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Clustering data with hclust algorithm for Metabolite signatures in trauma patients with venous thromboembolism (VTE) (Study ST000552)
Reversed phase NEGATIVE ION MODE (Analysis AN000844)
Metabolite
Structure
F1
F2
LysoPE (22:6)
ME165970
0.71
1.29
2,4-Dinitrophenol (herbicide)
ME165877
0.60
1.40
3-(4-HYDROXYPHENYL)LACTATE
ME165879
0.62
1.38
GLYCOCHOLATE_R1
ME165936
0.63
1.37
Pimelic Acid
ME165992
0.46
1.64
2^,4^-DIHYDROXYACETOPHENONE
ME165876
0.28
1.72
4-HYDROXY-2-QUINOLINECARBOXYLIC ACID
ME165891
0.34
1.79
CITRATE
ME165919
0.79
1.21
4-METHYL-2-OXO-PENTANOIC ACID
ME165893
0.81
1.19
Vanilloloside
ME166010
0.80
1.20
N-ACETYLGLYCINE
ME165979
0.86
1.14
LysoPE (20:4)
ME165969
0.85
1.15
GLUCONIC ACID/D-GULONIC ACID GAMA-LACTONE
ME165930
0.85
1.15
ETHYLMALONIC ACID
ME165928
0.85
1.15
ANTHRANILATE
ME165903
0.85
1.15
3-METHYL-2-OXOVALERIC ACID
ME165884
0.85
1.15
4-ACETAMIDOBUTANOATE
ME165889
0.85
1.15
D-SACCHARIC ACID
ME165927
0.89
1.11
AZELAIC ACID
ME165907
0.88
1.12
GLUTARATE
ME165933
0.87
1.13
GLYCOCHOLATE_R2
ME165937
1.21
0.79
a-LINOLENIC ACID
ME165898
1.19
0.81
Linoleic Acid (18:2)
ME165956
1.20
0.80
Chenodeoxycholic Acid (CDCA)_R3
ME165916
1.20
0.80
Kynurenic Acid
ME165945
1.20
0.80
L-GLUTAMIC ACID
ME165953
1.10
0.90
3-SULFINO-L-ALANINE
ME165887
1.11
0.89
Ferulic acid sulfate
ME165929
1.11
0.89
ALPHA-KETOGLUTARIC ACID+2H
ME165902
1.12
0.88
Glycoursodeoxycholic acid (G-UDCA)
ME165940
1.12
0.88
MALATE
ME165971
1.16
0.84
3-METHOXY-4-HYDROXYMANDELATE
ME165883
1.17
0.83
TARTARIC ACID
ME166000
1.17
0.83
Arachidonic Acid (20:4)
ME165904
1.15
0.85
Plasmenyl-LysoPE (P-18:1)
ME165993
1.14
0.85
4-HYDROXYBENZALDEHYDE
ME165892
1.13
0.87
4-COUMARATE
ME165890
1.14
0.86
L-2-PHOSPHOGLYCERIC ACID
ME165946
1.14
0.87
ASPARTATE
ME165906
0.96
1.04
LACTATE-dimer
ME165948
0.96
1.04
CITRAMALATE
ME165918
0.95
1.05
L-Cysteine-S-Sulfate
ME165951
0.95
1.05
3-methyladipic acid_R1
ME165885
0.92
1.08
Xylenesulfonate
ME166013
0.92
1.08
Glycocholic Acid (GCA)
ME165938
0.93
1.07
1,2-Benzisothiazolin-3-one
ME165875
0.93
1.07
3-methyladipic acid_R2
ME165886
0.93
1.07
XANTHINE
ME166012
0.94
1.06
N-FORMYLGLYCINE
ME165990
0.94
1.06
3-tert-Butyladipic acid
ME165888
0.94
1.06
NALPHA-ACETYL-L-LYSINE
ME165982
0.94
1.06
TAURINE
ME166001
1.06
0.94
L-ISOLEUCINE_R1
ME165957
1.06
0.94
L-GLUTAMINE
ME165954
1.06
0.94
4-oxoproline
ME165894
1.06
0.94
5-HYDROXY-L-TRYPTOPHAN
ME165896
1.06
0.94
Proline
ME165994
1.05
0.95
N-ACETYL-L-LEUCINE
ME165981
1.05
0.95
L-HISTIDINE
ME165955
1.05
0.95
CITRULLINE
ME165921
1.05
0.95
Docosahexaenoic Acid (22:6)
ME165926
1.05
0.95
Catechol Sulfate_R2
ME165913
1.09
0.91
THREONINE/HOMOSERINE
ME166005
1.09
0.91
Sulfoacetaldehyde
ME165999
1.08
0.92
N-ACETYL-DL-GLUTAMIC ACID
ME165977
1.08
0.92
LysoPE (18:0)
ME165967
1.08
0.92
L-CYSTEIC ACID
ME165950
1.08
0.92
LEUCINE
ME165952
1.08
0.92
URIDINE
ME166009
0.99
1.01
SUCCINIC ACID-13C4
ME165998
0.99
1.01
Salicylic Acid-D4
ME165995
0.99
1.01
N-BOC-L-tert-Leucine_R2
ME165987
0.99
1.01
N-BOC-L-Aspartic Acid_R2
ME165985
0.99
1.01
N-BOC-L-Aspartic Acid_R1
ME165984
0.99
1.01
LysoPE (18:1)
ME165968
0.99
1.01
Inosine
ME165943
0.99
1.01
GLYCERIC ACID_R1
ME165934
0.99
1.01
Dinoterb (herbicide)
ME165924
0.99
1.01
Cholic Acid
ME165917
0.99
1.01
C6H12O6-HEXOSE/KETOSE/INOSITOL
ME165910
0.99
1.01
3-(2-HYDROXYPHENYL)PROPANOATE
ME165878
0.99
1.01
3-HYDROXY-3-METHYLGLUTARATE
ME165881
0.99
1.01
L-Tyrosine-13C6
ME165963
1.00
1.00
D-GLUCURONIC ACID/D-GLUCURONOLACTONE/D-(+)-GALACTURONIC ACID
ME165923
1.00
1.00
L-CARNITINE
ME165949
1.00
1.00
L-METHIONINE
ME165960
0.97
1.03
SUCCINATE
ME165997
0.98
1.02
N-BOC-L-tert-Leucine_R1
ME165986
0.98
1.02
N-AMIDINO-L-ASPARTATE
ME165983
0.98
1.02
LysoPE (16:0)
ME165966
0.98
1.02
L-Phenylalanine-13C6
ME165961
0.98
1.02
GLYCERIC ACID_R2
ME165935
0.98
1.02
GLUCOSE/FRUCTOSE_R1
ME165931
0.98
1.02
GLUCOSE/FRUCTOSE_R2
ME165932
0.98
1.02
URATE
ME166008
1.02
0.98
Tryptophan-2,3,3-D3
ME166007
1.02
0.98
N-ACETYL-L-ALANINE
ME165980
1.02
0.98
LysoPC (18:1)
ME165965
1.02
0.98
LACTATE
ME165947
1.02
0.98
HYPOXANTHINE
ME165941
1.02
0.98
3-Aminosalicylic acid
ME165880
1.02
0.98
ALLANTOIN
ME165899
1.02
0.98
N-METHYL-L-GLUTAMATE
ME165991
1.01
0.99
INDOLE-3-ACETATE
ME165942
1.01
0.99
CITRIC ACID-13C6
ME165920
1.01
0.99
Catechol Sulfate_R1
ME165912
1.01
0.99
Caffeic Acid
ME165911
1.01
0.99
BOC-L-Tyrosine_R2
ME165909
1.01
0.99
BOC-L-Tyrosine_R1
ME165908
1.01
0.99
3-Hydroxydecanoic acid
ME165882
1.01
0.99
ALPHA-HYDROXYISOBUTYRIC ACID
ME165900
1.01
0.99
Tryptophan
ME166006
1.03
0.97
SARCOSINE/BETA-ALANINE
ME165996
1.03
0.97
N-BOC-L-Tryptophan_R2
ME165989
1.03
0.97
N-BOC-L-Tryptophan_R1
ME165988
1.03
0.97
Mono-(2-Ethylhexyl) Phthalate Dimer
ME165974
1.03
0.97
L-KYNURENINE
ME165959
1.03
0.97
L-ISOLEUCINE_R2
ME165958
1.03
0.97
ISOCITRIC ACID
ME165944
1.03
0.97
5-hydroxyindoleacetic acid
ME165895
1.03
0.97
6-Hydroxycaproic acid
ME165897
1.03
0.97
Monobutyl phthalate
ME165976
1.04
0.96
L-VALINE
ME165964
1.04
0.96
CREATINE
ME165922
1.04
0.96
L-TYROSINE
ME165962
1.04
0.96
DISACCHARIDE (6C/6C)/2-alpha-D-glucosyl-D-glucose
ME165925
1.25
0.75
ASCORBIC ACID
ME165905
1.29
0.71
N-ACETYL-DL-SERINE
ME165978
1.28
0.72
Vanilloylglycine
ME166011
1.40
0.60
Taurocholic acid (TCA)
ME166003
1.37
0.63
ALPHA-KETOGLUTARIC ACID
ME165901
1.35
0.65
Glycodeoxycholic acid (GDCA)
ME165939
1.34
0.66
Taurochenodesoxycholic acid (T-CDCA)
ME166002
1.64
0.36
Mannitol
ME165972
1.56
0.44
Mono-(2-Ethylhexyl) Phthalate Trimer
ME165975
1.56
0.44
Tauroursodeoxycholic acid (T-UDCA)
ME166004
1.44
0.45
Chenodeoxycholic Acid (CDCA)_R1
ME165914
1.50
0.47
Chenodeoxycholic Acid (CDCA)_R2
ME165915
1.49
0.51
Mono-(2-Ethylhexyl) Phthalate
ME165973
1.47
0.53
Factors:
F1
VTE:no
F2
VTE:yes
Data matrix
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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