Clustering data with hclust algorithm for Cyclobutene- and cyclobutane-functionalized fatty acids as novel biochemical probes of structure and function in HepG2 cells (Study ST000241)

FT-ICR-MS Positive ion mode (Analysis AN000373)
MetaboliteStructureF1F2F3F4F5F6F7F8
PC(20:4(5Z,8Z,11Z,14Z)/P-18:1(11Z))ME6997920.900.150.100.440.210.215.330.67
Tetrahydroaldosterone-3-glucuronideME6997020.430.050.080.100.130.090.196.44
OleamideME6995621.510.310.460.120.070.021.164.35
TG(15:0/18:1(9Z)/16:0)[iso6]ME6998101.050.220.350.100.070.031.214.97
Palmitic amideME6995550.06NA0.060.060.06NANA3.52
TriterpenoidME6997090.430.050.080.530.490.49NA4.93
13,14-Dihydro- lipoxin A4ME6996106.530.080.180.110.120.190.420.38
PC(14:0/18:1(11Z))ME6997766.440.230.040.040.020.010.091.13
DG(14:0/15:0/0:0)ME6996971.99NANA0.650.32NA0.530.51
Tetracosahexaenoic acidME6996133.340.090.34NA0.110.100.520.10
AminopterinME6996622.92NANA0.310.370.710.08NA
LysoPE(0:0/20:2(11Z,14Z))ME6996912.90NA0.130.170.480.430.320.17
LysoPE(0:0/20:1(11Z))ME6996922.520.070.16NANANANA0.07
Prostaglandin F2aME6996113.110.080.080.160.080.09NA0.09
N-UndecanoylglycineME6995494.470.460.140.010.090.090.281.85
Cysteineglutathione disulfideME6996534.130.200.121.040.540.820.130.16
DihydrothymineME6995253.490.970.170.870.850.880.280.48
2-HydroxylauroylcarnitineME6996153.610.260.660.110.02NA1.490.52
7-KetocholesterolME6996394.090.720.810.140.110.181.210.73
13-OxoODEME6995675.760.180.250.280.330.400.430.38
PC(14:1(9Z)/18:4(6Z,9Z,12Z,15Z))ME6997735.590.070.130.080.110.380.140.30
PseudoephedrineME6995335.530.110.310.110.150.270.130.36
Neuroprotectin D1ME6996165.140.110.330.150.110.160.400.14
Molybdenum cofactor (sulfide)ME6997005.260.270.330.370.310.430.490.54
PI(16:0/16:0)ME6998065.400.150.320.140.390.380.520.40
DG(18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)ME6997365.250.200.300.320.450.350.680.23
Ubiquinol-6ME6997275.270.180.370.280.410.280.920.24
13^-Carboxy-gama-tocopherolME6996675.220.420.500.200.210.350.790.30
L(-)-Nicotine pestalME6995325.460.400.420.230.270.360.630.24
2-Hexaprenyl-6-methoxy-1,4-benzoquinolME6997083.980.180.100.430.340.270.890.26
DG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/0:0)ME6997324.160.380.490.570.360.850.760.42
Dextrorphan O-glucuronideME6996573.950.150.390.480.520.810.930.77
PS(14:1(9Z)/18:3(9Z,12Z,15Z))ME6997744.020.370.520.440.460.710.740.74
GabapentinME6995354.200.290.620.260.300.210.320.32
7^-carboxy-gama-tocotrienolME6995964.360.100.060.05NA0.070.100.12
12(13)Ep-9-KODEME6995794.62NA0.250.120.150.260.150.13
CotinineglucuronideME6996094.330.280.280.180.170.290.140.16
24,25-Dihydroxyvitamin DME6996504.510.630.520.090.040.220.500.85
Beta-CryptoxanthinME6997104.470.190.260.550.320.790.530.14
Testosterone glucuronideME6996754.670.230.200.600.320.760.210.28
LysoPC(16:1(9Z))ME6996874.910.730.580.140.280.370.680.30
LysoPE(0:0/24:6(6Z,9Z,12Z,15Z,18Z,21Z))ME6997114.520.430.700.120.460.760.600.41
LysoPC(22:1(13Z))ME6997204.460.430.540.410.470.550.690.46
PC(14:0/20:5(5Z,8Z,11Z,14Z,17Z))ME6997804.520.290.420.440.510.560.600.66
13^-hydroxy-alpha-tocotrienolME6996634.580.170.390.140.170.340.910.30
DG(14:1(9Z)/14:1(9Z)/0:0)ME6996934.780.370.340.260.260.650.550.37
LysoPC(22:0)ME6997214.640.270.370.260.130.350.460.44
D-UrobilinME6997263.710.230.060.280.080.88NA0.07
PE(14:1(9Z)/P-16:0)ME6997413.860.890.560.200.260.660.370.25
3-O-Sulfogalactosylceramide (d18:1/24:1(15Z))ME6998540.060.320.070.115.380.070.080.06
PC(24:1(15Z)/24:1(15Z))ME6998700.000.140.180.386.270.000.030.00
PG(18:0/22:5(4Z,7Z,10Z,13Z,16Z))ME6998140.290.160.230.855.760.120.480.12
PG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6998130.540.200.280.725.670.170.100.33
PE(20:5(5Z,8Z,11Z,14Z,17Z)/24:1(15Z))ME6998340.020.090.212.271.780.06NANA
PE(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z))ME6997860.010.040.012.602.780.230.030.03
GlucosylsphingosineME699674NA0.010.951.271.640.01NA0.80
PG(18:0/18:0)ME699787NANANA1.551.900.020.290.02
PhytosphingosineME6995860.000.00NA0.801.87NANANA
PC(22:0/24:1(15Z))ME699862NA0.060.012.164.040.060.010.00
PC(24:0/24:1(15Z))ME699871NA0.000.002.313.660.020.00NA
Tridecanoic acidME6995440.720.470.050.933.741.400.030.17
PI(16:0/20:3(5Z,8Z,11Z))ME6998430.35NANA0.993.180.370.160.07
Trihexosylceramide (d18:1/24:1(15Z))ME6998840.020.010.01NA3.970.010.010.01
5-Taurinomethyl-2-thiouridineME6996350.010.01NA0.332.99NA0.01NA
Hexacosanoic acidME6996340.040.050.040.383.54NA0.04NA
PC(14:0/18:2(9Z,12Z))ME6997750.040.656.580.020.000.000.010.03
DG(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)ME6997670.362.053.930.410.360.130.240.53
TG(16:0/20:0/20:4(5Z,8Z,11Z,14Z))[iso6]ME6998590.012.033.440.030.040.12NA0.01
TG(18:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6]ME699866NA1.973.970.010.020.02NA0.01
TG(18:1(9Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6]ME699865NA2.123.780.010.020.050.02NA
PE(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6998110.270.914.361.840.100.070.300.14
PS(18:0/20:0)ME6998120.471.483.441.170.400.190.330.51
9^-carboxy-gama-tocotrienolME6996200.080.073.760.700.350.150.070.49
Retinoic acidME6995700.090.233.560.670.75NANA0.71
GestrinoneME6995770.220.214.770.360.370.200.180.62
LysoPC(14:1(9Z))ME6996760.030.034.610.700.600.21NA0.83
1,11-Undecanedicarboxylic acidME6995500.550.124.290.560.280.150.140.21
2-trans,4-cis-DecadienoylcarnitineME6995810.10NA4.180.310.090.100.250.36
19-Hydroxy-PGE2ME6996180.010.025.121.710.080.010.010.06
PE(14:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6997770.010.014.811.300.000.010.000.20
PC(14:1(9Z)/16:1(9Z))ME6997630.150.105.800.660.940.130.110.11
PC(14:1(9Z)/P-18:1(11Z))ME6997660.120.025.370.810.330.020.010.33
Alpha-CEHCME6995610.030.063.461.591.210.050.050.92
ProcaineME6995480.040.072.811.050.890.040.081.77
PS(14:0/16:1(9Z))ME6997650.330.042.870.840.66NANA0.93
Estriol 3-sulfate 16-glucuronideME6997050.690.123.260.220.140.970.590.12
PE(16:1(9Z)/P-18:1(11Z))ME699762NA0.063.000.970.14NANA0.20
13,14-Dihydro-15-oxo-lipoxin A4ME699608NANA2.740.120.06NA0.080.21
DG(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)ME6997380.060.352.890.090.06NANANA
PE(16:0/P-18:1(11Z))ME6997640.610.171.682.800.410.241.900.19
PC(18:3(6Z,9Z,12Z)/20:5(5Z,8Z,11Z,14Z,17Z))ME699799NA0.022.261.920.18NANA0.30
L-UrobilinogenME699730NA0.003.122.110.060.00NA0.04
Hexadecanedioic acidME6995640.020.032.422.520.020.020.020.02
PE(14:0/14:1(9Z))ME6997340.010.013.022.550.060.010.010.03
PE(20:1(11Z)/24:1(15Z))ME6998390.150.072.752.470.170.110.03NA
PC(20:0/24:0)ME6998560.000.090.276.920.270.090.010.00
TG(16:0/16:0/20:1(11Z))[iso3]ME6998440.480.020.023.661.541.720.190.35
Cer(d18:1/22:1(13Z))ME699733NA0.010.033.710.120.05NA1.76
Uroporphyrinogen IIIME6998230.010.010.044.660.440.120.001.71
8-iso-15-keto-PGE2ME6996070.160.221.213.020.11NANA0.17
Trihexosylceramide (d18:1/9Z-18:1)ME699882NANA1.123.130.020.02NA0.06
trans-D-Decenoyl-CoAME699861NA0.05NA2.120.10NANA0.80
CL(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:2(9Z,12Z)/18:2(9Z,12Z))ME6998950.12NANA2.310.16NANA0.11
Ganglioside GM3 (d18:0/16:0)ME699886NANANA2.710.070.04NA0.23
5a-Cholestane-3a,7a,12a,25-tetrolME6996580.080.03NA2.91NANA0.040.05
Phytosphingosine-1-PME6996360.070.080.082.820.180.07NA0.07
3-Oxododecanoyl-CoAME6998740.030.030.033.100.080.07NA1.10
3-Hydroxyhexdecanedioyl-CoAME699883NANA0.013.300.040.01NA0.65
PE(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME699825NANANA3.210.040.030.030.40
DG(15:0/16:0/0:0)ME6997120.060.05NA4.210.220.18NA0.65
AdenosineME6995570.090.040.043.880.040.050.040.34
Glucosylceramide (d18:1/26:0)ME6998280.020.030.024.200.090.04NA0.37
Linoleoyl ethanolamideME6995900.870.160.285.090.480.020.520.26
N-Acetyl-L-glutamate 5-semialdehydeME6995360.450.370.374.630.440.330.490.37
Ceramide (d18:1/9Z-18:1)ME6997140.090.090.224.141.060.260.090.23
DelphinidinME6995990.390.020.024.031.530.170.230.02
2-Phosphoglyceric acidME6995390.800.05NA3.130.85NANA0.16
Fructose 1,6-bisphosphateME6995911.230.220.123.361.260.280.570.16
PC(18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6998170.141.421.241.271.691.860.020.03
TG(16:0/18:2(9Z,12Z)/20:1(11Z))[iso6]ME6998510.690.110.151.282.162.060.471.08
LysoPC(18:3(6Z,9Z,12Z))ME6996950.370.440.501.312.281.870.021.21
LysoPE(0:0/18:3(6Z,9Z,12Z))ME6996820.550.420.461.531.931.720.221.18
PI(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6998580.340.280.321.541.282.27NA0.94
LysoPE(0:0/16:0)ME6996720.560.390.401.661.622.030.131.20
LysoPC(15:0)ME6996860.440.480.501.701.712.100.300.77
LysoPC(16:0)ME6996880.500.460.451.681.762.080.170.91
LysoPE(0:0/20:3(11Z,14Z,17Z))ME6996900.330.500.471.321.711.891.000.80
LysoPC(20:4(5Z,8Z,11Z,14Z))ME6997040.440.340.301.652.012.160.580.52
LysoPE(0:0/18:1(11Z))ME6996850.540.420.371.691.462.220.660.64
LysoPE(0:0/20:4(5Z,8Z,11Z,14Z))ME6996890.630.460.391.491.432.230.720.65
LysoPC(14:0)ME6996800.720.400.122.241.332.620.130.44
LysoPC(20:3(5Z,8Z,11Z))ME6997070.280.410.301.591.592.910.630.30
PC(20:3(5Z,8Z,11Z)/P-18:1(11Z))ME6997930.340.410.441.361.263.080.500.61
4,4-Dimethylcholesta-8,14,24-trienolME6996460.20NANA0.982.201.250.090.10
Propinol adenylateME699642NA0.00NA0.951.111.27NANA
PropionylcholineME699531NANANA1.781.161.980.050.04
4-PhosphopantothenoylcysteineME6996400.01NA0.010.771.562.31NA0.01
CE(18:3(6Z,9Z,12Z))ME699742NA0.060.231.080.992.340.00NA
PC(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6998480.010.02NA1.081.022.220.00NA
5a-Cholesta-8,24-dien-3-oneME6996260.260.660.080.521.032.581.001.86
TG(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]ME6998690.340.340.300.210.693.300.981.13
CE(22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME699759NA0.02NA0.040.023.26NA0.02
MG(18:0e/0:0/0:0)ME699605NA0.00NANA0.032.640.000.01
AcetylphosphateME699529NA0.01NANA0.122.870.010.01
DocosamideME6996010.050.050.05NANA2.890.070.06
S-AdenosylmethionimineME6996120.010.010.10NANA2.920.01NA
CysteinylglycineME699537NA0.390.31NANA1.960.38NA
PG(16:0/20:3(5Z,8Z,11Z))ME699784NANA0.200.250.451.96NA0.21
LPA(0:0/16:0)ME699645NA0.210.170.36NA2.300.180.17
DG(18:0/22:5(4Z,7Z,10Z,13Z,16Z)/0:0)ME699749NA0.14NA0.100.422.38NA0.07
L-Aspartyl-4-phosphateME699543NA0.01NANANA1.990.010.00
Palmitic acidME699556NA0.00NANA0.012.32NA0.00
PC(15:0/22:0)ME6998020.180.010.010.781.313.660.020.01
VenlafaxineME6995600.180.040.040.381.203.260.07NA
DG(16:0/22:4(7Z,10Z,13Z,16Z)/0:0)ME6997400.090.050.060.181.133.690.240.42
Adenosine tetraphosphateME699725NA0.010.010.390.453.480.01NA
Gamma-GlutamylcysteineME699552NA0.070.070.370.583.420.080.18
8,11,14-Eicosatrienoic acidME6995740.030.060.030.580.823.530.040.03
CE(5:0)ME699681NA0.02NA0.250.843.540.020.02
PC(20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6998370.090.090.030.820.244.45NA0.02
CE(20:5(5Z,8Z,11Z,14Z,17Z)ME699750NA0.000.010.120.304.570.000.00
Hypogeic acidME6995540.080.170.090.100.094.260.08NA
MargaroylglycineME6995940.000.070.05NANA4.210.000.00
TG(20:0/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z))[iso3]ME6998720.010.000.010.160.137.670.010.01
PC(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6998220.130.070.101.471.294.770.080.08
7-DehydrocholesterolME6996280.040.130.060.611.205.530.340.10
3b-AllotetrahydrocortisolME6996170.070.060.050.420.105.320.040.04
Galabiosylceramide (d18:1/26:0)ME6998810.480.210.230.150.385.780.270.30
PGP(18:0/20:3(5Z,8Z,11Z))ME6998490.390.240.320.130.485.300.570.57
TG(16:0/16:0/18:2(9Z,12Z))[iso3]ME6998190.951.781.920.210.250.431.530.94
DG(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)ME6997700.232.191.321.140.850.141.131.00
PE(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6998270.272.201.750.641.030.111.280.72
Gamma-Aminobutyryl-lysineME6995470.051.841.00NANA0.390.05NA
4Alpha-hydroxymethyl-5alpha-cholesta-8,24-dien-3beta-olME699648NA2.080.670.31NANA0.400.31
Dihydroxyacetone Phosphate Acyl EsterME699542NA1.980.64NANANA0.070.06
LysoPE(0:0/18:2(9Z,12Z))ME699684NA0.752.500.090.070.04NANA
PC(24:1(15Z)/P-18:1(11Z))ME6998380.021.351.950.02NANA0.03NA
TG(16:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6]ME699857NA1.142.19NA0.000.00NA0.00
TG(18:2(9Z,12Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6]ME699864NA1.002.290.01NA0.030.06NA
1D-Myo-inositol 1,4-bisphosphateME699602NA1.571.42NA0.050.33NANA
Galactosylceramide (d18:1/14:0)ME699751NA1.191.67NA0.020.47NANA
Homophytanic acidME6995930.001.981.690.00NANA0.000.00
UndecanoylcholineME699559NA1.751.52NA0.02NA0.020.12
DG(15:0/24:0/0:0)ME6997480.131.682.170.05NANA0.370.10
Erucic acidME6996000.021.922.160.150.14NANANA
PC(22:0/P-18:1(11Z))ME6998150.061.792.020.09NANANA0.13
Glucosylceramide (d18:1/12:0)ME699739NA1.712.280.050.120.20NANA
PIP(16:0/20:1(11Z))ME6998670.041.552.290.090.04NA0.140.04
TG(16:0/14:0/16:0)[iso3]ME6997880.032.970.95NANA0.020.050.05
TG(16:0/16:1(9Z)/16:1(9Z))[iso3]ME6998010.503.381.200.21NANA0.320.12
SM(d18:0/26:1(17Z))ME6998290.142.802.270.03NANA0.060.06
SM(d18:0/14:0)ME6997560.112.871.710.050.06NA0.26NA
SM(d18:1/14:0)ME6997540.033.321.610.04NA0.020.460.04
CE(20:4(5Z,8Z,11Z,14Z)ME699752NA3.201.750.000.010.03NANA
DG(18:1(11Z)/22:2(13Z,16Z)/0:0)ME6997550.023.621.630.030.02NA0.030.02
TG(20:0/20:1(11Z)/20:1(11Z))[iso3]ME6998770.232.792.670.140.110.081.880.10
DG(15:0/24:1(15Z)/0:0)ME6997470.513.272.540.460.300.180.410.34
Endomorphin-2ME6997180.602.352.620.380.400.420.770.46
3-Hydroxy-cis-5-tetradecenoylcarnitineME6996290.453.550.410.07NANA1.350.16
MG(0:0/20:2(11Z,14Z)/0:0)ME6996250.522.400.550.540.602.200.600.59
Cholesterol sulfateME6996790.072.830.040.050.051.370.070.05
Glycocholic acidME6996770.143.930.160.120.171.980.170.24
5b-Cholestane-3a,7a,12a,23R,25-pentolME699671NANA0.660.051.780.050.042.47
PC(18:1(9Z)/18:1(9Z))ME6997890.140.160.121.401.201.700.322.95
PC(15:0/20:4(5Z,8Z,11Z,14Z))ME6997823.040.130.630.080.670.382.560.50
Ribose 1,5-bisphosphateME6995782.290.060.071.141.080.482.190.70
Phosphohydroxypyruvic acidME6995380.340.13NANANANA1.901.06
9-DecenoylcarnitineME699583NA0.290.65NANA0.242.900.13
Ganglioside GT3 (d18:1/18:1(11Z))ME6998980.650.610.57NANA0.092.48NA
PC(o-18:0/24:0)ME6998420.570.430.290.640.670.692.981.81
L-OctanoylcarnitineME6995650.830.080.130.530.300.094.331.11
PI(16:0/18:1(11Z))ME6998241.000.330.560.480.270.333.731.30
Cervonoyl ethanolamideME6996210.680.590.721.610.240.043.420.69
PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/P-18:1(11Z))ME6998080.790.421.140.520.410.233.850.64
PC(20:5(5Z,8Z,11Z,14Z,17Z)/P-18:1(11Z))ME6997910.550.771.120.710.750.342.960.80
PE(18:3(6Z,9Z,12Z)/P-16:0)ME6997610.810.570.650.650.720.713.320.57
11-Hydroxyeicosatetraenoate glyceryl esterME6996320.430.721.570.860.54NA2.380.49
Gamma-linolenyl carnitineME6996520.301.211.270.620.040.042.63NA
13^-carboxy-alpha-tocotrienolME6996731.511.281.230.820.290.322.410.41
PGF2a ethanolamideME6996370.841.321.090.41NA0.012.150.84
7-Ketodeoxycholic acidME6996441.020.931.221.100.770.031.950.99
ThymolME6995301.100.600.690.900.410.572.231.17
PI(16:0/22:2(13Z,16Z))ME6998551.440.610.900.800.560.462.181.05
SM(d18:0/12:0)ME6997441.470.930.910.740.490.412.070.98
N-LignoceroylsphingosineME6997431.980.560.720.760.220.042.191.21
PGP(18:0/18:1(11Z))ME6998401.520.530.490.660.500.362.281.66
TG(20:1(11Z)/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso3]ME6998731.510.420.700.180.140.162.821.79
7a,12a-Dihydroxy-3-oxo-4-cholenoic acidME6996432.410.480.580.110.050.033.070.94
CelastrolME6996691.860.410.660.520.650.242.750.90
PalmitoylglycineME6995841.540.640.760.320.340.253.390.76
N,N-DimethylanilineME6995230.771.39NANANANA0.101.48
TG(16:0/16:0/16:0)[iso]ME6998051.800.780.860.370.280.111.582.22
TriphosphateME6995531.880.600.550.390.350.611.562.26
TG(15:0/16:0/20:2(11Z,14Z))[iso6]ME6998321.831.210.620.120.090.041.982.11
TG(16:0/18:0/18:2(9Z,12Z))[iso6]ME6998411.851.230.880.390.240.091.611.72
2-ArachidonylglycerolME6996242.540.670.300.170.030.001.431.41
Cer(d18:0/24:0)ME6997452.370.600.840.780.020.020.781.29
TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]ME6998792.050.750.990.760.270.251.391.53
TG(16:0/16:0/18:1(9Z))[iso3]ME6998211.860.771.430.310.190.090.612.74
TG(16:0/18:1(9Z)/20:1(11Z))[iso6]ME6998521.720.240.780.310.320.481.232.93
MG(0:0/24:6(6Z,9Z,12Z,15Z,18Z,21Z)/0:0)ME6996561.250.970.38NANANA0.701.70
SelenocysteineME6995341.060.641.02NANA0.051.181.73
24-HydroxycholesterolME6996410.970.490.24NANA0.070.582.69
4Alpha-hydroxymethyl-5alpha-cholesta-8-en-3beta-olME6996491.470.250.77NANA0.050.372.46
3-Methylcrotonyl-CoAME6998361.56NA0.190.360.23NA0.661.52
KyotorphinME6995981.430.040.150.03NANA1.092.01
TG(16:1(9Z)/14:0/16:1(9Z))[iso3]ME6997851.450.340.26NANANA0.802.30
TG(15:0/16:0/20:4(5Z,8Z,11Z,14Z))[iso6]ME6998300.822.240.300.240.180.051.103.07
TG(15:0/16:0/20:3(8Z,11Z,14Z))[iso6]ME6998310.560.471.010.200.220.072.033.44
TG(16:0/16:0/16:1(9Z))[iso3]ME6998031.100.570.700.110.130.032.072.97
3D,7D,11D-Phytanic acidME6995820.290.910.450.460.690.821.462.45
RetilME6995630.630.170.201.250.490.130.793.50
TG(15:0/18:1(9Z)/16:1(9Z))[iso6]ME6998090.320.700.940.730.380.541.023.36
PE(14:0/P-18:1(11Z))ME6997531.490.712.400.710.571.030.330.76
Leukotriene A4ME6995880.210.242.780.530.661.910.190.41
PC(15:0/24:1(15Z))ME6998180.610.812.590.361.590.810.500.73
PC(15:0/22:1(13Z))ME6998000.89NA2.400.341.051.260.130.84
4-oxo-Retinoic acidME6995850.280.482.400.931.331.550.150.88
BrompheniramineME6995870.160.201.670.801.221.26NA1.13
Nodeca-10(Z)-enoic acidME6995682.120.741.850.761.650.120.110.64
PC(15:0/22:2(13Z,16Z))ME6997963.030.841.400.360.110.020.900.69
DG(14:0/18:1(11Z)/0:0)ME6997161.850.841.150.11NANA1.460.59
Cholesteryl acetateME6996551.851.191.680.020.050.021.100.48
LysoSM(d18:1)ME6996782.330.881.710.120.050.190.920.61
TG(20:0/20:1(11Z)/20:4(5Z,8Z,11Z,14Z))[iso6]ME6998750.820.210.391.752.200.021.400.88
D-LimoneneME6995281.11NA0.101.170.880.200.081.97
CE(14:0)ME6997310.730.260.192.071.780.500.151.42
1,25-Dihydroxyvitamin D3-26,23-lactoneME6996651.390.060.112.141.570.480.102.14
CE(14:1(9Z))ME6997290.990.300.272.061.660.070.711.93
L-PalmitoylcarnitineME6996380.860.281.870.450.480.771.232.07
16b-HydroxystanozololME6996040.900.710.811.241.130.180.522.51
TG(20:4(5Z,8Z,11Z,14Z)/14:0/18:3(9Z,12Z,15Z))[iso6]ME6998350.451.110.771.701.020.060.572.01
LysoPE(0:0/22:5(4Z,7Z,10Z,13Z,16Z))ME6996980.950.330.510.510.461.890.472.12
2-Hydroxymyristic acidME6995511.420.520.820.690.571.060.712.12
Hexacosanoyl carnitineME6997011.240.941.090.760.720.560.512.18
3-Oxo-4,6-choladienoic acidME6996191.140.720.760.910.791.000.332.36
PC(14:0/15:0)ME6997580.860.710.880.931.010.940.442.23
Adenosylcobimide-GDPME6998960.750.690.461.631.521.290.231.43
LysoPE(0:0/16:1(9Z))ME6996700.770.500.551.511.201.560.131.78
16-hydroxy hexadecanoic acidME6995580.521.330.681.811.320.960.311.07
Kinetensin 4-7ME6997191.020.980.591.391.561.510.480.47
MG(18:0/0:0/0:0)ME6996140.740.870.891.411.491.030.920.65
PC(18:3(6Z,9Z,12Z)/P-18:1(11Z))ME6997810.670.540.871.421.441.250.801.00
DG(14:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)ME6997240.850.601.030.572.201.410.450.89
PC(22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6998500.510.791.581.411.260.780.551.12
DG(22:4(7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)/0:0)ME6997690.490.891.100.891.820.960.321.52
PC(16:1(9Z)/22:2(13Z,16Z))ME6998070.630.541.701.102.130.600.301.23
3a,20b-PregnediolME6995891.850.680.831.660.161.210.341.35
7,7^,8,8^,11,11^,12,12^-Hexahydro-y,y-CaroteneME6997031.200.850.861.040.921.110.551.47
(R)-3-Hydroxy-Octadecanoic acidME6995711.430.640.781.131.091.500.321.10
O-(N-acetyl-a-neuraminosyl)-(2->3)-O-b-D-galactopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-b-D-glucopyranosyl-(1->3)-O-b-D-galactopyranosyl-(1->4)-O-2-(acetylamino)-2-deoxy-b-D-glucopyranosyl-(1->3)-O-b-D-galactopyranosyl-(1->4)- D-GlucME6998921.430.790.871.271.081.100.740.71
Ganglioside GM3 (d18:1/23:0)ME6998871.190.890.950.980.961.190.930.91
Leukotriene F4ME6997171.071.130.950.991.081.070.810.90
PC(14:1(9Z)/P-16:0)ME6997571.390.840.940.970.731.250.831.04
PC(15:0/16:1(9Z))ME6997681.200.670.811.240.911.110.941.13
PG(16:0/16:0)ME6997721.651.041.050.820.971.060.440.97
PE(14:0/14:0)ME6997351.541.130.810.911.161.000.520.93
PE(18:4(6Z,9Z,12Z,15Z)/P-18:1(11Z))ME6997711.680.970.770.871.051.140.461.06
9^-Carboxy-gama-chromanolME6996221.581.161.150.701.071.110.670.55
PGP(18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z))ME6998331.340.861.080.891.231.270.610.71
Homoveratric acidME6995411.300.721.650.410.590.611.071.25
13^-carboxy-gama-tocotrienolME6996601.400.761.280.640.700.701.011.51
LPA(0:0/18:0)ME6996591.360.711.190.860.640.760.921.55
Ganglioside GM3 (d18:0/24:0)ME6998881.151.161.181.300.440.671.180.93
Ganglioside GM3 (d18:0/25:0)ME6998891.120.971.161.100.740.770.931.21
Heptanoic acidME6995261.520.740.751.020.810.671.271.23
PS(16:0/16:0)ME6997781.490.781.000.980.790.831.440.68
Prostaglandin E2 ethanolamideME6996330.910.860.801.571.050.131.411.26
MG(0:0/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)ME6996231.410.950.611.010.77NA1.161.09
TG(20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso3]ME6998781.520.700.851.371.220.121.051.16
12-Ketodeoxycholic acidME6996310.910.410.750.991.540.791.421.38
PI(16:0/20:0)ME6998451.290.280.571.071.340.641.191.62
PC(14:0/22:1(13Z))ME6997900.820.610.711.151.190.940.791.78
PC(15:0/20:3(5Z,8Z,11Z))ME6997830.790.910.670.771.540.641.071.61
6,7-Dimethyl-8-(1-D-ribityl)lumazineME6995921.550.700.640.321.420.141.111.83
SM(d17:1/24:1(15Z))ME6997971.530.880.720.881.240.590.651.52
SM(d19:1/24:1(15Z))ME6998161.520.910.750.851.150.400.941.47
ChitosanME6998941.620.341.061.620.66NA0.850.51
(S)-SuccinyldihydrolipoamideME6995761.251.031.211.380.12NA1.060.95
TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))[iso6]ME6998801.571.371.440.710.490.071.091.26
11^-Carboxy-alpha-tocotrienolME6996470.190.480.511.111.781.341.710.61
PE(18:1(11Z)/22:2(13Z,16Z))ME6997950.250.551.070.811.371.411.451.08
2,6 dimethylheptanoyl carnitineME6995720.880.820.760.830.681.461.491.08
PC(18:4(6Z,9Z,12Z,15Z)/P-16:0)ME6997790.630.450.461.361.051.431.481.15
3-Hydroxy-5, 8-tetradecadiencarnitineME6996271.190.810.740.910.850.942.040.50
DG(15:0/22:1(13Z)/0:0)ME6997371.020.370.430.911.200.882.101.09
TG(18:0/18:2(9Z,12Z)/20:1(11Z))[iso6]ME6998601.210.411.330.231.730.361.581.14
Inositol 1,3,4,5,6-pentakisphosphateME6997221.020.521.650.950.981.381.200.28
(R)-AmphetamineME6995271.420.891.530.401.340.741.510.31
2-Hexaprenyl-3-methyl-6-methoxy-1,4 benzoquinoneME6997132.030.780.291.051.280.630.170.20
Ganglioside GT3 (d18:1/16:0)ME6998971.720.100.460.931.181.13NANA
(S)-2,3-EpoxysqualeneME6996542.170.640.841.381.301.380.110.18
Indoleacetyl glutamineME6995731.600.650.791.091.491.240.080.46
PGP(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))ME6998461.480.370.811.291.251.14NA0.59
4,4-Dimethyl-14alpha-hydroxymethyl-5alpha-cholesta-8-en-3beta-olME6996662.160.090.151.811.240.390.280.09
Geranylgeranyl-PPME6996682.610.200.211.921.630.550.530.35
PentacosanoylglycineME6996611.640.010.012.001.410.930.020.98
LysoPC(18:2(9Z,12Z))ME6996961.600.300.441.281.561.050.391.40
N-HeptanoylglycineME6995401.740.100.271.481.200.970.261.67
Dimethylarsinous acidME6995241.150.020.021.592.211.090.720.56
TG(18:0/20:0/20:0)[iso3]ME6998681.900.090.141.941.351.230.740.62
Disialyllacto-N-tetraoseME6998901.630.390.351.411.670.860.950.74
TG(16:0/18:0/20:1(11Z))[iso6]ME6998531.810.400.421.631.470.860.980.45
5b-PregnediolME6995662.020.010.020.811.421.880.270.94
PC(20:2(11Z,14Z)/P-18:1(11Z))ME6997942.410.240.301.110.992.270.330.35
DG(14:0/20:2(11Z,14Z)/0:0)ME6997282.60NA0.110.910.350.99NA0.16
PE(15:0/18:4(6Z,9Z,12Z,15Z))ME6997602.500.15NA0.130.511.650.070.42
Dihydrofolic acidME6996642.340.630.651.050.761.230.570.77
PE(15:0/P-16:0)ME6997462.650.730.780.820.801.320.210.43
Lactyl-CoAME6998263.080.610.590.590.431.161.170.37
LysoPC(18:4(6Z,9Z,12Z,15Z))ME6996942.540.150.890.420.831.461.030.61

Factors:

F1Concentration (uM):0 | Treatment_compound:BSA
F2Concentration (uM):500 | Treatment_compound:CB-cis
F3Concentration (uM):500 | Treatment_compound:CB-trans
F4Concentration (uM):500 | Treatment_compound:CK-cis
F5Concentration (uM):500 | Treatment_compound:CK-trans
F6Concentration (uM):500 | Treatment_compound:K-cis
F7Concentration (uM):500 | Treatment_compound:Oleic acid
F8Concentration (uM):500 | Treatment_compound:Palmitic acid
Data matrix
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