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Clustering data with hclust algorithm for (Study ST002243)
(Analysis AN003661)
Metabolite
Structure
F1
F2
F3
F4
DAG 18:0-18:0
ME541100
2.36
0.99
0.88
0.68
Cer 19:1;2/22:0
ME541069
1.12
1.42
1.11
0.84
Cer 19:1;2/23:0
ME541070
1.10
1.40
1.11
0.85
Cer 18:0;2/23:0
ME541052
1.09
1.35
1.11
0.86
Cer m18:0/24:1
ME541075
1.07
1.39
1.12
0.86
Cer m18:0/24:0
ME541074
1.12
1.40
1.22
0.80
Cer m19:0/24:1
ME541079
1.08
1.40
1.18
0.83
Cer m18:1/24:0
ME541077
1.11
1.30
1.23
0.81
Cer 18:2;2/25:0
ME541068
1.10
1.32
1.20
0.83
Cer 19:1;2/24:0
ME541071
1.10
1.34
1.18
0.83
Cer m18:1/22:0
ME541076
1.10
1.34
1.19
0.83
Cer 18:1;2/26:0
ME541062
1.04
1.36
1.18
0.84
Cer m18:0/22:0
ME541073
1.06
1.34
1.18
0.84
CE 20:5
ME541089
1.00
1.37
1.31
0.79
Cer m19:0/24:0
ME541078
1.05
1.49
1.34
0.75
TAG 16:0-18:0-22:0
ME541237
1.19
0.81
0.89
1.03
TAG 16:0-18:0-18:0
ME541234
1.16
1.00
0.86
1.02
TAG 16:0-18:0-20:0
ME541236
1.13
0.98
0.74
1.08
TAG 18:0-18:0-18:0
ME541255
1.11
0.97
0.74
1.09
CAR 12:0
ME541031
0.98
1.19
1.08
0.93
CE 18:3
ME541085
0.96
1.25
1.06
0.94
Cer 18:1;2/26:1
ME541063
1.02
1.33
1.11
0.88
SM(d34:0)
ME541175
1.04
1.24
1.07
0.92
CAR 20:0
ME541040
1.05
1.27
1.09
0.90
TAG 18:0-18:0-20:4
ME541257
1.05
1.26
1.08
0.90
CAR 14:0
ME541032
1.00
1.27
1.05
0.93
CAR 20:1
ME541041
1.01
1.27
1.08
0.91
Cer 19:1;2/24:1
ME541072
1.02
1.29
1.07
0.91
Cer 18:2;2/22:0
ME541064
1.06
1.18
1.11
0.90
SM(d42:1)
ME541188
1.08
1.19
1.11
0.90
Cer 18:0;2/22:0
ME541051
1.03
1.22
1.12
0.90
Cer 18:1;2/22:0
ME541058
1.04
1.21
1.10
0.91
PE P-18:0/22:6
ME541327
1.07
1.14
1.11
0.91
SM(d38:1)
ME541183
1.10
1.14
1.09
0.91
SM(d40:1)
ME541186
1.08
1.16
1.08
0.91
SM(d40:2)
ME541187
1.09
1.17
1.07
0.91
SM(d38:2)
ME541184
1.04
1.16
1.07
0.93
PC O-18:0/22:6
ME541315
1.05
1.14
1.06
0.93
Cer 18:1;2/24:1
ME541061
1.04
1.15
1.05
0.94
LPC 18:0
ME541144
1.05
1.15
1.04
0.94
CE 22:6
ME541092
1.02
1.18
1.09
0.92
Cer 18:0;2/24:1
ME541054
1.06
1.19
1.06
0.92
SM(d44:1)
ME541191
1.04
1.19
1.07
0.92
TAG 18:2-18:2-22:6
ME541295
1.14
1.23
1.10
0.87
Cer 18:1;2/23:0
ME541059
1.09
1.25
1.11
0.88
SM(d32:1)
ME541173
1.11
1.23
1.12
0.88
SM(d32:0)
ME541172
1.11
1.24
1.10
0.88
TAG 18:1-18:2-22:5
ME541285
1.11
1.23
1.10
0.88
Cer 18:2;2/23:0
ME541065
1.11
1.26
1.14
0.86
Cer 18:0;2/24:0
ME541053
1.06
1.27
1.16
0.86
PC O-18:0/18:1
ME541312
1.07
1.25
1.14
0.87
Cer 18:2;2/24:0
ME541066
1.09
1.19
1.18
0.86
Cer 18:1;2/24:0
ME541060
1.07
1.19
1.16
0.87
LPC 20:5
ME541158
1.07
1.19
1.18
0.87
TAG 16:0-18:1-22:6
ME541243
1.09
1.13
1.17
0.88
TAG 18:1-18:2-22:6
ME541286
1.13
1.15
1.15
0.87
SM(d36:3)
ME541182
1.14
1.32
0.94
0.93
TAG 18:0-18:2-22:6
ME541266
1.12
1.31
1.09
0.87
TAG 18:2-18:3-20:4
ME541297
1.14
1.33
1.02
0.89
DAG 18:0-18:2
ME541102
1.15
1.24
0.98
0.92
CE 16:1
ME541081
1.08
1.27
1.02
0.92
SM(d32:2)
ME541174
1.12
1.27
1.05
0.89
SM(d34:3)
ME541178
1.15
1.25
1.05
0.89
DAG 18:0-18:1
ME541101
1.14
1.21
1.04
0.91
SM(d34:2)
ME541177
1.10
1.23
1.04
0.91
CAR 20:4
ME541044
0.91
1.26
1.02
0.97
DAG 18:2-18:3
ME541110
1.04
1.37
0.91
0.96
TAG 18:2-18:3-18:3
ME541296
1.02
1.34
0.91
0.97
CAR 16:1
ME541036
1.05
1.31
0.95
0.95
DAG 18:1-18:3
ME541105
1.04
1.28
0.98
0.95
CAR 14:1
ME541033
1.01
1.27
0.97
0.96
TAG 15:0-18:2-18:3
ME541224
1.02
1.29
0.97
0.96
DAG 18:2-18:2
ME541109
1.08
1.26
0.94
0.95
CAR 14:2
ME541034
1.03
1.22
0.97
0.96
SM(d36:2)
ME541181
1.04
1.21
0.96
0.97
SM(d36:0)
ME541179
1.05
1.24
0.95
0.96
TAG 18:0-18:2-18:2
ME541264
1.02
1.25
0.95
0.97
TAG 17:1-18:2-18:2
ME541254
1.09
1.20
0.94
0.97
TAG 16:1-18:2-18:3
ME541306
1.05
1.25
0.91
0.98
TAG 18:0-18:0-18:1
ME541256
1.06
1.20
0.91
0.99
TAG 18:2-18:2-18:3
ME541292
1.05
1.22
0.92
0.98
DAG 16:0-18:0
ME541095
1.23
1.07
1.07
0.90
TAG 14:0-16:0-22:6
ME541210
1.13
0.98
1.12
0.92
TAG 18:1-18:2-20:0
ME541280
1.10
0.99
1.12
0.92
TAG 17:0-18:1-18:2
ME541249
1.01
1.13
1.00
0.97
TAG 16:0-17:1-18:2
ME541233
1.00
1.12
0.97
0.99
AEA 18:0
ME541047
1.02
1.11
0.98
0.98
TAG 18:1-18:2-20:4
ME541282
1.01
1.12
0.98
0.98
TAG 16:0-18:0-18:1
ME541235
1.07
1.10
0.99
0.97
TAG 18:0-18:1-22:4
ME541263
1.04
1.09
1.00
0.97
TAG 14:0-17:1-18:1
ME541211
1.05
1.08
1.01
0.97
TAG 14:0-18:1-18:1
ME541212
1.05
1.09
1.01
0.97
TAG 18:1-18:1-18:2
ME541268
1.04
1.07
0.98
0.99
HexCer 18:2;2/22:0
ME541134
1.02
1.09
0.96
0.99
TAG 17:0-18:0-18:1
ME541247
1.02
1.08
0.98
0.99
HexCer 18:1;2/23:0
ME541130
1.06
1.10
0.96
0.99
TAG 16:0-18:1-18:2
ME541239
1.04
1.10
0.98
0.98
TAG 16:0-17:0-18:0
ME541230
1.04
1.04
0.95
1.00
CE 22:5
ME541091
1.03
1.05
0.97
1.00
Hex3Cer 18:1;2/20:0
ME541122
1.03
1.04
0.98
1.00
Hex3Cer 18:1;2/18:0
ME541121
1.04
1.08
0.94
1.00
HexCer 18:1;2/20:0
ME541128
1.03
1.11
0.93
1.00
TAG 16:0-16:1-18:3
ME541229
0.96
1.13
0.97
1.00
AEA 18:2
ME541049
0.95
1.10
1.01
0.99
TAG 16:0-18:1-18:1
ME541238
0.97
1.10
1.02
0.98
SM(d38:3)
ME541185
0.96
1.07
1.00
1.00
HexCer 18:2;2/24:0
ME541135
0.98
1.09
0.98
0.99
TAG 18:0-18:1-18:1
ME541258
0.98
1.08
0.99
1.00
TAG 14:0-16:1-18:2
ME541298
0.99
1.11
0.99
0.99
TAG 15:0-16:1-18:2
ME541220
0.98
1.10
1.00
0.99
Cer 18:0;2/16:0
ME541050
0.99
1.16
1.06
0.95
Cer 18:1;2/20:0
ME541057
0.98
1.15
1.04
0.96
TAG 15:0-18:1-18:2
ME541222
0.99
1.14
1.02
0.97
CAR 16:0
ME541035
1.00
1.15
1.03
0.96
CAR 20:2
ME541042
0.99
1.15
1.02
0.96
PC O-18:0/22:4
ME541314
1.04
1.12
1.01
0.96
TAG 16:0-16:0-18:2
ME541228
1.03
1.13
1.01
0.96
CE 20:4
ME541088
1.02
1.12
1.04
0.96
DAG 18:1-18:1
ME541103
1.03
1.13
1.03
0.95
TAG 17:1-18:1-18:1
ME541252
1.01
1.09
1.01
0.98
LPE 22:6
ME541171
1.01
1.10
1.03
0.96
Cer 18:1;2/16:0
ME541055
1.00
1.09
1.02
0.97
TAG 17:0-18:1-18:1
ME541248
1.00
1.09
1.02
0.97
Hex2Cer 18:1;2/18:0
ME541113
1.01
1.10
1.02
0.97
TAG 18:1-18:1-22:5
ME541276
1.01
1.10
1.02
0.97
TAG 15:0-16:0-18:2
ME541218
0.99
1.11
1.04
0.96
LPC 22:6
ME541163
0.99
1.08
1.04
0.97
TAG 14:0-16:0-18:2
ME541209
0.98
1.08
1.04
0.97
TAG 14:0-18:2-18:2
ME541213
0.97
1.22
0.97
0.98
TAG 14:0-18:2-18:3
ME541214
0.98
1.22
0.96
0.98
Cer 18:1;2/18:0
ME541056
0.98
1.21
0.94
0.99
TAG 16:0-18:2-18:3
ME541245
1.00
1.22
0.94
0.98
TAG 18:1-18:2-18:3
ME541279
1.00
1.20
0.95
0.98
TAG 16:0-18:3-18:3
ME541246
1.02
1.18
0.98
0.97
TAG 18:1-18:1-18:3
ME541269
1.00
1.20
0.98
0.97
TAG 16:0-18:1-18:3
ME541240
1.00
1.16
0.99
0.97
TAG 18:0-18:2-19:1
ME541265
1.00
1.17
1.01
0.97
CAR 18:2
ME541039
0.98
1.18
0.97
0.98
CE 16:0
ME541080
0.98
1.17
0.98
0.98
CAR 18:1
ME541038
0.98
1.18
1.00
0.97
CAR 20:3
ME541043
0.96
1.18
1.00
0.98
TAG 18:1-18:2-18:2
ME541308
1.10
1.11
0.96
0.97
Hex2Cer 18:2;2/16:0
ME541119
1.06
1.14
1.01
0.95
SM(d44:3)
ME541193
1.07
1.13
1.00
0.96
TAG 18:0-18:1-20:0
ME541261
1.12
1.13
1.01
0.94
DAG 16:0-18:2
ME541097
1.09
1.12
1.02
0.94
SM(d42:3)
ME541190
1.09
1.13
1.01
0.95
CAR 18:0
ME541037
1.01
1.20
1.01
0.95
CE 20:3
ME541087
1.03
1.18
1.01
0.95
DAG 18:1-20:4
ME541108
1.07
1.18
1.03
0.93
SM(d44:2)
ME541192
1.05
1.19
1.03
0.94
CE 18:0
ME541082
1.08
1.21
1.00
0.94
DAG 18:1-18:2
ME541104
1.07
1.18
0.99
0.95
TAG 15:0-18:2-18:2
ME541223
1.05
1.20
0.99
0.95
TAG 18:0-18:1-18:2
ME541259
1.05
1.19
0.99
0.95
TAG 18:2-18:2-20:4
ME541294
1.06
1.15
0.91
0.99
SM(d36:1)
ME541180
1.06
1.17
0.98
0.96
TAG 17:0-18:2-20:4
ME541250
1.05
1.17
0.97
0.97
DAG 16:1-18:2
ME541099
1.07
1.17
0.96
0.97
TAG 16:0-18:2-18:2
ME541244
1.07
1.15
0.95
0.97
TAG 17:1-18:1-18:2
ME541253
1.04
1.13
0.97
0.98
TAG 16:1-18:1-18:2
ME541305
1.05
1.15
0.96
0.98
TAG 17:1-18:0-18:1
ME541251
1.03
1.16
0.97
0.98
TAG 18:2-18:2-18:2
ME541291
1.03
1.16
0.95
0.98
Hex2Cer 18:1;2/24:1
ME541117
0.92
1.05
1.05
0.99
TAG 14:0-15:0-18:2
ME541204
0.90
1.07
1.04
1.00
AEA 16:0
ME541046
0.90
1.02
1.05
1.00
AEA 18:1
ME541048
0.92
0.99
1.04
1.00
TAG 12:0-16:0-18:1
ME541200
0.91
1.01
1.02
1.01
HexCer 18:1;2/16:0
ME541126
0.96
1.03
0.94
1.03
TAG 12:0-16:0-18:2
ME541201
0.92
1.04
0.97
1.02
TAG 15:0-16:0-18:1
ME541217
0.97
0.99
1.03
1.00
Hex2Cer 18:1;2/24:2
ME541118
0.99
1.01
0.97
1.01
CE 22:4
ME541090
0.95
1.04
0.98
1.01
Hex2Cer 18:1;2/20:0
ME541114
0.95
1.03
1.00
1.00
LPC 22:5
ME541162
0.97
1.01
1.00
1.01
TAG 18:0-18:1-19:1
ME541260
0.96
1.02
1.00
1.01
TAG 15:0-16:1-16:1
ME541219
1.11
1.01
0.97
0.98
TAG 16:0-16:0-18:0
ME541226
1.12
1.03
0.98
0.97
Cer 18:2;2/24:1
ME541067
1.07
1.11
1.08
0.92
TAG 16:0-18:1-22:5
ME541242
1.06
1.09
1.09
0.93
SM(d34:1)
ME541176
1.06
1.11
1.03
0.95
CE 18:1
ME541083
1.03
1.10
1.06
0.95
DAG 16:1-18:1
ME541098
1.06
1.08
1.04
0.95
PC O-18:0/20:3
ME541313
1.04
1.09
1.04
0.96
CE 18:2
ME541084
1.04
1.08
1.06
0.95
LPE 18:0
ME541167
1.05
1.09
1.05
0.95
DAG 18:1-20:3
ME541107
1.10
1.10
1.04
0.94
LPC 16:1
ME541141
1.07
1.08
1.02
0.96
SM(d42:2)
ME541189
1.09
1.08
1.02
0.95
PE P-18:0/18:2
ME541323
1.08
1.06
1.08
0.93
DAG 16:0-18:1
ME541096
1.06
1.03
1.09
0.94
LPC 17:0
ME541142
1.05
1.04
1.08
0.94
TAG 18:2-18:2-20:0
ME541293
1.06
1.03
1.12
0.93
LPC 14:0
ME541137
1.08
1.04
1.10
0.93
Hex2Cer 18:1;2/14:0
ME541111
1.06
1.04
1.10
0.93
LPC 19:0
ME541150
1.06
1.05
1.11
0.93
LPC O-18:0
ME541145
1.02
1.06
1.04
0.97
PC O-16:0/20:4
ME541310
1.02
1.06
1.07
0.95
LPC 15:0
ME541138
1.03
1.05
1.06
0.95
LPC 16:0
ME541139
1.03
1.05
1.05
0.96
LPC 24:1
ME541165
1.01
1.08
1.09
0.94
LPC 19:1
ME541151
1.03
1.04
1.09
0.94
LPC 20:0
ME541152
1.02
1.05
1.09
0.95
LPC 20:2
ME541155
1.03
0.94
1.10
0.96
DAG 16:0-16:0
ME541094
1.05
0.94
1.10
0.95
TAG 18:1-18:1-20:0
ME541270
1.05
0.94
1.09
0.96
LPC 20:1
ME541154
1.00
1.01
1.10
0.95
PE P-18:0/18:1
ME541322
1.02
0.98
1.11
0.95
LPC 17:1
ME541143
1.04
1.01
1.08
0.95
LPC 18:1
ME541146
1.02
1.00
1.07
0.96
LPC O-16:0
ME541140
1.02
1.00
1.06
0.97
LPC 18:2
ME541148
1.02
0.97
1.07
0.97
TAG 14:0-16:0-16:1
ME541302
1.01
0.98
1.04
0.98
TAG 14:1-16:0-18:1
ME541215
0.99
0.99
1.06
0.98
TAG 16:0-16:0-18:1
ME541227
1.08
1.02
1.03
0.96
TAG 16:0-18:1-20:4
ME541241
1.07
1.03
1.02
0.97
CE 20:2
ME541086
1.08
1.05
1.03
0.95
TAG 14:0-16:1-18:0
ME541303
1.08
1.04
1.05
0.95
TAG 14:0-16:0-18:0
ME541207
1.08
0.98
1.04
0.97
LPE 16:0
ME541166
1.04
0.98
1.03
0.98
LPE 18:2
ME541169
1.05
1.00
1.02
0.98
TAG 15:0-16:0-18:0
ME541216
1.06
1.01
1.02
0.98
LPC O-20:0
ME541153
0.99
1.02
1.07
0.97
TAG 14:0-16:0-18:1
ME541208
0.97
1.02
1.07
0.97
LPC 20:4
ME541157
0.99
1.02
1.04
0.98
LPE 20:4
ME541170
0.98
1.04
1.04
0.98
TAG 15:0-18:1-18:1
ME541221
1.00
1.04
1.04
0.98
TAG 18:1-18:1-20:3
ME541272
1.02
1.06
0.99
0.99
HexCer 18:1;2/22:0
ME541129
1.00
1.06
1.00
0.99
TAG 12:0-18:1-18:2
ME541202
1.01
1.07
1.00
0.98
HexCer 18:1;2/24:0
ME541131
1.00
1.04
1.01
0.99
PC O-16:0/16:0
ME541309
1.00
1.04
1.02
0.99
PC O-18:0/16:0
ME541311
1.00
1.07
1.02
0.98
TAG 18:1-18:1-18:1
ME541267
0.98
1.06
1.01
0.99
TAG 16:0-16:0-17:1
ME541225
1.02
1.01
0.99
1.00
TAG 18:1-18:1-22:4
ME541275
1.02
1.02
1.01
0.99
TAG 14:1-16:0-18:2
ME541299
0.99
1.01
1.00
1.00
Hex2Cer 18:1;2/16:0
ME541112
0.99
1.01
1.02
0.99
Hex3Cer 18:1;2/24:1
ME541125
1.01
1.00
1.02
0.99
TAG 16:0-17:0-18:1
ME541231
1.02
1.04
1.01
0.98
TAG 16:0-17:1-18:1
ME541232
1.04
1.05
1.01
0.98
Hex3Cer 18:1;2/16:0
ME541120
1.04
1.03
1.03
0.97
LPC 20:3
ME541156
1.04
1.02
1.03
0.97
LPC 18:3
ME541149
1.02
1.03
1.03
0.97
LPC O-18:1
ME541147
1.01
1.03
1.04
0.97
TAG 18:1-18:1-22:1
ME541274
1.01
0.90
1.20
0.93
TAG 18:1-18:2-22:1
ME541284
1.01
0.95
1.17
0.93
PE P-16:0/20:4
ME541318
0.92
0.95
1.16
0.96
TAG 18:1-18:2-24:1
ME541288
0.96
0.91
1.14
0.97
Hex3Cer 18:1;2/22:0
ME541123
0.92
0.97
1.08
0.99
TAG 14:0-15:0-18:1
ME541203
0.95
0.96
1.08
0.99
Hex2Cer 18:1;2/22:0
ME541115
0.91
1.00
1.11
0.98
PE P-18:0/20:4
ME541324
0.95
1.00
1.11
0.97
PE P-18:0/22:5
ME541326
0.94
0.99
1.10
0.97
DAG 14:0-18:1
ME541093
0.97
0.99
1.09
0.97
Hex3Cer 18:1;2/24:0
ME541124
0.96
1.01
1.09
0.97
Hex2Cer 18:1;2/24:0
ME541116
0.93
1.03
1.14
0.95
LPC 22:0
ME541159
0.98
1.00
1.17
0.93
PE P-16:0/18:1
ME541316
0.96
0.98
1.15
0.95
PE P-18:1/20:4
ME541329
0.98
0.99
1.13
0.95
TAG 18:1-18:2-26:1
ME541290
0.95
1.14
1.20
0.90
PE P-16:0/22:6
ME541321
1.01
1.10
1.12
0.93
PE P-18:1/22:6
ME541328
1.00
1.11
1.12
0.93
CAR 24:0
ME541045
1.07
1.06
1.17
0.89
LPC 24:0
ME541164
1.02
1.07
1.17
0.91
LPC 22:1
ME541160
1.01
1.03
1.16
0.92
PE P-16:0/18:2
ME541317
1.01
1.02
1.15
0.93
PE P-16:0/22:4
ME541320
0.84
0.79
1.05
1.06
TAG 12:0-15:0-18:1
ME541198
0.80
0.84
1.05
1.06
PE P-18:0/22:4
ME541325
0.74
0.69
1.04
1.11
SPHP d18:1
ME541195
0.79
0.75
1.02
1.10
LPC 22:4
ME541161
0.95
0.88
0.93
1.06
TAG 12:0-14:0-18:1
ME541197
0.96
0.92
0.91
1.07
TAG 12:0-16:0-16:1
ME541301
0.96
0.92
0.91
1.07
HexCer 18:1;2/24:2
ME541133
1.04
0.92
0.86
1.07
HexCer 18:1;2/18:0
ME541127
1.02
1.04
0.88
1.04
HexCer 18:1;2/24:1
ME541132
1.02
0.95
0.92
1.04
HexCer 18:2;2/24:1
ME541136
1.01
0.99
0.91
1.04
TAG 10:0-16:0-18:1
ME541300
0.97
0.79
1.13
0.99
TAG 18:1-18:1-24:1
ME541277
0.94
0.85
1.14
0.98
LPE 18:1
ME541168
1.02
0.87
1.07
0.99
TAG 18:1-18:1-20:1
ME541271
1.00
0.87
1.08
0.99
TAG 14:0-16:0-16:0
ME541205
1.00
0.92
1.06
0.99
TAG 14:0-16:0-17:0
ME541206
0.96
0.93
1.03
1.01
TAG 18:1-18:2-20:1
ME541281
0.97
0.90
1.04
1.01
SPHP d18:2
ME541196
0.91
0.92
1.01
1.04
SPH d18:1
ME541194
0.93
0.85
1.03
1.03
TAG 12:0-16:0-16:0
ME541199
0.94
0.85
1.00
1.04
TAG 18:1-18:2-22:0
ME541283
1.24
0.89
1.30
0.82
TAG 18:1-18:2-26:0
ME541289
1.11
0.92
1.35
0.83
TAG 18:1-18:1-26:0
ME541278
1.11
0.85
1.31
0.86
TAG 18:1-18:2-24:0
ME541287
1.17
0.89
1.29
0.85
TAG 18:0-18:1-22:0
ME541262
1.31
0.89
1.18
0.85
TAG 16:0-16:0-22:0
ME541304
1.21
0.72
1.16
0.93
TAG 16:0-18:1-24:0
ME541307
1.19
0.80
1.19
0.90
TAG 18:1-18:1-22:0
ME541273
1.20
0.77
1.22
0.89
DAG 18:1-20:0
ME541106
0.98
0.92
1.53
0.79
PE P-16:0/20:5
ME541319
0.86
1.12
1.40
0.84
Factors:
F1
Group:-
F2
Group:Carrier
F3
Group:Control
F4
Group:Patient
Data matrix
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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