.39
N-palmitoyl methionineME3000002.130.971.040.751.010.570.740.740.810.720.390.750.662.280.810.661.130.771.72
PS(O-34:1)ME3000551.881.041.000.981.470.800.880.741.030.960.260.270.322.120.350.850.920.821.84
SM(d36:0)ME2999021.550.780.860.902.261.070.611.090.541.040.570.340.421.270.530.690.751.022.49
[SP (16:0)] N-(hexadecanoyl)-sphinganine-1-phosphocholineME2999471.601.020.680.761.810.920.670.950.511.040.600.440.421.720.660.871.020.922.12
PG (32:0)ME3000401.520.540.950.761.680.750.601.020.720.990.901.071.021.400.980.520.630.792.11
SM(d32:0)ME2999011.611.020.500.691.440.670.770.810.710.920.680.670.621.950.921.031.360.831.55
PS(42:10)ME2998231.820.870.480.791.150.550.630.900.880.780.771.040.862.061.230.720.890.971.53
[PC(22:6/22:6)] 1,2-di-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholineME2998691.620.930.920.721.590.610.710.830.620.800.640.890.801.811.040.740.990.801.73
PC(42:9)ME2997491.550.730.810.681.540.620.720.970.810.910.710.930.841.711.060.730.950.821.77
PC(44:11)ME2997511.580.880.870.591.600.610.640.840.740.730.700.910.861.601.150.780.970.791.90
PC(42:10)ME2997451.520.910.880.821.410.680.820.980.720.950.650.830.821.821.000.700.910.881.53
PC(42:11)ME2998971.720.800.770.821.420.650.811.050.741.000.610.870.801.901.070.640.800.671.67
N-(11Z,14Z,17Z-eicosatrienoyl)-ethanolamineME2999811.421.050.501.042.030.811.080.941.181.150.710.660.721.240.800.590.920.821.12
TG(56:10)ME3000791.640.680.380.761.670.810.821.060.951.000.540.590.971.610.750.600.830.711.99
[PG hydrox] 1-(3-hydroxyphytanyl)-2-phytanyl-sn-glycero-3-phospho-(1^-sn-glycerol)ME2999431.230.720.660.721.590.940.981.391.241.220.580.620.791.190.660.821.080.701.68
PG(O-20:0/22:0)ME3000431.430.730.470.641.600.870.921.341.171.170.540.620.971.360.750.740.950.661.87
LPA(18:0e/0:0)ME3000840.891.771.301.320.750.691.211.210.960.980.480.500.641.560.770.580.981.900.53
[FA hydroxy(3:2/20:4)] N-(3-hydroxy-propyl)-5Z,8Z,11Z,14Z-eicosatetraenoyl amineME2999380.841.351.020.880.610.641.151.181.010.940.761.241.100.741.351.101.141.360.73
[PI(18:0)] 1-octadecanoyl-sn-glycero-3-phospho-(1^-myo-inositol)ME2999440.871.261.201.160.780.841.091.120.980.970.740.800.910.971.070.921.071.410.84
PS(18:0)ME3000470.801.301.181.220.660.911.001.030.990.770.930.860.880.801.081.161.181.620.74
PG(36:4)ME2997901.101.180.901.190.680.720.801.171.010.830.581.060.641.090.941.041.101.771.24
PE(O-20:0/0:0)ME3000301.070.981.051.471.080.850.880.910.850.900.850.981.130.931.010.800.911.480.92
LysoPC(O-16:1)ME2999780.951.011.161.900.831.020.991.070.920.880.640.700.751.090.710.961.091.500.82
[PE(16:1)] 1-(1Z-hexadecenyl)-sn-glycero-3-phosphoethanolamineME3000811.111.290.911.690.710.600.950.910.770.950.820.810.781.320.950.881.061.570.97
PE(16:2)ME3000280.951.411.031.550.730.900.980.960.780.860.800.750.771.060.861.041.211.590.80
[LysoPC(16:2)] 1-hexadecyl-sn-glycero-3-phosphocholineME2998570.681.651.211.520.711.240.880.860.890.800.720.700.740.540.701.421.621.500.56
PC(14:2)ME3000090.801.241.141.391.071.440.800.751.390.900.850.730.860.600.721.011.331.170.67
[SP] Sphinganine-1-phosphateME2999171.521.300.200.910.830.740.980.750.941.210.590.521.131.601.070.841.470.721.12
PS(O-40:4)ME3000641.521.260.730.691.070.770.860.930.810.810.420.730.741.111.041.171.520.921.67
N-(2R-methyl-3-hydroxy-ethyl)-16,16-dimethyl-5Z,8Z,11Z,14Z-docosatetraenoyl amineME2999931.131.170.941.021.070.720.851.040.900.930.560.710.651.190.921.651.121.141.15
PS(34:0)ME2998071.131.300.730.840.970.690.721.050.910.750.690.930.761.291.151.211.421.191.24
PS(O-16:0/22:1(11Z))ME3000501.281.490.690.850.970.610.731.060.991.000.620.780.801.331.121.131.380.891.11
PE(P-20:0/22:4(7Z,10Z,13Z,16Z))ME3000341.090.671.380.981.471.100.721.590.750.990.930.630.790.840.880.590.631.081.95
PC(P-36:2)ME2998361.000.681.561.031.001.080.831.500.961.370.830.790.650.711.040.580.641.141.66
PC(P-38:3)ME3001031.130.681.461.041.021.000.791.410.951.300.820.760.611.080.990.530.611.151.72
PC(P-38:4)ME3001041.120.851.391.041.201.020.901.380.870.950.830.840.710.970.960.680.701.081.53
PE(P-38:2)ME3001081.020.851.630.991.001.060.901.500.740.950.760.790.880.931.020.670.621.281.50
PE(P-36:4)ME2998530.860.650.951.061.181.300.821.760.901.640.830.670.800.810.840.540.691.191.60
PE(P-40:5)ME3000370.830.661.371.111.071.310.861.810.931.180.840.780.780.810.820.580.691.041.57
PS(O-36:1)ME3000581.020.581.211.001.431.160.721.590.751.460.800.740.910.851.000.500.610.991.70
PS(O-38:4)ME3000631.090.721.290.971.291.020.811.590.721.360.830.700.821.030.990.530.601.091.61
PS(O-36:2)ME3000590.930.671.261.071.291.050.761.550.841.330.850.750.920.901.010.580.641.111.55
PS(O-36:3)ME3000600.870.671.381.021.251.140.811.660.781.360.840.780.900.971.030.520.571.131.42
[SP] 1-deoxy-sphinganineME2999570.910.591.261.191.480.960.931.350.781.340.920.950.991.151.130.370.361.061.34
PE(P-38:0)ME3001071.240.570.981.001.750.870.651.240.761.140.980.901.021.150.860.500.571.001.85
PC(P-36:1)ME3001021.090.621.170.901.540.920.711.310.801.160.930.850.951.071.110.510.590.991.81
PE(P-38:1)ME3000351.090.621.130.921.520.840.711.230.831.080.890.961.091.081.280.550.650.991.56
PI(34:1)ME2997970.801.070.390.690.861.000.861.530.751.541.140.891.080.911.270.971.220.711.38
PI(34:2)ME2997980.960.680.550.761.160.850.811.520.831.410.890.981.071.041.400.790.950.861.56
PI(36:3)ME2997990.860.840.580.791.040.970.861.250.911.291.141.091.170.991.300.861.110.741.27
PE(34:2)ME3000290.810.920.671.030.671.280.951.850.961.550.920.730.580.811.040.820.971.021.55
PE(38:5)ME2997700.970.740.820.951.001.270.801.650.611.331.020.521.060.861.080.710.831.041.80
PE(38:6)ME2997710.900.820.770.950.761.230.771.870.591.470.930.820.970.901.120.750.941.101.54
PE(40:6)ME2997770.950.630.851.040.991.200.741.790.691.480.870.840.920.841.060.650.741.121.75
PC(30:2)ME3000130.831.000.591.021.041.130.941.790.881.220.940.840.900.861.050.831.060.931.30
PE(32:0)ME2997580.990.910.680.831.421.270.771.671.021.100.790.700.860.971.030.850.940.751.44
PE(46:6)ME2998501.030.700.930.951.060.940.721.570.741.051.190.821.140.771.180.670.661.181.86
PE(34:3)ME2997621.020.840.470.901.051.020.931.690.930.970.990.941.071.081.280.740.730.861.60
PE(40:7)ME2997781.000.650.860.880.921.060.791.590.821.090.910.951.201.061.210.750.720.871.75
PS(40:7)ME2998211.170.930.920.990.950.970.691.340.720.880.751.040.831.131.440.690.961.241.48
PS(34:1)ME2998080.880.990.970.930.871.190.861.600.930.830.880.890.880.761.220.971.051.071.36
PS(36:2)ME2998110.910.891.040.940.671.030.781.380.881.171.160.970.880.921.290.790.901.081.45
PS(38:4)ME2998160.980.881.141.031.051.090.691.560.941.230.750.750.790.941.060.770.831.171.42
PI(40:5)ME2998010.910.841.261.031.001.160.871.440.940.930.970.840.940.880.950.770.881.001.46
PS(36:1)ME2998100.830.791.090.990.951.250.821.700.841.011.020.890.960.861.230.720.781.091.38
PS(40:4)ME2998190.980.851.111.100.921.160.771.470.861.051.040.690.850.861.150.690.761.231.57
1-(14-methyl-pentadecanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycerolME2999610.840.761.120.811.141.010.741.270.811.291.111.041.090.971.240.770.720.801.53
PI(40:6)ME2998021.060.851.000.751.140.960.721.130.771.041.020.961.011.221.040.880.970.801.66
PC(44:8)ME2997551.140.840.851.011.110.870.651.330.701.270.780.850.991.150.920.740.851.211.78
PC(40:5)ME3000190.970.810.781.001.180.910.551.600.801.450.850.870.971.011.150.630.851.211.52
PC(44:7)ME2997541.030.680.860.951.120.900.741.310.881.310.920.941.111.011.320.610.761.101.52
PS(38:5)ME2998171.131.020.920.920.900.950.751.270.841.000.941.010.891.021.170.790.991.121.43
PE(42:6)ME2997831.071.020.920.821.100.890.771.230.831.200.900.970.810.891.290.900.930.941.52
PE(38:2)ME2997681.001.010.810.821.130.930.811.280.871.030.890.890.951.061.190.851.060.961.48
PC(38:5)ME2997371.050.990.901.001.050.950.731.190.811.140.830.880.921.111.110.871.080.921.43
PE(40:3)ME2997740.970.940.900.881.070.940.791.300.841.240.870.891.001.011.160.851.020.981.38
PC(40:6)ME2997411.000.950.940.781.070.820.661.540.831.260.840.810.921.121.120.771.121.061.43
PE(40:8)ME2997791.030.861.030.920.880.980.791.410.921.300.810.800.941.011.150.800.931.091.39
PE(42:5)ME2997821.040.710.950.951.070.920.811.290.841.240.830.930.991.080.990.841.031.071.45
PC(36:1)ME2997320.970.811.070.951.241.120.681.420.751.370.880.660.860.820.950.790.841.071.73
PE(38:1)ME2997671.060.760.920.891.251.010.721.270.831.290.860.770.891.011.020.770.970.961.70
PC(38:2)ME2997350.910.811.070.971.061.120.741.420.771.301.070.831.020.821.070.730.831.021.50
PE(44:5)ME2997870.870.940.891.000.921.050.771.470.861.360.970.790.960.861.070.820.981.021.47
PC(42:6)ME2997461.020.690.880.891.080.980.711.320.791.260.920.921.081.001.240.810.900.901.62
PC(38:3)ME2997360.940.780.990.921.181.040.761.440.721.360.910.850.950.861.170.740.830.971.63
PE(42:4)ME2997810.960.770.920.901.090.980.731.450.741.320.920.871.060.931.270.690.791.021.66
PE(44:6)ME2997881.030.870.940.861.091.000.661.410.711.270.970.820.920.931.170.881.030.951.54
PC(36:2)ME3000170.980.891.100.881.090.950.731.350.811.250.900.830.901.021.070.760.921.041.55
PS(40:6)ME2998201.030.881.030.841.140.930.661.280.751.090.910.851.041.061.210.800.891.011.61
PI(40:7)ME2998031.230.950.510.641.200.720.681.090.790.991.111.230.971.121.580.900.950.741.64
PE(38:7)ME2997721.161.080.660.801.040.940.871.340.820.950.740.741.011.491.150.930.880.871.58
PE(P-20:0)ME3000331.350.810.991.021.350.700.801.160.791.040.680.920.771.540.960.640.671.161.63
PC(42:7)ME2997471.420.810.750.811.370.740.691.070.741.020.810.940.991.491.220.700.900.941.51
PC(42:8)ME2997481.380.840.780.861.300.740.751.100.811.000.720.860.891.551.110.660.841.001.75
PI(42:8)ME2998051.320.860.670.891.330.760.791.090.850.810.800.910.991.271.250.760.870.921.78
PI(42:9)ME2998061.300.810.590.781.440.710.791.170.861.000.750.880.881.461.200.750.960.851.73
PC(44:10)ME2997501.340.980.860.801.340.760.711.070.830.990.670.860.831.501.090.821.040.991.42
PC(44:9)ME2997561.280.990.820.901.170.810.751.130.881.090.670.810.811.411.050.571.021.081.69
PS(P-42:6)ME3000661.571.120.690.931.050.710.890.870.890.950.660.900.851.471.020.841.080.881.45
PC(40:10)ME2998951.560.660.840.821.090.781.131.321.111.070.610.790.851.531.040.560.750.861.57
PC(34:4)ME2997301.361.020.600.861.150.781.001.091.241.240.660.800.821.431.030.751.050.701.24
PC(34:5)ME2997311.470.880.580.891.190.771.031.181.121.090.670.780.851.421.150.660.970.631.48
PS(O-40:6)ME3000651.490.800.591.091.230.890.911.020.971.100.580.810.881.541.120.670.790.951.40
PC(36:5)ME2998931.390.920.690.901.120.780.901.110.981.160.670.840.831.541.150.720.900.821.45
PC(40:9)ME2997431.380.860.910.901.210.740.931.091.001.050.640.860.841.531.150.620.840.951.39
PC(30:1)ME2997251.420.990.650.970.890.740.941.111.081.520.680.770.941.081.330.740.910.621.41
Lactosylceramide(d18ME2998431.490.920.690.831.260.810.740.930.881.090.710.881.171.591.490.720.790.731.50
PC(38:7)ME2998941.350.870.710.841.170.720.851.050.931.090.791.041.031.491.370.710.650.831.42
PC(38:8)ME2997391.190.730.530.820.920.821.101.111.111.110.941.211.281.311.490.720.760.691.14
PE(36:3)ME2997641.200.910.580.961.020.881.041.091.031.180.901.111.141.361.330.511.000.720.99
PC(32:3)ME2997281.360.880.530.951.130.770.961.021.031.220.770.921.101.391.440.630.860.661.23
PC(34:3)ME3000161.220.950.590.891.140.760.871.070.951.130.781.001.021.381.340.770.950.861.28
N-(2-hydroxy-tetracosanoyl)-tetradecasphing-4-enine-1-phosphoethanolamineME2999920.931.111.130.900.871.031.000.971.121.140.980.890.981.191.250.760.880.840.95
Choline phosphateME2999040.871.181.100.911.060.980.981.150.981.300.910.780.741.091.000.861.020.961.08
SM(d34:1)ME3000700.921.031.090.891.061.050.961.190.991.230.770.840.781.161.030.851.031.031.08
PE(38:4)ME2998990.980.820.770.950.850.841.031.281.091.190.841.131.101.091.390.831.050.761.02
PE(42:8)ME2997850.970.980.970.880.950.750.961.231.031.090.761.101.071.151.380.760.960.951.07
PS(36:4)ME2998121.011.230.790.900.720.841.021.381.011.150.660.810.771.280.950.951.261.151.11
PS(34:2)ME2998091.001.240.610.840.790.810.911.151.061.060.970.990.891.191.211.031.310.971.00
PS(38:6)ME2998181.111.160.710.960.790.800.931.171.001.040.860.960.891.370.990.921.231.121.04
PC(32:2)ME2997271.141.150.520.881.120.791.061.151.151.200.790.920.921.251.190.900.960.701.10
PC(32:1)ME2998921.161.150.790.921.100.860.851.150.951.310.750.820.860.871.180.950.940.841.44
PC(40:7)ME2997421.141.001.050.771.150.710.831.150.761.120.680.950.961.251.200.880.970.981.39
PC(34:2)ME3000150.961.150.720.901.110.910.911.200.991.160.780.850.851.141.001.001.190.961.18
PE(36:2)ME2998980.981.130.660.931.120.840.881.210.981.200.780.940.881.091.200.931.130.921.16
PC(36:3)ME2997331.051.020.750.861.080.880.801.190.871.180.810.930.941.171.160.881.120.971.31
PC(38:6)ME2997381.061.080.910.820.990.860.861.160.921.120.780.890.891.191.120.931.160.971.24
PE(36:1)ME2997631.061.080.760.931.150.800.801.070.921.190.790.810.861.241.080.941.150.901.36
PE(44:7)ME2997891.051.110.830.781.200.850.731.140.851.140.810.860.881.141.180.911.110.961.43
PE(42:7)ME2997841.161.030.840.800.970.750.911.040.920.970.861.080.871.441.260.891.110.841.21
PE(38:3)ME2997691.081.050.670.881.010.820.861.090.921.100.841.041.031.251.220.931.160.811.19
PE(40:5)ME2997761.171.000.710.880.980.800.871.080.931.110.820.930.901.271.230.891.090.841.42
PE(P-32:1)ME3001051.400.910.940.961.430.750.931.431.081.170.420.600.601.500.770.740.960.761.44
PA(38:5)ME2997221.190.920.990.791.180.990.711.400.941.050.730.770.911.370.980.870.930.931.31
PA(34:2)ME2997191.121.030.720.821.321.000.871.241.171.010.720.700.881.350.851.001.160.761.14
PA(36:3)ME2997201.180.900.810.791.391.020.781.311.031.100.740.770.881.321.000.821.070.841.17
PA(38:6)ME2997231.171.030.950.751.380.990.751.151.040.970.680.800.931.360.940.891.190.731.14
PE(36:5)ME2997661.140.890.850.741.390.900.791.370.971.110.700.550.981.281.290.870.970.771.29
PE(30:1)ME2997571.020.900.810.811.330.950.881.311.101.350.670.670.911.071.050.851.140.701.33
PE(32:1)ME2997591.011.030.780.721.471.060.791.471.051.260.680.670.871.140.890.951.060.811.21
TG(50:5)ME3000771.130.940.580.671.390.961.081.411.231.250.540.620.831.210.670.971.220.671.42
TG(54:6)ME3000781.231.030.510.711.250.901.011.221.171.010.610.790.881.580.741.031.260.701.20
PS(O-18:0)ME3000511.390.720.821.491.330.481.061.500.590.970.620.930.911.401.050.440.561.701.22
PC(14:1)ME3000081.241.070.881.430.970.580.890.980.580.910.740.990.911.421.100.710.871.671.13
LysoPE(18:1)ME2999791.370.940.781.271.210.410.871.110.480.960.640.970.931.581.160.640.761.681.35
[PE(O-18:2)] 1-octadecyl-sn-glycero-3-phosphoethanolamineME2999421.270.980.821.231.250.580.911.140.630.980.610.950.891.461.100.700.801.511.24
[ST (3:0)] (5Z,7E)-(3S)-3-azido-9,10-seco-5,7,10(19)-cholestatrien-25-olME2999581.130.931.171.051.310.900.840.990.910.970.680.880.841.581.080.351.130.681.24
[ST] cholest-7-en-3beta-olME2999231.211.041.261.181.140.770.891.040.990.970.620.870.751.331.090.461.081.041.17
PS(38:1)ME2998131.370.681.071.101.150.730.861.131.150.790.560.910.901.631.190.470.711.321.27
LysoPC(O-18:2)ME2998861.310.891.151.321.250.740.820.960.830.810.760.930.961.200.980.710.841.391.15
PC(40:2)ME2997401.420.801.161.121.420.820.801.011.010.970.730.810.771.271.050.590.681.271.09
PG(40:7)ME2997951.521.031.030.951.030.690.650.820.880.720.720.970.921.600.970.791.041.321.32
PS(40:8)ME2998221.271.100.860.990.810.770.841.180.940.910.751.020.871.501.260.810.921.330.97
[PR tetramethyl(4:0/16:1)] 3R,7R,11R,15-tetramethyl-2E-hexadecen-1-ol phosphateME2999451.231.251.081.380.640.851.020.970.891.030.770.930.831.301.050.470.921.321.07
N,N-Dimethylsphing-4-enineME2998891.241.041.031.240.980.830.920.850.970.910.810.960.891.441.040.670.951.101.06
[SP hydrox] 4-hydroxysphinganineME2999141.321.171.121.360.820.870.930.900.950.830.800.940.791.440.910.640.891.271.02
PC(22:1)ME3000111.311.121.271.151.180.830.780.740.810.630.840.910.870.861.181.251.041.330.86
LysoPC(24:1(15Z))ME2998461.371.031.271.041.480.730.780.830.790.790.710.860.800.961.171.030.981.171.11
PC(O-20:0)ME3000211.471.071.351.161.400.760.730.730.620.650.740.840.790.991.050.991.031.371.20
CholesterolsulfateME3000830.991.181.340.891.260.880.791.200.791.400.450.580.541.020.921.041.051.321.25
PC(P-34:2)ME3000260.990.981.531.081.321.000.881.321.031.260.590.650.710.700.560.820.991.271.28
PA(O-36:2)ME3000061.250.591.380.811.631.090.841.270.971.060.870.610.881.370.770.530.740.881.37
PS(O-36:0)ME3000571.130.791.110.961.420.940.741.310.820.980.740.730.871.181.100.710.791.211.47
PA(P-34:2)ME2998910.980.841.480.871.330.980.941.540.961.130.670.600.751.200.710.760.911.071.25
PE(O-42:6)ME3000320.890.761.540.951.441.010.891.251.051.230.750.790.891.060.860.670.751.051.14
PC(P-34:1)ME3001000.970.921.271.051.310.920.811.230.961.070.710.800.831.031.040.740.941.151.23
PE(P-40:4)ME3001101.090.831.310.941.330.910.841.211.021.220.730.750.761.140.780.740.881.081.40
Cer(d34:2))ME2999670.980.811.370.981.281.000.901.200.721.080.931.000.991.011.210.710.811.100.98
SM(d32:1)ME3000681.051.201.130.961.290.760.771.170.791.050.560.850.820.921.301.011.051.301.00
SM(d36:2)ME3000720.890.971.321.021.080.910.811.170.911.030.750.880.850.891.161.140.961.241.03
PG(40:4)ME2997920.990.891.581.190.861.040.831.130.981.080.830.820.801.160.770.740.951.311.06
PG(40:5)ME2997931.031.101.381.190.851.020.780.950.990.970.870.820.761.150.770.831.131.351.06
PS(38:3)ME2998151.151.120.991.180.920.840.761.040.930.910.660.810.781.031.270.851.001.501.22
PG(38:4)ME2997911.171.031.221.051.030.840.681.001.010.940.690.730.671.190.910.971.101.401.32
PG(40:6)ME2997941.291.061.170.971.000.830.650.920.840.880.780.930.781.320.940.981.091.201.34
PC(34:1)ME2997291.031.100.840.931.221.020.761.150.851.160.770.700.781.060.921.001.160.981.47
PC(P-36:3)ME2998371.210.971.110.851.161.010.811.241.001.020.650.600.751.160.880.781.101.221.42
PE(40:4)ME2997751.110.891.000.921.000.970.831.230.981.220.740.760.671.210.990.851.050.991.53
[ST (2:0)] (5Z,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatriene-3,25-diolME2999181.261.161.141.160.850.860.941.061.021.010.650.930.830.930.790.821.161.181.19
PS(O-38:2)ME3000611.191.041.380.941.040.790.921.211.070.880.740.800.770.880.880.851.201.101.26
PC(40:8)ME2998961.051.061.160.911.000.790.931.171.011.100.640.840.851.171.020.901.151.031.12
[ST (3:0)] cholest-5Z,7Z,24-trien-3beta-olME2999191.091.131.231.081.030.830.951.270.991.070.620.700.661.010.950.951.131.211.04
PC(P-38:5)ME2998381.091.091.311.001.410.810.771.120.951.050.570.560.531.170.751.031.141.181.33
PC(32:4)ME3000141.061.061.141.091.560.730.831.110.981.000.560.750.761.100.970.911.071.121.10
PE(P-36:1)ME2998521.050.941.221.061.430.820.781.060.971.080.680.750.761.170.900.831.111.141.15
PC(18:4(6Z,9Z,12Z,15Z)/P-16:0)ME2998471.121.111.371.071.250.810.871.031.060.990.540.690.671.200.820.911.111.101.13
PE(P-38:3)ME3000361.151.031.251.021.300.880.941.111.040.950.590.690.731.040.860.871.061.141.25
PC(P-34:0)ME3000991.031.001.151.021.580.960.701.110.751.130.700.630.740.900.870.941.011.161.51
PE(P-36:0)ME3001061.161.101.221.051.300.990.851.080.860.860.650.680.770.930.830.981.011.131.40
PG(40:8)ME2997961.220.950.831.521.100.840.910.821.391.390.820.780.961.241.020.520.651.080.83
PS(O-38:3)ME3000621.111.100.741.270.680.791.110.970.961.090.880.761.261.651.170.750.860.830.88
PS(22:1)ME3000491.210.871.021.140.921.050.781.061.180.840.830.880.821.311.450.641.020.790.97
[PR] Abietic acidME2999051.180.980.731.140.951.261.190.911.150.951.030.840.921.310.970.630.960.771.05
[SP amino,hydroxy(4:0/20:0)] 2S-amino-3R,4R,5S,14R-tetrahydroxyeicos-6E-enoic acidME2999511.170.770.921.260.770.991.121.161.300.941.070.640.611.591.040.671.200.650.90
[SP] 3-dehydrosphinganineME2999150.861.120.980.900.781.061.170.971.201.091.051.440.791.110.880.881.220.870.72
[ST hydroxy(6:2/3:0)] (5Z,7E)-(1S,2R,3R)-2-(6-hydroxyhexyl)-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triolME2999590.961.070.981.030.751.250.971.171.350.971.000.820.681.090.770.991.500.600.76
Tetradecanoic acidME2999340.991.080.930.960.561.211.001.071.420.981.080.950.831.230.690.961.320.800.91
FA hydroxy(18:1)]ME2999730.861.020.910.960.841.021.020.971.281.150.970.890.801.590.810.981.270.850.74
FA oxo(12:1)ME2999080.971.091.151.120.911.151.110.981.201.030.810.650.711.390.650.871.220.940.89
3-O-Sulfogalactosylceramide(d18ME2998400.870.991.430.981.000.981.161.081.490.950.760.900.711.370.830.650.900.800.78
PI(40:4)ME2998000.880.691.380.970.981.260.921.191.031.241.150.851.001.030.840.620.820.831.34
PA(36:2)ME2998900.970.821.340.711.011.310.931.381.111.090.960.730.991.270.770.760.910.781.13
PA(38:4)ME2997210.990.911.110.881.011.160.961.271.191.090.880.880.981.240.910.750.960.771.02
N-(11Z-eicosenoyl)-tetradecasphing-4-enine-1-phosphoethanolamineME2999840.720.691.171.470.951.090.981.550.931.040.890.910.990.801.180.620.761.451.02
N-(2-hydroxy-eicosanoyl)-tetradecasphing-4-enine-1-phosphoethanolamineME2999890.670.841.251.250.821.031.111.621.110.950.890.970.910.771.12NA0.731.170.82
N-(hexadecanoyl)-hexadecasphing-4-enine-1-phosphoethanolamineME2999980.720.890.841.130.900.931.081.291.071.441.021.061.051.011.280.640.841.170.78
Cer(d36:2)ME2998260.710.871.510.910.930.990.871.620.691.240.941.061.120.781.300.710.810.971.13
N-(Tetradecanoyl)-sphing-4-enineME2998880.810.851.170.941.091.100.971.540.871.430.830.811.030.721.380.710.870.891.05
PE(32:2)ME2997600.911.080.510.851.050.981.011.661.141.400.890.850.950.931.131.011.240.690.75
PC(28:0)ME2997241.020.961.300.941.030.650.911.341.091.680.550.700.800.951.200.770.980.631.31
PC(P-30:1)ME3000970.981.010.950.801.070.591.251.961.101.530.500.810.781.051.070.760.980.761.06
FA (20:0)ME2999260.911.091.351.061.431.060.990.830.890.940.570.660.691.600.620.861.340.870.99
Octadecanoic acidME2999300.931.010.960.671.451.280.880.850.760.760.730.920.781.550.851.031.390.651.34
SphinganineME2999330.801.001.020.851.451.310.901.070.660.660.670.830.671.790.740.671.540.501.64
[FA (18:3)] 6Z,9Z,12Z-octadecatrienoic acidME2999100.840.840.750.831.071.600.910.781.000.991.611.331.240.891.030.641.080.581.05
Hexadecanoic acidME2999280.730.800.790.681.421.300.800.750.730.771.261.451.121.391.100.881.170.641.24
HexadecasphinganineME2998600.850.820.910.771.431.410.690.760.820.721.131.370.991.261.150.531.480.481.35
PE(40:0)ME2997730.810.641.551.011.051.530.692.080.711.111.020.610.630.600.960.700.720.921.67
PE(O-36:0)ME3000310.860.582.050.971.311.070.671.830.791.110.900.400.580.780.740.550.571.131.78
Cholesta-3,5-dien-7-oneME2998580.910.701.380.831.661.090.741.830.961.380.540.500.680.630.570.690.991.011.89
[ST (20:5)] cholest-5-en-3beta-yl (5Z,8Z,11Z,14Z,17Z-eicosapentaenoate)ME2998720.900.700.950.761.941.210.611.650.681.530.600.460.750.470.700.990.970.822.19
N-(eicosanoyl)-tetradecasphing-4-enine-1-phosphoethanolamineME2999970.740.721.091.040.991.371.121.620.901.870.820.670.810.750.950.540.651.181.24
Sphingomyelin(d18:1/12:0)ME2998240.660.721.241.201.021.371.031.690.821.810.750.740.790.681.010.580.621.281.12
[SP (26:0)] N-(17Z-hexacosenoyl)-sphing-4-enine-1-phosphocholineME2999480.570.671.111.061.541.660.842.160.792.350.610.380.590.300.550.760.780.981.33
PC(o-36:0)ME3000960.840.511.481.031.651.230.731.790.622.000.690.540.740.560.780.590.540.961.73
Cer(d40:2)ME2999680.870.591.321.141.441.160.671.750.641.700.790.590.870.530.830.720.750.841.79
PC(38:0)ME2997340.750.571.500.931.281.080.681.780.681.870.950.680.960.570.960.670.590.881.69
[SP (24:0)] N-(15Z-tetracosenoyl)-sphing-4-enineME2998700.770.571.421.001.401.190.771.880.601.800.860.620.840.500.910.740.660.931.63
Cer(d41:1)ME3000820.700.711.320.941.291.280.871.900.761.980.680.550.670.550.710.820.820.941.43
Cer(d40:1)ME2998270.690.701.440.991.341.250.811.890.692.120.690.520.700.380.720.910.701.001.48
[SP (24:0)] N-(tetracosanoyl)-sphing-4-enineME2998710.720.661.230.921.311.270.821.910.792.210.730.510.750.410.750.800.770.971.51
PC(o-44:6)ME2998350.700.671.110.951.421.470.781.890.811.670.780.500.700.470.700.840.860.971.57
PC(o-22:0/20:4(8Z,11Z,14Z,17Z))ME2998340.760.611.121.031.591.350.711.860.801.800.760.600.830.440.710.720.681.041.67
PC(P-20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME3000250.750.671.151.021.541.320.671.850.731.730.770.520.730.510.810.730.821.041.69
PC(P-42:4)ME3000270.760.711.130.991.601.400.701.870.731.830.710.450.650.460.700.840.831.041.62
PIP(36:4)ME2998551.160.420.530.711.181.370.652.280.891.510.900.530.921.490.860.450.480.572.16
PI(42:10)ME2998041.200.510.600.531.141.210.722.030.821.371.020.761.171.191.070.640.800.741.63
PI(42:11)ME3000460.930.430.650.641.171.240.662.340.771.351.210.751.241.141.180.420.480.641.98
PIP(36:3)ME2998540.960.460.590.631.221.260.702.210.811.411.140.821.201.181.190.460.520.631.81
3-O-(6^-O-octadecanoyl-beta-D-glucopyranosyl)-campest-5-en-3beta-olME2999640.730.541.260.771.400.800.801.591.022.100.620.841.270.661.140.490.561.001.43
PE(P-42:2)ME3000390.850.391.061.101.651.000.671.890.640.831.201.001.340.661.580.270.370.951.75
PC(P-40:1)ME2998490.690.341.221.121.391.140.661.770.751.551.250.991.300.451.390.310.331.071.56
PE(P-42:1)ME3000380.760.291.141.141.481.090.591.610.691.441.210.991.390.581.510.220.280.941.66
PC(44:6)ME2997530.980.500.840.891.331.070.571.590.651.491.070.871.150.701.380.430.550.792.23
PC(42:1)ME2997440.790.441.331.071.141.130.621.860.621.681.120.791.100.591.160.510.530.951.75
PC(44:5)ME2997520.920.471.001.071.281.050.591.670.671.580.980.841.130.821.190.360.471.002.05
PE(42:1)ME2997800.840.481.070.981.291.090.641.900.601.770.980.781.050.661.180.450.560.951.89
PC(42:2)ME3000200.840.421.030.951.131.080.611.780.651.681.230.891.080.631.310.440.571.001.91
PE(44:3)ME2997860.840.480.940.961.151.040.621.740.641.741.080.941.230.701.270.440.570.981.84
SM(d18:1/24:0)ME2998391.410.530.580.631.800.810.831.961.021.550.400.450.800.910.640.630.720.612.57
PE(P-40:0)ME3001091.080.411.030.962.030.860.531.530.671.680.800.730.910.790.960.330.461.072.19
N-(2-hydroxy-hexacosanoyl)-tetradecasphing-4-enineME2999901.300.361.090.902.680.710.411.190.591.220.710.810.900.810.870.470.441.022.45
N-(2-hydroxy-tetracosanoyl)-4E,6E-hexadecasphingadienineME2999911.200.341.371.052.430.740.431.230.511.210.760.780.900.660.840.410.431.222.48
[FA methoxy,hydroxy(18:2)] octadecadienoic acidME2999391.143.241.190.520.610.931.240.531.221.110.591.180.890.690.560.581.010.570.90
[PA(16:0/0:0)] 1-hexadecanoyl-2-sn-glycero-3-phosphateME2998670.462.211.521.230.741.461.211.080.810.700.340.280.370.890.451.291.582.030.29
LPA(18:0)ME2998440.612.651.570.780.640.960.850.790.580.510.220.220.240.910.292.442.291.570.55
LysoPC(16:0)ME2998740.512.021.011.200.491.410.950.810.970.810.760.720.700.530.761.711.911.200.40
LysoPE(20:0)ME3000870.592.121.091.080.531.310.900.760.910.750.690.700.650.550.751.792.011.210.44
LysoPC(18:0)ME2998760.582.441.251.210.581.270.830.730.810.660.450.360.430.450.452.122.281.400.43
LysoPE(22:0)ME3000910.821.971.301.210.811.130.880.780.850.700.480.410.510.550.531.822.011.420.61
SP (4:0)ME3000760.982.530.790.580.560.701.280.591.450.900.800.460.731.360.911.620.740.930.78
[FA (18:1)] 9Z-octadecenamideME3001110.992.130.940.760.850.801.110.811.191.030.590.800.761.200.711.241.181.010.72
LinoleamideME2999751.082.160.880.660.860.961.180.711.130.920.770.630.821.110.841.311.050.780.88
N-(9Z-octadecenoyl)-glycineME3000950.620.960.760.890.960.970.860.841.081.341.100.740.781.540.702.161.180.850.55
DodecanamideME2998590.851.511.020.740.801.081.340.561.111.060.810.711.060.990.601.930.990.870.73
OctadecanamideME2998620.771.301.120.820.861.241.070.940.900.950.660.660.650.950.711.921.551.030.70
[SP methyl(10:0/8:0/8:0)] (9aS)-6S-(deca-1,3E-dienyl)-4S-methyloctahydro-1H-quinolizin-3R-olME2999550.811.231.300.670.810.941.030.850.770.930.840.700.760.790.672.601.730.640.70
N-stearoyl GABAME3000020.451.000.480.410.511.101.060.380.990.415.124.030.321.040.260.771.290.370.50
[FA hydroxy(20:4)] N-hydroxy-5Z,8Z,11Z,14Z-eicosatetraenoyl amineME2999371.160.740.360.321.710.661.000.751.580.694.151.571.041.180.890.310.570.340.68
[PR] Taxa-4(20),11(12)-dien-5alpha-olME2999060.921.010.800.430.801.000.980.771.140.923.512.041.100.960.950.280.950.610.56
O-9Z,12Z-Hexadecadienoyl-R-carnitineME3000041.340.090.090.110.780.110.080.070.070.072.664.203.551.443.670.070.190.091.07
[FA hydroxy(20:4)] 5S-hydroxy-12-keto-6Z,8E,10E,14Z-eicosatetraenoic acidME2998650.990.370.340.302.440.390.360.340.420.311.332.452.421.662.020.320.500.251.87
DehydrophytosphingosineME2999700.601.260.970.760.731.080.930.680.900.780.974.120.790.750.691.430.880.580.70
Margaroyl-EAME2999800.820.920.660.890.600.601.130.930.890.961.232.121.010.682.050.961.001.150.75
[SP methyl(2:0)] 9-methyl-sphinga-4E,8E-dienineME2999560.581.130.980.920.400.771.131.260.950.891.222.021.160.631.990.721.041.060.55
LysoPE(0:0/14:0)ME2998280.920.830.760.950.481.140.850.930.840.941.472.511.070.971.880.640.810.850.60
LysoPE(22:4)ME3000930.630.610.721.210.531.040.950.861.350.861.612.281.320.582.120.510.721.130.46
LysoPE(18:2)ME3000860.680.790.671.010.540.970.940.941.130.891.742.261.250.592.020.620.950.930.54
LysoPE(20:4)ME2998310.670.730.841.100.541.010.990.921.200.891.552.431.150.591.860.550.801.090.60
LysoPC(18:1)ME2999760.500.960.710.910.450.900.740.610.810.612.242.671.580.462.580.720.930.740.43
LysoPE(22:1)ME2998320.491.060.750.880.370.950.750.610.780.612.102.691.500.412.530.861.020.810.38
LysoPC(22:2(13Z,16Z))ME2998830.670.740.860.880.630.780.710.720.880.621.912.711.580.512.570.580.800.880.53
PG(18:2(9Z,12Z)/0:0)ME3000410.710.610.800.940.630.960.850.761.070.801.732.361.680.592.310.390.710.970.60
LysoPE(22:6)ME3000940.590.730.590.920.500.930.850.881.100.731.942.541.470.592.450.530.790.910.53
LysoPE(20:3)ME3000900.590.640.691.050.640.870.800.881.110.751.802.791.480.532.300.490.720.880.59
LysoPE(22:5)ME2998330.730.730.660.910.660.830.810.841.060.761.642.701.450.672.260.520.880.870.54
LysoPE(16:0)ME2998290.481.080.520.870.420.770.940.810.850.751.543.421.120.512.490.781.010.880.43
LysoPE(16:1)ME3000850.580.730.570.780.460.730.820.800.900.712.033.451.410.552.790.530.750.660.50
[SP (3:0)] sphinga-4E,8E,10E-trienineME2999490.660.670.890.630.961.540.770.950.700.671.772.241.091.151.770.530.830.491.06
[SP] Sphing-4-enineME2999160.640.820.690.860.871.340.910.761.000.851.592.121.210.911.610.630.940.650.88
[FA (18:1)] 9Z-octadecenoic acidME2999090.690.610.560.710.881.410.730.610.770.772.122.471.430.652.230.640.690.450.99
N-(8Z,11Z,14Z-eicosatrienoyl)-ethanolamineME2998870.780.480.680.930.941.000.770.570.930.592.062.941.550.412.040.410.550.631.28
[FA (22:4)] 7Z,10Z,13Z,16Z-docosatetraenoic acidME2998630.860.540.690.990.941.010.790.600.940.802.022.761.130.431.770.470.610.701.47
[FA (22:5)] 7Z,10Z,13Z,16Z,19Z-docosapentaenoic acidME2998640.800.500.540.840.991.120.740.530.760.702.222.581.360.412.040.470.610.581.71
[FA hydroxy(20:4)] eicosatetraenoyl amineME2999360.540.600.450.680.921.481.420.420.690.602.432.711.340.342.900.240.500.310.89
N-(9Z,12Z-octadecadienoyl)-ethanolamineME3001120.600.520.580.730.641.310.740.570.910.652.683.091.670.352.240.300.630.411.08
[FA (20:5)] 5Z,8Z,11Z,14Z,17Z-eicosapentaenoic acidME2999110.690.410.420.710.691.090.910.480.700.692.823.161.610.322.780.260.440.401.12
Icosatrienoic acidME2998610.680.370.570.770.531.300.830.350.540.742.753.171.690.362.560.500.570.550.89
FA(16:1)ME2998730.780.530.390.680.620.730.570.470.881.422.333.011.560.452.310.760.500.401.16
N-(5Z,8Z,11Z-eicosatrienoyl)-ethanolamineME2999960.910.500.070.861.030.070.930.601.040.872.022.911.880.472.390.780.600.161.34
[PC(20:5)] 1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycero-3-phosphocholineME2998681.250.350.400.470.920.480.540.460.520.402.062.741.321.064.500.200.311.310.37
LysoPC(20:4)ME2998810.470.490.790.850.330.780.820.700.840.602.793.261.780.433.090.300.460.630.43
PC(18:2)ME3000100.440.530.640.810.350.750.800.710.830.602.863.381.940.373.040.340.520.640.36
LysoPC(16:1(9Z))ME2998750.520.610.600.830.350.740.800.630.760.672.683.161.890.523.040.410.600.510.44
LysoPE(20:1)ME3000880.460.610.620.800.330.760.760.620.780.572.673.352.010.383.160.420.590.570.35
LysoPE(22:2)ME3000920.390.480.610.690.330.620.650.570.700.513.073.762.100.363.540.320.440.490.34
LysoPC(22:4(7Z,10Z,13Z,16Z))ME2998840.420.410.660.800.310.690.680.590.780.512.873.821.960.343.510.250.400.620.35
LysoPC(20:2)ME2998790.410.500.660.750.340.670.670.580.710.492.933.741.930.333.430.350.510.590.34
LysoPC(20:3)ME2998800.450.460.670.760.340.660.690.580.720.542.943.641.990.403.370.300.460.550.41
LysoPE(20:2)ME3000890.320.340.480.670.220.610.730.610.700.543.473.892.130.303.770.240.380.420.29
[PC(22:6)]ME2999410.390.410.680.640.250.590.650.570.620.463.183.992.080.333.710.260.410.500.34
FA (20:4)ME2999270.550.270.380.500.440.710.570.400.560.513.134.401.790.273.660.230.330.361.02
LinoleateME2999290.370.300.480.490.290.520.490.440.390.383.054.981.810.324.210.310.320.360.70
LysoPC(22:5)ME2998450.440.360.620.580.310.550.570.520.470.442.684.571.960.334.150.270.420.440.37
[PC(21:4)] 1-(6Z,9Z,12Z,15Z-heneicosatetraenoyl)-sn-glycero-3-phosphocholineME2999400.470.370.590.510.330.490.620.580.590.472.914.362.050.383.700.270.510.410.45
DG(34:1)ME2999710.510.390.600.670.140.380.460.52NA0.331.953.711.580.213.94NA0.210.590.80
PA(O-30:0)ME3000050.11NA0.100.200.120.270.190.110.100.102.444.491.19NA3.60NANA0.060.43

Factors:

F1Drug treatment:DMSO
F2Drug treatment:MMV099637
F3Drug treatment:MMV652003
F4Drug treatment:MMV676600
F5Drug treatment:MMV676604
F6Drug treatment:MMV687706
F7Drug treatment:MMV688179
F8Drug treatment:MMV688271
F9Drug treatment:MMV688279
F10Drug treatment:MMV688467
F11Drug treatment:MMV688776
F12Drug treatment:MMV688796
F13Drug treatment:MMV688797
F14Drug treatment:MMV688798
F15Drug treatment:MMV688958
F16Drug treatment:MMV689028
F17Drug treatment:MMV689029
F18Drug treatment:MMV690027
F19Drug treatment:MMV690028
Data matrix
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