Clustering data with hclust algorithm for (Study ST000444)

(Analysis AN000695)
MetaboliteStructureF1F2
PimelylcarnitineME1503800.471.53
Dihydroisomorphine-3-glucuronideME1503992.470.26
CabergolineME1504022.130.43
PC(14:00P-18:1(11Z))ME1504152.140.43
VerapamilME1502701.00NA
TrimethoprimME1502581.00NA
TerfenadineME1502661.00NA
NetilmicinME1503711.00NA
MeperidineME1503541.00NA
L-HistidineME1502771.00NA
D-GlucoseME1503701.00NA
CD 1790ME1504121.00NA
CandesartanME1503431.00NA
1-MethylhistidineME1502751.00NA
3-DechloroethylifosfamideME1504091.00NA
AcenocoumarolME1503761.880.12
MepyramineME1502481.830.17
15beta-hydroxycyproterone acetateME1503161.840.16
2-OctenoylcarnitineME1503831.840.16
4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol glucuronideME1503861.690.31
ImiquimodME1503461.680.32
15(S)-HETEME1502991.680.32
CyclopentolateME1502591.680.32
AndrostenedioneME1503191.700.30
O-Desmethylverapamil (D-702)ME1502691.700.30
LevonorgestrelME1503221.720.28
SR 494980MC-207,110ME1503441.710.29
Haloperidol 1,2,3,6-tetrahydropyridineME1502681.710.29
2,3-Dinor-6-keto-prostaglandin F1 aME1503031.710.29
DecanoylcarnitineME1502871.710.29
CinnarizineME1502631.810.19
NadololME1502461.780.22
D-UrobilinogenME1503491.800.20
GlisoxepideME1502711.790.21
Caprylic0Octanoic acidME1502911.790.21
Docosahexaenoic acidME1502961.790.21
Linoleic acidME1503901.760.24
AcitretinME1503351.760.24
9-DecenoylcarnitineME1502821.760.24
17a-EthynylestradiolME1503231.760.24
2,3-Dinor-TXB2ME1503041.760.24
Palmitoyl glucuronideME1503871.740.26
2,3-Methyleneglutaric acidME1502921.740.26
AlosetronME1503571.740.26
Prostaglandin E2ME1502971.730.27
DipivefrinME1502471.730.27
MestranolME1503211.730.27
LevocabastineME1503551.580.42
3-Hydroxytetradecanedioic acidME1502951.580.42
Delta-12-Prostaglandin J2ME1503021.580.42
MifepristoneME1503271.590.41
Ethacrynic acidME1502601.590.41
17-HydroxyprogesteroneME1503141.590.41
Buspirone N-oxideME1503391.590.41
ErlotinibME1503581.600.40
Retinoyl b-glucuronideME1503361.600.40
Prostaglandin F2aME1503011.640.36
IxabepiloneME1503781.640.36
Leukotriene B4ME1503001.640.36
MegestrolME1503881.660.34
GentamicinME1503721.650.35
ClidiniumME1502611.650.35
b-DihydrotetrabenazineME1504101.650.35
AlvimopanME1502731.650.35
2-Hydroxyestradiol-3-methyl etherME1503251.650.35
3-Hydroxy-cis-5-tetradecenoylcarnitineME1502881.650.35
ArtemetherME1503331.610.39
2-Octenedioic acidME1502931.610.39
AnserineME1502761.610.39
FluspirileneME1502671.620.38
DesmosineME1503811.630.37
Deoxydihydro-artemisininME1503921.630.37
CarphenazineME1503631.630.37
15-Deoxy-d-12,14-PGJ2ME1502981.630.37
BepridilME1502501.630.37
Tetrahydrocortisone0UrocortisoneME1503061.530.47
12-Hydroxynevirapine glucuronideME1503681.520.47
NevirapineME1503971.520.48
NabiloneME1503621.520.48
1,3-DiacetylpropaneME1503661.520.48
Homovanillic acidME1502561.520.48
AldosteroneME1503071.510.49
Ellagic acidME1503771.500.50
L-OctanoylcarnitineME1502811.540.46
5a-TetrahydrocortisolME1503051.540.46
16-a-HydroxypregnenoloneME1503151.540.46
(2S,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholineME1503641.540.46
MethylergonovineME1504141.550.45
SuccinylacetoneME1503821.550.45
NNAL-N-glucuronideME1503691.560.44
CarvedilolME1503591.560.44
16α-hydroxyprednisoloneME1503081.560.44
6beta-hydroxybudesonideME1503091.560.44
7C-aglyconeME1503341.570.43
Tafluprost free acidME1504041.570.43
QuinineME1504011.490.51
N1-Methyl-2-pyridone-5-carboxamideME1503531.490.51
DimenhydrinateME1502651.490.51
2-Hydroxy-imipramine glucuronideME1503611.490.51
CreatinineME1503451.490.51
(3a,5b,7a,12a)-24-[(carboxymethyl)amino]-1,12-dihydroxy-24-oxocholan-3-yl-b-D-Glucopyranosiduronic acidME1503101.480.52
L-LysineME1502781.480.52
N-desmethylimatinibME1502721.470.53
10-Hydroxy-octadec-12Z-enoate-9-beta-D-glucuronideME1503911.470.53
Cortolone-3-glucuronideME1503111.470.53
Proline betaineME1502791.460.54
DifluprednateME1503181.460.54
EdrophoniumME1502571.460.54
Androsterone glucuronideME1503121.420.58
DityrosineME1503791.410.59
HydralazineME1503561.410.59
4-HydroxynonenalME1503851.450.55
AlizaprideME1503941.450.55
AFN911ME1504131.430.57
Phosphoramide mustardME1504081.440.56
DeoxyartemsininME1503931.440.56
Dibucaine0cinchocaineME1503481.440.56
4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-butanoneME1503320.981.02
PropofolME1502540.991.01
2-MethylbutyroylcarnitineME1502841.001.00
Perillic acidME1503301.001.00
NizatidineME1503421.060.94
AcetyldigitoxinME1503281.040.96
Phthalic acidME1502521.040.96
2-Methyl-4-heptanoneME1503671.020.98
5^-(3^-Methoxy-4^-hydroxyphenyl)-gamma-valerolactoneME1502551.030.97
PiperitoneME1504050.791.10
L-HexanoylcarnitineME1502860.891.11
2-pentylfuranME1503500.931.07
Azelaic acidME1502900.941.06
CaffeineME1504001.190.81
cis-4-Hydroxycyclohexylacetic acidME1503651.200.80
RanolazineME1502801.210.79
4-HydroxypropofolME1502531.220.78
8-HydroxycarvedilolME1504111.220.78
TrimipramineME1503601.230.77
ThymolME1503311.240.76
5-Hydroxymethyl tolterodineME1502621.240.76
ProcyclidineME1502491.240.76
Diisobutyl phthalateME1502511.090.91
TirofibanME1503741.100.90
1-MethyladenosineME1504031.170.83
ButyrylcarnitineME1502831.170.83
ChloroquineME1503471.160.84
Methyl 4,8-decadienoateME1502851.160.84
Linalyl oxideME1503511.130.87
2,2,4-Trimethyl-1,3-pentadienol diisobutyrateME1504061.140.86
L-TyrosineME1503731.140.86
12-HydroxynevirapineME1503961.430.79
1-Methyl-4-nitroimidazoleME1503951.380.81
4-ene-Valproic acidME1504071.280.72
AntrafenineME1503401.290.71
NorethindroneME1503241.290.71
PC(o-18:2(9Z,12Z)024:0)ME1503891.300.70
UmbelliferoneME1503751.300.70
2-Propyl-2,4-pentadienoic acidME1502891.320.68
Vitamin D2 3-glucuronideME1503371.310.69
2,6-Di-tert-butylbenzoquinoneME1503291.310.69
ThiabendazoleME1503521.310.69
TerazosinME1503381.350.65
PivmecillinamME1502741.360.64
DipyridamoleME1503981.360.64
EstramustineME1503261.360.64
Deoxycholic acid 3-glucuronideME1503131.370.63
Traumatic acidME1502941.380.62
2-Hydroxycaproic acidME1503841.380.62
FluocinonideME1503171.380.62
DehydroepiandrosteroneME1503201.400.60
AzlocillinME1503411.390.61
FlunarizineME1502641.390.61

Factors:

F1Sample Treatment:Bubbled
F2Sample Treatment:Control
Data matrix
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