Data for (Study ST002498)

(Analysis AN004654)

Values for each metabolite have been scaled by dividing by the mean across all factors

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Metabolite	F1	F2
10,11-dihydro-10-hydroxycarbamazepine	1.0000	NA
1-methyl-4-imidazoleacetate	1.0009	0.9990
1-methyl-5-imidazoleacetate	1.1111	0.8698
1-methylguanidine	1.0609	0.9256
1-methylnicotinamide	1.0208	0.9756
1-methylurate	1.0444	0.9487
1-methylxanthine	1.0114	0.9878
1-ribosyl-imidazoleacetate*	0.9803	1.0231
2,3-dihydroxypyridine	0.9755	1.0274
2-amino-4-cyanobutanoate	0.9918	1.0097
2-aminobutyrate	0.9977	1.0027
2-aminoheptanoate	1.0151	0.9823
2-furoylcarnitine	0.9805	1.0237
2-hydroxycarbamazepine	1.0000	NA
2-hydroxyglutarate	0.9882	1.0138
2-methylbutyrylcarnitine (C5)	0.9470	1.0674
2-methylserine	0.9669	1.0380
2^-O-methylcytidine	0.9819	1.0212
2-oxoarginine*	0.9996	1.0005
2-piperidinone	1.0740	0.9132
2-pyrrolidinone	1.0438	0.9487
3-amino-2-piperidone	0.9967	1.0038
3-aminoisobutyrate	1.0040	0.9953
3-(cystein-S-yl)acetaminophen*	1.0408	0.9417
3-formylindole	0.9771	1.0269
3-hydroxybutyroylglycine**	0.9939	1.0072
3-hydroxycarbamazepine	1.0000	NA
3-hydroxyhexanoylcarnitine (1)	1.0112	0.9869
3-hydroxyindolin-2-one	0.9804	1.0216
3-hydroxyoctanoylcarnitine (1)	0.9799	1.0235
3-hydroxyoctanoylcarnitine (2)	0.9756	1.0285
3-hydroxypyridine glucuronide	1.0174	0.9805
3-hydroxystachydrine*	1.1397	0.8389
3-methoxytyrosine	0.7928	1.2429
3-methylcytidine	0.9966	1.0040
3-methylglutarylcarnitine (2)	0.9828	1.0201
3-phosphoglycerate	1.0367	0.9571
3-ureidopropionate	1.1685	0.8044
4-acetamidobutanoate	1.0551	0.9355
4-guanidinobutanoate	1.0461	0.9455
4-hydroxyglutamate	0.9759	1.0272
4-hydroxyphenylacetoylcarnitine	1.0003	0.9996
4-imidazoleacetate	0.9501	1.0622
5,6-dihydrothymine	0.9908	1.0108
5-(galactosylhydroxy)-lysine	1.0171	0.9799
5-hydroxylysine	0.9430	1.0669
5-hydroxymethyl-2-furoylcarnitine*	0.8777	1.1507
5-methylthioadenosine (MTA)	0.9901	1.0116
7-methylguanine	0.9897	1.0120
7-methylurate	0.9960	1.0048
7-methylxanthine	1.0274	0.9683
8-methoxykynurenate	1.2937	0.6574
acetoacetate	1.0069	0.9920
acetylcarnitine (C2)	0.9831	1.0198
adenosine 5^-monophosphate (AMP)	1.0493	0.9422
adipoylcarnitine (C6-DC)	1.1598	0.8132
alanine	0.9898	1.0120
alliin	1.0446	0.9464
alpha-hydroxymetoprolol	1.2243	0.7356
anthranilate	0.9912	1.0102
argininate*	0.9972	1.0033
arginine	0.9938	1.0073
asparagine	0.9978	1.0026
aspartate	0.9944	1.0066
atenolol	1.0068	0.9937
benzoylecgonine	0.9561	1.0146
beta-alanine	0.9805	1.0228
beta-guanidinopropanoate	1.0387	0.9538
betaine	1.0127	0.9851
butyrylcarnitine (C4)	0.9948	1.0061
caffeine	0.9995	1.0006
carboxyethyl-GABA	0.9983	1.0020
carnitine	0.9869	1.0153
carnosine	0.5236	1.4884
cephalexin	1.0000	1.0000
choline	0.9983	1.0020
choline phosphate	1.0084	0.9901
cimetidine	NA	1.0000
citrulline	1.0023	0.9973
cotinine	0.9525	1.0396
creatine	0.9792	1.0244
creatinine	0.9922	1.0092
cyclo(gly-pro)	1.0012	0.9987
cys-gly, oxidized	0.9978	1.0026
cystathionine	0.9664	1.0395
cysteine	1.0001	0.9999
cysteine-glutathione disulfide	1.0024	0.9972
cysteine s-sulfate	0.9970	1.0035
cysteine sulfinic acid	0.9900	1.0116
cysteinylglycine	0.9937	1.0073
cysteinylglycine disulfide*	0.9878	1.0143
cystine	0.9712	1.0338
cytidine	0.9815	1.0213
cytosine	0.9809	1.0222
deoxycarnitine	0.9953	1.0055
dimethylarginine (SDMA + ADMA)	0.9975	1.0029
dimethylglycine	1.0066	0.9922
dimethyl sulfone	0.6663	1.3912
doxylamine	1.1525	0.0851
ectoine	1.0347	0.9592
ergothioneine	1.0387	0.9546
formiminoglutamate	0.9917	1.0097
fructosyllysine	0.9986	1.0016
gamma-carboxyglutamate	1.0265	0.9690
gamma-glutamyl-2-aminobutyrate	1.0101	0.9880
gamma-glutamylalanine	1.0006	0.9993
gamma-glutamyl-alpha-lysine	0.9903	1.0113
gamma-glutamylcitrulline*	0.9999	1.0001
gamma-glutamyl-epsilon-lysine	1.0210	0.9692
gamma-glutamylglutamate	0.9894	1.0124
gamma-glutamylglutamine	0.9955	1.0052
gamma-glutamylglycine	0.9951	1.0057
gamma-glutamylhistidine	0.9935	1.0076
gamma-glutamylisoleucine*	0.9870	1.0153
gamma-glutamylleucine	0.9849	1.0177
gamma-glutamylmethionine	0.9825	1.0205
gamma-glutamylphenylalanine	0.9870	1.0153
gamma-glutamylthreonine	0.9914	1.0100
gamma-glutamylvaline	0.9869	1.0154
glutamate	0.9825	1.0206
glutamine	0.9962	1.0044
glutamine conjugate of C6H10O2 (1)*	1.1082	0.8734
glutarylcarnitine (C5-DC)	0.9966	1.0040
glycerol 3-phosphate	0.9901	1.0116
glycerophosphoethanolamine	0.9791	1.0245
glycerophosphorylcholine (GPC)	0.9815	1.0217
glycine	0.9900	1.0118
guanidinoacetate	1.0079	0.9907
hexanoylcarnitine (C6)	0.9419	1.0681
homoarginine	0.9997	1.0004
homostachydrine*	1.0103	0.9879
hydroxyasparagine**	0.9897	1.0121
hydroxybupropion	0.7831	1.2440
hydroxycotinine	1.1260	0.8950
hydroxy-N6,N6,N6-trimethyllysine*	1.0195	0.9772
hypoxanthine	1.0827	0.9031
imidazole lactate	0.9784	1.0253
imidazole propionate	0.9645	1.0413
iminodiacetate (IDA)	1.0105	0.9877
indoleacetoylcarnitine*	0.9157	1.0947
indolin-2-one	0.9803	1.0226
isobutyrylcarnitine (C4)	0.9588	1.0477
isoleucine	0.9887	1.0132
isovalerylcarnitine (C5)	0.9821	1.0210
ketopioglitazone	0.8670	1.0380
kynurenine	0.9820	1.0211
lamivudine	1.0000	1.0000
lanthionine	1.0151	0.9832
leucine	0.9863	1.0161
leucylglycine	0.9876	1.0131
levulinoylcarnitine	0.8983	1.1101
lidocaine	0.5085	1.9011
lysine	0.9934	1.0078
malonylcarnitine	0.9966	1.0045
meglumine	0.4418	1.3721
metformin	1.0987	0.9312
methionine	0.9872	1.0150
methionine sulfone	0.9800	1.0234
methionine sulfoxide	0.9754	1.0288
methyl indole-3-acetate	1.1844	0.8095
methylsuccinoylcarnitine	0.9705	1.0349
methylurea	1.0580	0.9348
metoprolol acid metabolite*	1.2870	0.7066
minocyclin	1.0000	NA
N1-methyladenosine	0.9801	1.0233
N1-methylinosine	0.9855	1.0169
(N(1) + N(8))-acetylspermidine	1.0273	0.9682
N2-acetyl,N6-methyllysine	1.0877	0.9012
N2-acetyl,N6,N6-dimethyllysine	1.1269	0.8512
N2,N2-dimethylguanosine	0.9913	1.0102
N6-carboxymethyllysine	1.0377	0.9564
N6-methyllysine	1.0702	0.9177
N6,N6-dimethyllysine	1.0458	0.9452
N6,N6,N6-trimethyllysine	1.0050	0.9941
N-acetyl-1-methylhistidine*	0.9375	1.0719
N-acetylarginine	0.9613	1.0453
N-acetyl-aspartyl-glutamate (NAAG)	1.0055	0.9936
N-acetylglucosamine/N-acetylgalactosamine	0.9979	1.0024
N-acetylglucosaminylasparagine	0.9872	1.0149
N-acetylglycine	0.9677	1.0379
N-acetylhistidine	0.9412	1.0728
N-acetylisoleucine	0.9806	1.0239
N-acetyl-isoputreanine	1.0038	0.9955
N-acetylneuraminate	1.0062	0.9927
N-acetylproline	1.0294	0.9648
N-acetylputrescine	0.9886	1.0134
N-acetyltheanine	0.8512	1.1595
N-alpha-acetylornithine	0.9845	1.0182
N-carbamoylalanine	0.9994	1.0008
N-ethylglycinexylidide	0.7087	1.4369
nicotinamide	0.9228	1.0905
nicotinamide N-oxide	0.8096	1.2387
nicotinate	0.0452	2.0693
nicotinate ribonucleoside	0.3856	1.5632
nicotinurate (nicotinoylglycine)	0.9721	1.0419
N-methylhydroxyproline**	1.0323	0.9617
N-methylpipecolate	1.0449	0.9504
N-methylproline	1.1179	0.8618
N,N-dimethyl-5-aminovalerate	1.0675	0.9220
N,N-dimethylalanine	0.9955	1.0052
N,N,N-trimethyl-5-aminovalerate	0.9712	1.0338
N,N,N-trimethyl-alanylproline betaine (TMAP)	1.0130	0.9847
norcotinine	0.9730	1.0174
O-desmethyltramadol	NA	1.0000
O-desmethyltramadol glucuronide	NA	1.0000
O-desmethylvenlafaxine	1.3145	0.6855
ofloxacin	1.0201	0.9736
ornithine	1.0138	0.9838
phenylacetylcarnitine	0.9366	1.0728
phenylacetylglutamine	1.0125	0.9853
phenylalanine	0.9920	1.0094
phosphate	0.9861	1.0162
phosphoethanolamine	1.0158	0.9815
picolinate	1.0100	0.9883
pimeloylcarnitine/3-methyladipoylcarnitine (C7-DC)	1.0141	0.9838
pioglitazone	0.9994	1.0002
pipecolate	0.9437	1.0660
pregabalin	1.0000	1.0000
pro-hydroxy-pro	0.9692	1.0360
proline	0.9984	1.0019
prolylglycine	0.9558	1.0517
propionylcarnitine (C3)	0.9776	1.0263
quinine	0.8217	1.2918
quinolinate	0.9918	1.0096
(R)-3-hydroxybutyrylcarnitine	1.0034	0.9960
ranitidine	0.4651	1.8024
ranitidine N-oxide*	0.3508	1.8115
S-1-pyrroline-5-carboxylate	0.9753	1.0290
(S)-3-hydroxybutyrylcarnitine	1.0135	0.9842
(S)-a-amino-omega-caprolactam	1.0376	0.9606
S-allylcysteine	0.9776	1.0253
sarcosine	1.0129	0.9849
S-carboxyethylcysteine	0.9635	1.0426
serine	0.9995	1.0006
serotonin	0.9998	1.0003
S-methylcysteine sulfoxide	0.9928	1.0084
S-methylmethionine	0.9105	1.1080
spermidine	1.0559	0.9347
spermine	0.9257	1.0991
stachydrine	1.0561	0.9343
suberoylcarnitine (C8-DC)	1.0764	0.9191
succinylcarnitine (C4-DC)	0.9926	1.0086
tamsulosin	0.8814	1.1897
taurine	1.0049	0.9942
theobromine	1.0120	0.9860
thioproline	0.9929	1.0083
threonine	0.9964	1.0043
tiglylcarnitine (C5:1-DC)	0.9859	1.0166
topiramate	NA	1.0000
tramadol	NA	1.0000
trans-4-hydroxyproline	0.9797	1.0238
triamterene	1.2992	0.7606
trigonelline (N^-methylnicotinate)	1.0044	0.9948
trimethoprim	0.8633	1.1777
trimethylamine N-oxide	1.0200	0.9766
tryptophan	0.9979	1.0025
tryptophan betaine	1.0211	0.9754
tyrosine	0.9935	1.0076
urea	0.9944	1.0065
X-11795	0.9622	1.0443
X-12096	1.0989	0.9054
X-12100	0.9947	1.0062
X-12101	1.0697	0.9183
X-12112	1.0470	0.9447
X-12117	1.0051	0.9941
X-12125	1.2159	0.7802
X-12126	0.9505	1.0487
X-12127	0.9851	1.0173
X-12199	1.2882	0.7033
X-12283	0.9244	1.0805
X-12462	0.9952	1.0056
X-12680	1.0479	0.9445
X-12689	0.9963	1.0043
X-12753	0.8703	1.1889
X-12798	1.0082	0.9904
X-13507	1.0525	0.9389
X-13684	0.9777	1.0264
X-14056	0.9840	1.0188
X-15461	0.9914	1.0101
X-15666	0.9968	1.0038
X-16397	1.0317	0.9632
X-16580	1.0176	0.9793
X-17301	0.9508	1.0338
X-17306	1.0799	0.9376
X-17346	1.0261	0.9693
X-21283	0.9810	1.0227
X-22162	1.0050	0.9941
X-23581	1.0455	0.9471
X-23583	0.9584	1.0505
X-23587	0.8745	1.1462
X-23593	0.9996	1.0005
X-23636	1.0113	0.9868
X-23639	0.9994	1.0007
X-23644	1.0502	0.9409
X-23648	1.0049	0.9941
X-23654	0.9980	1.0023
X-23655	1.0420	0.9502
X-23659	1.0206	0.9763
X-23665	0.9976	1.0028
X-23739	1.0128	0.9851
X-23780	0.9368	1.0733
X-23997	1.0482	0.9441
X-24243	1.0527	0.9391
X-24410	0.9871	1.0165
X-24411	0.9815	1.0216
X-24422	0.9609	1.0468
X-24425	0.9879	1.0139
X-24431	1.0173	0.9802
X-24456	1.0160	0.9812
X-24457	1.1369	0.8394
X-24462	1.0629	0.9228
X-24473	1.0170	0.9801
X-24474	1.0107	0.9871
X-24475	1.0426	0.9512
X-24699: ret for 64571	1.0048	0.9944
X-24728	1.0140	0.9836
X-24736	1.0249	0.9696
X-24764	1.0262	0.9662
X-24801	0.9907	1.0109
X-24811	1.0199	0.9772
X-24812	0.8864	1.1303
X-24970	1.1326	0.8463
X-24973	1.4672	0.4326
X-25109	1.0246	0.9722
X-25172	0.9830	1.0199
X-25217	1.0909	0.8900
X-25265	1.0260	0.9696
X-25267	0.9815	1.0212
X-25271	1.0934	0.8911
X-25343	0.9878	1.0143
X-25417	0.9673	1.0362
X-25419	1.0070	0.9919
X-25420	0.9661	1.0397
X-25422	0.9851	1.0174
X-25423	1.0724	0.9242
X-25519	0.9630	1.0433
X-25520	1.0573	0.9320
X-25790	1.0269	0.9685
X-25810	0.8169	1.2146
X-25828	0.9833	1.0195
X-25855	1.0250	0.9705
X-25948	1.0408	0.9521
X-25951	1.2144	0.6784
X-25952	1.0000	NA
X-25957	0.9871	1.0148
X-26008	0.8741	1.1447
X-26097	1.0171	0.9798
xanthurenate	0.9888	1.0132
zolpidem	1.1231	0.8097

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Factors:

F1	Diagnosis:0
F2	Diagnosis:1