Clustering data with hclust algorithm for (Study ST003028)

(Analysis AN004964)
MetaboliteStructureF1F2
Hyodeoxycholic AcidME7807970.311.69
Taurocholic AcidME7807950.191.81
Taurochenodesoxycholic AcidME7807960.141.86
Tauroursodeoxycholic AcidME7807940.131.87
Indole-3-EthanolME7810971.620.38
2-Methoxybenzoic AcidME7807871.470.53
EnterodiolME7808041.520.48
4-HydroxyhippurateME7810840.721.28
Glycochenodeoxycholic AcidME7807990.691.31
2,5-Dihydroxy Benzoic AcidME7807860.591.41
Ursodeoxycholic AcidME7807930.651.35
2,4-Dihydroxybenzoic AcidME7809370.641.36
Inosine 5^-MonophosphateME7808140.631.37
3-(3-Hydroxyphenyl)Propionate AcidME7809091.340.66
Phenyllactate (Pla)ME7808731.340.66
3-(4-Hydroxyphenyl)-Propionic AcidME7807881.300.70
Mandelic AcidME7808711.300.70
3-Hydroxypicolinic acidME7809771.310.69
L-3-Phenyllactic AcidME7808671.310.69
OrotidineME7809271.270.73
AspirinME7810281.260.74
3,3^,5^-TriiodothyronineME7810991.260.74
4-MethylcatecholME7808021.260.74
S-(5-Adenosy)-L-HomocysteineME7807761.290.71
PantetheineME7809251.280.72
P–Hydroxyphenyl Acetic AcidME7807921.280.72
PorphobilinogenME7809981.170.83
PDX [10(S),17(S)-dihydroxy-4Z,7Z,11E,13Z,15E,19Z-docosahexaenoic acid]ME7810721.170.83
Oxoadipic AcidME7809331.170.83
3-Indolepropionic AcidME7808441.170.83
Hexadecanedioic acidME7810081.170.83
Scyllo inositolME7810861.160.84
Pyridoxal 5^-PhosphateME7808201.160.84
5-MethoxytryptopholME7809891.160.84
Nicotinamide-N-OxideME7808401.160.84
Deoxyribose 5-PhosphateME7809311.120.88
2,2-Dimethyl Succinic acidME7809921.120.88
5-Hydroxyhexanoic AcidME7809221.120.88
Indole-3-CarboxaldehydeME7808461.130.87
D-FructoseME7808321.130.87
2-Methylglutaric AcidME7809201.130.87
CinnamoylglycineME7809681.130.87
Α-Hydroxyisobutyric AcidME7808781.140.86
Hexanoyl GlycineME7807651.140.86
Galactaric acidME7809631.140.86
Flavin Adenine DinucleotideME7808111.140.86
4-Hydroxybenzoic AcidME7807911.140.86
3-Methylglutaric acidME7809621.140.86
2-Hydroxybutanoic AcidME7808501.140.86
3,4-Dihydroxybenzeneacetic AcidME7807891.140.86
γ-Linolenic Acid(C18:3N6)ME7808951.150.85
MyoinositolME7810831.150.85
INDOLE-3-CARBINOLME7809711.150.85
Arachidic Acid(C20:0)ME7809061.150.85
GDP-L-fucoseME7809751.150.85
Kinic AcidME7808661.220.78
13-HOTrE [13S-hydroxy-9Z,11E,15Z-octadecatrienoic acid]ME7808931.240.76
3-Hydroxyanthranilic AcidME7807901.240.76
N-Acetylaspartylglutamic acidME7809701.230.77
D-GlucuronolactoneME7810941.230.77
FormononetinME7810001.230.77
TxB3 [9α,11,15S-trihydroxythromba-5Z,13E,17Z-trien-1-oic acid]ME7810811.190.81
Phe-PheME7807751.190.81
HydroquinoneME7810031.190.81
4-Hydroxy-L-Glutamic AcidME7807621.190.81
Citric AcidME7808221.190.81
XanthosineME7809541.180.82
L-Malic AcidME7808241.180.82
9,10-DiHOME [(±)9,10-dihydroxy-12Z-octadecenoic acid]ME7808941.180.82
9-HpodeME7808921.180.82
TXB2 [9α,11,15S-trihydroxythromba-5Z,13E-dien-1-oic acid]ME7808791.200.80
Guanidinoethyl SulfonateME7808641.200.80
D-Malic AcidME7808231.200.80
DL-3,4-Dihydroxyphenyl glycolME7809601.200.80
D-GlucopyranoseME7809291.200.80
Azelaic AcidME7808581.200.80
13-methylmyristic acidME7810901.200.80
Anthranilic acidME7810041.200.80
D-(+)-Malic acidME7809831.210.79
Α-Linolenic Acid(C18:3N3)ME7809071.210.79
RvD5 [7S,17S-dihydroxy-4Z,8E,10Z,13Z,15E,19Z-docosahexaenoic acid]ME7810801.110.89
Pyrrole-2-Carboxylic AcidME7808751.110.89
Indole-2-Carboxylic AcidME7808451.110.89
D-MannoseME7808351.110.89
D-GlucoseME7808341.110.89
D-GlucarateME7809531.110.89
Butyl?AcetateME7810231.110.89
BiopterinME7809131.110.89
A-Ketoglutaric AcidME7808261.110.89
2^-Deoxycytidine-5^-MonophosphateME7809281.110.89
2-n-PentylfuranME7810251.110.89
PGD1 [9α,15S-dihydroxy-11-oxo-prost-13E-en-1-oic acid]ME7810731.100.90
GlucotropaeolinME7809961.100.90
3-HydroxybutyrateME7808541.100.90
(±)4-HDHA [(±)4-hydroxy-5E,7Z,10Z,13Z,16Z,19Z-docosahexaenoic acid]ME7810501.100.90
Terephthalic AcidME7807851.060.94
Lysope 14:0ME7808881.060.94
Indoxylsulfuric acidME7809971.060.94
Hypoxanthine-9-β-D-ArabinofuranosideME7809261.060.94
EthylsalicylateME7810171.060.94
estrone 3-sulfateME7809561.060.94
Elaidic Acid (C18:1N9T)ME7809011.060.94
Citraconic AcidME7809321.060.94
3-Methyladipic acidME7809611.060.94
14(S)-HDHA [14S-hydroxy-4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoic acid]ME7810591.060.94
(±)18-HETE [(±)18-hydroxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid]ME7810491.060.94
Tridecanoic AcidME7808961.070.93
Tetradecanedioic acidME7809871.070.93
SulfacetamideME7810241.070.93
PyrophosphateME7810091.070.93
PHENYL-BETA-D-GLUCOPYRANOSIDEME7810341.070.93
PGF2α [9α,11α,15S-trihydroxy-prosta-5Z,13E-dien-1-oic acid]ME7810771.070.93
N-lactoyl-phenylalanineME7809781.070.93
N-Acetyl-L-TyrosineME7807701.070.93
Myristic acidME7810821.070.93
MalonicacidME7808701.070.93
LXA5 [5S,6R,15S-trihydroxy-7E,9E,11Z,13E,17Z-eicosapentaenoic acid]ME7810701.070.93
Hexadecanoic Acid (C16:0)ME7808981.070.93
Fumaric AcidME7809421.070.93
D-Lactic AcidME7808621.070.93
Cysteine glutathione disulfideME7810871.070.93
Creatine PhosphateME7808611.070.93
Carbamoyl phosphateME7809941.070.93
Cis-11,14-Eicosadienoic Acid (C20:2)ME7809041.070.93
PGE1 [9-oxo-11α,15S-dihydroxy-prost-13E-en-1-oic acid]ME7810741.080.92
N-Oleoyl GlycineME7810011.080.92
N-AcetylvalineME7809801.080.92
Methylmalonic AcidME7808721.080.92
InosineME7808131.080.92
EPA [5Z,8Z,11Z,14Z,17Z-eicosapentaenoic acid]ME7809021.080.92
DeoxyadenosineME7809181.080.92
cis-7-Hexadecenoic AcidME7809731.080.92
AllantoinME7807631.080.92
9-HOTrE [9S-hydroxy-10E,12Z,15Z-octadecatrienoic acid]ME7809431.080.92
2,6-DihydroxypurineME7808071.080.92
(±)15-HEPE [(±)-15-hydroxy-5Z,8Z,11Z,13E,17Z-eicosapentaenoic acid]ME7810441.080.92
(±)17-HETE [(±)17-hydroxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid]ME7810471.080.92
TRP-GLUME7810881.090.91
PGF1α [9α,11α,15S-trihydroxy-prost-13E-en-1-oic acid]ME7810761.090.91
Palmitoleic Acid (C16:1)ME7808971.090.91
Lysops 22:6ME7808831.090.91
Lysopa 16:0ME7808901.090.91
L-Lactic AcidME7808681.090.91
InositolME7808051.090.91
D-GalactoseME7808331.090.91
Adipic AcidME7808571.090.91
(±)16-HETE [(±)16-hydroxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid]ME7810451.090.91
3-Indolebutyric AcidME7808431.090.91
Vanillic AcidME7808770.961.04
S-Sulfo-L-CysteineME7807780.961.04
PalmitaldehydeME7809400.961.04
N-acetylornithineME7810910.961.04
N-acetyl-beta-alanineME7810850.961.04
L-ArabitolME7808300.961.04
Dimethylmalonic acidME7809930.961.04
D-Glucoronic AcidME7808380.961.04
5-HydroxymethyluracilME7808090.961.04
15-oxoETE [15-oxo-5Z,8Z,11Z,13E-eicosatetraenoic acid]ME7810600.961.04
(3-Methoxy-4-hydroxyphenyl)ethylene glycol sulfateME7809510.961.04
PantothenateME7808390.971.03
N-AcetylthreonineME7809240.971.03
LTE4 [5S-hydroxy-6R-(S-cysteinyl)-7E,9E,11Z,14Z-eicosatetraenoic acid]ME7810690.971.03
Dihydroxyacetone phosphateME7810130.971.03
(±)7-HDHA [(±)7-hydroxy-4Z,8E,10Z,13Z,16Z,19Z-docosahexaenoic acid]ME7810530.971.03
3-Methoxy-4-Hydroxyphenylethyleneglycol SulfateME7809340.971.03
2-Aminoisobutyric AcidME7808490.971.03
3-Hydroxy-3-Methyl Butyric AcidME7808530.971.03
N-AcetylmethionineME7809450.991.01
Lysope 18:0ME7808860.991.01
Lysopa 18:0ME7808890.991.01
L-ArginineME7807560.991.01
D-Xylulose 5-phosphateME7810070.991.01
D-Glucosamine 6-PhosphateME7810930.991.01
D-Alanyl-D-AlanineME7807640.991.01
1-Naphthylacetic AcidME7808470.991.01
Citramalic AcidME7808270.991.01
Thiamine TriphosphateME7809210.981.02
(S)-(-)-2-Hydroxyisocaproic AcidME7809080.981.02
O-Phospho-L-SerineME7807740.981.02
N-Amidino-L-AspartateME7810960.981.02
Methanesulfonic acidME7810370.981.02
LipoxinA4 [5S,6R,15S-trihydroxy-7E,9E,11Z,13E-eicosatetraenoic acid]ME7808910.981.02
EpinephrineME7808190.981.02
D-Mannose 6-phosphateME7809790.981.02
Dl-Glyceraldehyde3-PhosphateME7809360.981.02
D-Fructose 6-phosphateME7809850.981.02
2^-DeoxyuridineME7808080.981.02
Cyclamic acidME7809820.981.02
UracilME7808151.001.00
Ribulose-5-PhosphateME7809461.001.00
Nonadecylic acidME7810921.001.00
LTD4 [5S-hydroxy-6R-(S-cysteinylglycinyl)-7E,9E,11Z,14Z-eicosatetraenoic acid]ME7810681.001.00
DulcitolME7808031.001.00
D-Arabinose 5-phosphateME7810021.001.00
9-oxoODE [9-oxo-10E,12Z-octadecadienoic acid]ME7810661.001.00
9,10-EpOME [(±)9,10-epoxy-12Z-octadecenoic acid]ME7810651.001.00
4-tert-OctylphenolME7810321.001.00
2-nonanolME7810201.001.00
17(18)-EpETE [(±)17,18-epoxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid]ME7810611.001.00
2,4-Di-tert-butylphenolME7810401.001.00
VanillinME7808061.020.98
TryptamineME7808281.020.98
Tiglic acidME7809881.020.98
Succinic AcidME7808251.020.98
PGE2 [9-oxo-11α,15S-dihydroxy-prosta-5Z,13E-dien-1-oic acid]ME7810751.020.98
PE(18:1(9Z)/0:0)ME7810121.020.98
OrcinolME7810271.020.98
N-Acetylneuraminic AcidME7807711.020.98
N-Acetyl-L-LeucineME7807691.020.98
MethylparabenME7810411.020.98
MaltolME7810181.020.98
L-Dihydroorotic AcidME7808691.020.98
L-Aspartic AcidME7807571.020.98
D-Fructose 6-Phosphate-Disodium SaltME7809301.020.98
Deoxycholic AcidME7808001.020.98
Chenodeoxycholic AcidME7808011.020.98
2-Methylbenzoic acidME7809651.020.98
2-Deoxyribose 1-PhosphateME7809481.020.98
13-oxoODE [13-oxo-9Z,11E-octadecadienoic acid]ME7810581.020.98
11,12-EET [(±)11,(12)-epoxy-5Z,8Z,14Z-eicosatrienoic acid]ME7810561.020.98
11(S)-HETE [11S-hydroxy-5Z,8Z,12E,14Z-eicosatetraenoic acid]ME7810551.020.98
Uridine 5-MonophosphateME7809171.010.99
TyramineME7807801.010.99
Trans,Trans-Muconic AcidME7809191.010.99
Trans-4-Hydroxy-L-ProlineME7807791.010.99
Succinic anhydrideME7810051.010.99
SarcosineME7807771.010.99
RICINOLEIC ACIDME7810331.010.99
O-PhosphorylethanolamineME7808821.010.99
NeopterinME7809121.010.99
N-AcetylphenylalanineME7807821.010.99
Lysope 16:0ME7808871.010.99
LXB4 [5S,14R,15S-trihydroxy-6E,8Z,10E,12E-eicosatetraenoic acid]ME7810711.010.99
L-IsoleucineME7807591.010.99
L-Glutamic AcidME7807581.010.99
Hydrocinnamic AcidME7808651.010.99
DHA [4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoic acid]ME7809031.010.99
D-Glucose 6-PhosphateME7808361.010.99
CurcuminME7809111.010.99
Cis-3-HexenylacetateME7810351.010.99
Argininosuccinic acidME7809471.010.99
5(S),15(S)-DiHETE [5S,15S-dihydroxy-6E,8Z,10Z,13E-eicosatetraenoic acid]ME7810621.010.99
2-NonanoneME7810381.010.99
2-Aminoethanesulfonic AcidME7808481.010.99
(±)17-HDHA [(±)17-hydroxy-4Z,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid]ME7810461.010.99
1-TetradecanolME7810311.010.99
Β-Hydroxypyruvic AcidME7809381.050.95
Vanillylmandelic acidME7810101.050.95
Pimelic acidME7809521.050.95
Phenylpyruvic AcidME7808741.050.95
L-CarnosineME7807671.050.95
Indolelactic acidME7809501.050.95
CreatineME7808601.050.95
7-MethylguanosineME7809761.050.95
8-Hydroxy-2-DeoxyguanosineME7809231.050.95
Sorbic acidME7810291.030.97
PropylparabenME7810391.030.97
O-Acetyl-L-serineME7809951.030.97
Nicotinic AcidME7808411.030.97
Mono-Methyl GlutarateME7810981.030.97
Lysopg 18:1ME7808841.030.97
Lysope 18:1ME7808851.030.97
L-LeucineME7807601.030.97
IndoleacetaldehydeME7810061.030.97
EthylmalonateME7809141.030.97
cis-4-Hydroxy-D-prolineME7809741.030.97
Benzoic AcidME7807841.030.97
Aminomalonic AcidME7809351.030.97
AdrenochromeME7810151.030.97
1-NonanalME7810191.030.97
ADP-riboseME7809571.030.97
Pyrroloquinoline QuinoneME7808211.040.96
PhenylpyruvateME7811001.040.96
PGK1 [9,11-dioxo-15S-hydroxy-prost-13E-en-1-oic acid]ME7810791.040.96
N-Acetylglucosamine 1-PhosphateME7809491.040.96
N-Acetyl-D-GlucosamineME7808371.040.96
Linoleic Acid (C18:2N6C)ME7808991.040.96
HypoxanthineME7808121.040.96
Dodecanoic Acid(C12:0)ME7809001.040.96
Cis-11,14,17-Eicosatrienoic Acid (C20:3)ME7809051.040.96
Caffeic AcidME7808591.040.96
8,15-DiheteME7809441.040.96
6β-hydroxytestosteroneME7809911.040.96
6 keto-PGF1α [6-oxo-9α,11α,15S-trihydroxy-prost-13E-en-1-oic acid]ME7810641.040.96
5-oxoETE [5-oxo-6E,8Z,11Z,14Z-eicosatetraenoic acid]ME7810141.040.96
3^-SialyllactoseME7809591.040.96
5-HETrE [5S-hydroxy-6E,8Z,11Z-eicosatrienoic acid]ME7810631.040.96
Uridine 5^-Diphospho-N-AcetylgalactosamineME7808180.881.12
Methyl hexadecanoateME7810300.881.12
4-OxopentanoateME7808560.881.12
(±)5-HEPE [(±)-5-hydroxy-6E,8Z,11Z,14Z,17Z-eicosapentaenoic acid]ME7810510.881.12
PGD2 [9α,15S-dihydroxy-11-oxo-prosta-5Z,13E-dien-1-oic acid]ME7808800.901.10
L-Asparagine AnhydrousME7807660.901.10
1-NaphtholME7810210.901.10
(±)5-HETE [(±)5-hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid]ME7810520.901.10
PGJ2 [11-oxo-15S-hydroxy-prosta-5Z,9,13E-trien-1-oic acid]ME7810780.891.11
Oxaloacetic acidME7810220.891.11
PantothenolME7808420.891.11
N-Acetyl-L-Glutamic AcidME7807680.921.08
MethylstearateME7810160.921.08
LTB4 [5S,12R-dihydroxy-6Z,8E,10E,14Z-eicosatetraenoic acid]ME7810670.921.08
AllysineME7809410.921.08
Adenosine 5^-MonophosphateME7808100.921.08
2-Methylsuccinic AcidME7808520.921.08
(±)9-HETE [(±)-9-hydroxy-5Z,7E,11Z,14Z-eicosatetraenoic acid]ME7810540.921.08
deoxyguanosine 5^-monophosphate (dGMP)ME7809860.911.09
Inosine diphosphate (IDP)ME7809550.911.09
Ureidoisobutyric AcidME7809160.951.05
L-SerineME7807610.951.05
2-(Formylamino)Benzoic AcidME7809150.951.05
2-Hydroxyisocaproic AcidME7808510.951.05
UridineME7808170.941.06
Salicylic acidME7809900.941.06
L-ThreonineME7807550.941.06
Glutaric AcidME7808630.941.06
7-ketodeoxycholic acidME7810890.941.06
3-UreidopropionateME7810950.941.06
12-HeteME7808810.941.06
(±)12-HETE [(±)12-hydroxy-5Z,8Z,10E,14Z-eicosatetraenoic acid]ME7810430.941.06
2-(4-Hydroxyphenyl)ethanolME7809660.931.07
D-Fructose-1,6-Biphosphate-Trisodium SaltME7809390.931.07
Glycerol 3-phosphateME7809810.851.15
DL-Benzylsuccinic acidME7809720.851.15
(±)12-HEPE [(±)-12-hydroxy-5Z,8Z,10E,14Z,17Z-eicosapentaenoic acid]ME7810420.851.15
3-Methylcrotonyl GlycineME7808550.851.15
2-(Methylthio)ethanolME7810360.861.14
Shikimic AcidME7808760.861.14
m-Coumaric acidME7809840.811.19
N-IsovaleroylglycineME7807720.821.18
12,13-EpOME [(±)12(13)epoxy-9Z-octadecenoic acid]ME7810570.821.18
D-SorbitolME7808290.821.18
RibitolME7808310.841.16
Γ-Glutamate-CysteineME7807810.831.17
Uridine 5’-DiphosphateME7808160.831.17
(±)18-HEPE [(±)-18-hydroxy-5Z,8Z,11Z,14Z,16E-eicosapentaenoic acid]ME7810480.831.17
Hydroxyphenyllactic acidME7809670.831.17
P-Coumaric AcidME7807830.791.21
UDP-glucoseME7809580.801.20
3-Aminosalicylic AcidME7809100.801.20
Gamma-Glu-LeuME7810110.801.20
Salicyluric acidME7809990.761.24
N-(2-Methylbenzoyl)glycineME7810260.761.24
N-PhenylacetylglycineME7807730.761.24
2-Phenylbutyric acidME7809640.771.23
Glycocholic AcidME7807980.781.22
MARMESINME7809690.781.22

Factors:

F1Treatment:AOM/DSS
F2Treatment:AOM/DSS and chronic restraint stress
Data matrix
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