Clustering data with hclust algorithm for Biomarkers for Depression in Human Cerebrospinal Fluid in a Population Sample (Study ST000063)

MS positive ion mode (Analysis AN000101)
MetaboliteStructureF1F2
shikimic acidME6526921.560.44
squaleneME6526941.540.46
glycerol-alpha-phosphateME6526280.851.15
citramalic acidME6525990.741.26
erythronic acidME6526100.761.24
piperidoneME6526811.260.74
3,6-anhydro-D-glucoseME6525751.260.74
phosphateME6526771.260.74
xylulose NISTME6527161.300.70
prolineME6526821.290.71
3,6-anhydro-D-galactoseME6525741.290.71
ethanolamineME6526121.290.71
2-deoxyerythritolME6525670.921.08
thymineME6527020.941.06
uracilME6527080.931.07
alpha-ketoglutarateME6525840.931.07
hydroxylamineME6526340.931.07
glutamineME6526231.001.00
acetoacetateME6525791.001.00
galactoseME6526171.001.00
dehydroabietic acidME6526050.991.01
inosineME6526360.991.01
aconitic acidME6525810.961.04
isocitric acidME6526380.961.04
citric acidME6526000.951.05
phosphoethanolamineME6526780.951.05
tocopherol alpha-ME6527030.981.02
uridineME6527110.971.03
p-cresolME6526740.971.03
inositol-4-monophosphateME6526370.971.03
itaconic acidME6526410.971.03
xylitolME6527141.030.97
saccharic acidME6526901.030.97
N-methylalanineME6526651.030.97
hexitolME6526321.030.97
fumaric acidME6526151.030.97
cerotinic acidME6525971.030.97
benzoic acidME6525921.030.97
2-hydroxyglutaric acidME6525701.030.97
5-aminovaleric acidME6525781.030.97
xyloseME6527151.040.96
palmitic acidME6526721.040.96
malonic acidME6526521.040.96
lyxoseME6526501.040.96
lysineME6526481.040.96
hypoxanthineME6526351.040.96
asparagineME6525881.040.96
cystineME6526041.040.96
stearic acidME6526951.020.98
malic acidME6526511.020.98
creatinineME6526031.020.98
cholesterolME6525981.020.98
1-monooleinME6525621.020.98
behenic acidME6525911.020.98
uric acidME6527101.010.99
lactamideME6526421.010.99
arachidic acidME6525861.010.99
glucoseME6526201.010.99
linoleic acidME6526471.050.95
lauric acidME6526451.050.95
capric acidME6525951.050.95
lactic acidME6526431.050.95
xanthineME6527131.060.94
sucroseME6526971.060.94
pseudo uridineME6526831.060.94
n-acetylglutamateME6526611.060.94
heptadecanoic acidME6526311.060.94
caprylic acidME6525961.060.94
beta-alanineME6525931.060.94
aspartic acidME6525891.060.94
3-hydroxybutyric acidME6525771.060.94
1-deoxyerythritolME6525601.060.94
2-hydroxybutanoic acidME6525691.060.94
phthalic acidME6526791.070.93
pelargonic acidME6526751.070.93
n-acetyl-d-hexosamineME6526601.070.93
methionine sulfoxideME6526571.070.93
fucose 1ME6526141.070.93
2-hydroxyvaleric acidME6525711.070.93
dodecanolME6526071.070.93
ureaME6527091.080.92
tryptophanME6527061.080.92
trans-4-hydroxyprolineME6527051.080.92
threonic acidME6526991.080.92
riboseME6526881.080.92
ornithineME6526691.080.92
lactuloseME6526441.080.92
2-deoxytetronic acidME6525681.080.92
alanineME6525831.080.92
valineME6527121.090.91
tyrosineME6527071.090.91
threonineME6527001.090.91
succinic acidME6526961.090.91
serineME6526911.090.91
phenylalanineME6526761.090.91
parabanic acid NISTME6526731.090.91
oxoprolineME6526711.090.91
nonadecanoic acidME6526661.090.91
myo-inositolME6526581.090.91
acetophenone NISTME6525801.090.91
citrullineME6526011.090.91
isoleucineME6526391.100.90
glycerolME6526261.100.90
glutamic acidME6526221.100.90
ascorbic acidME6525871.100.90
2-ketoisocaproic acidME6525731.100.90
3-hydroxy-3-methylglutaric acidME6525761.100.90
threitolME6526981.110.89
ribonic acidME6526871.110.89
pinitolME6526801.110.89
epsilon-caprolactamME6526081.110.89
erythritolME6526091.110.89
N-acetylmannosamineME6526621.130.87
N-acetyl-D-galactosamineME6526591.130.87
hexuronic acidME6526331.130.87
glyceric acidME6526251.130.87
glutaric acidME6526241.130.87
deoxypentitolME6526061.130.87
butyrolactam NISTME6525941.130.87
adipic acidME6525821.130.87
2,3-dihydroxybutanoic acid NISTME6525651.130.87
2,3-dihydroxypyridineME6525661.130.87
quinic acidME6526851.120.88
lyxitolME6526491.120.88
isothreonic acid 1ME6526401.120.88
glycineME6526291.120.88
fructoseME6526131.120.88
glycerol-3-galactosideME6526271.120.88
tocopherol gamma-ME6527041.140.86
sorbitolME6526931.140.86
threoseME6527011.140.86
galactonic acidME6526161.160.84
azelaic acidME6525901.160.84
conduritol-beta-epoxideME6526021.160.84
oleic acidME6526681.150.85
N-acetylornithineME6526631.150.85
methionineME6526561.150.85
mannitolME6526541.150.85
glucose-1-phosphateME6526211.150.85
leucineME6526461.150.85
oxalic acidME6526701.170.83
1-hexadecanolME6525611.170.83
erythronic acid lactoneME6526111.170.83
nicotinamideME6526641.180.82
glycolic acidME6526301.180.82
1,5-anhydroglucitolME6525591.180.82
glucoheptuloseME6526181.180.82
s(-)-willardiineME6526891.190.81
mannoseME6526551.190.81
aminomalonateME6525851.190.81
gluconic acidME6526191.190.81
1-monostearinME6525641.240.76
octadecanolME6526671.230.77
putrescineME6526841.230.77
2-ketoglucose dimethylacetal NISTME6525721.200.80
1-monopalmitinME6525631.220.78
maltose 1ME6526531.210.79
ribitolME6526861.210.79

Factors:

F1Source:Group 1 - Score 0
F2Source:Group 2 - Score 50
Data matrix
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