Metabolomics Workbench : NIH Data Repository

Clustering data with hclust algorithm for (Study ST000539)

(Analysis AN000818)

Metabolite	Structure	F1	F2	F3	F4	F5	F6
N-(3-acetamidopropyl)-4-aminobutanal	ME158856	0.09	0.09	0.17	0.22	4.15	1.27
N-succinyl-L-citrulline	ME158845	0.31	0.29	1.01	0.08	1.13	3.18
D-2-Amino-hexano-6-lactam	ME158805	3.47	0.57	0.55	0.47	0.48	0.47
1-5-diazabicyclononane	ME158806	3.36	0.59	0.49	0.53	0.44	0.59
1-5-diazabicyclononane 2	ME159192	3.36	0.59	0.49	0.53	0.44	0.59
Diethanolamine	ME158701	2.57	0.70	0.65	0.77	0.70	0.62
Diethanolamine 2	ME158705	2.57	0.70	0.65	0.77	0.70	0.62
2-monooleoylglycerol	ME158808	1.95	0.53	0.96	0.43	1.45	0.69
3-Dehydroteasterone	ME158700	2.16	0.56	0.81	0.67	1.17	0.64
Glu-Arg	ME158804	0.87	NA	NA	NA	1.22	0.92
Glu-Arg 2	ME159218	0.87	NA	NA	NA	1.22	0.92
Tazettine	ME159086	1.22	0.14	0.49	NA	1.05	1.53
4-Hydroxycinnamyl aldehyde	ME158699	1.75	0.13	0.62	0.16	1.30	1.77
Methyl cinnamate	ME158807	1.77	0.35	0.50	0.36	1.22	1.79
Leu-Asn-Ser	ME159083	0.83	NA	0.41	NA	NA	1.46
Met-Asp-Gly	ME158982	NA	NA	1.03	NA	1.00	0.97
Leu-Asp-Gln	ME159234	NA	NA	0.71	NA	0.64	1.79
N1-Methyl-4-pyridone-5-carboxamide	ME158799	NA	NA	0.93	NA	0.69	1.36
3-Methylcrotonylglycine	ME158963	0.29	0.52	0.70	0.21	3.44	0.60
5S-HETE di-endoperoxide	ME158943	0.34	0.52	1.07	0.48	3.10	0.50
Octylamine	ME158964	0.46	1.23	0.99	0.29	1.99	1.04
L-Pipecolate	ME158740	0.95	1.01	0.98	0.36	1.90	0.80
L-Pipecolate 2	ME159036	0.95	1.01	0.98	0.36	1.90	0.80
Met-Met-Met	ME159178	0.60	0.73	0.87	0.31	2.28	1.21
N4-Acetylaminobutanal	ME158728	0.53	0.54	1.28	0.49	2.51	0.67
Sanguinarine	ME158938	0.45	0.64	1.26	0.54	2.25	0.87
Daminozide	ME158809	0.07	0.07	0.29	0.05	2.63	2.28
Dasytrichone	ME158824	0.09	0.06	0.46	0.04	3.03	2.33
Leu-Ser	ME158948	0.31	0.55	0.78	0.36	1.83	1.42
L-Kynurenine	ME158697	NA	0.39	0.73	0.62	1.72	1.32
Homoarginine	ME158862	0.30	0.32	0.78	0.65	2.15	1.79
L-Lysine 1,6-lactam	ME158843	0.25	0.22	1.04	0.22	2.36	1.90
N5-acetyl-N5-hydroxy-L-ornithine	ME158936	0.21	0.30	1.05	0.15	1.78	2.51
L-Glutamate methylester	ME159214	NA	0.36	0.43	0.43	1.41	1.99
N6-Acetyl-N6-hydroxy-L-lysine	ME158755	0.22	0.26	0.92	0.81	1.45	2.34
N6-Acetyl-N6-hydroxy-L-lysine 2	ME159073	0.22	0.26	0.92	0.81	1.45	2.34
Gentianaine	ME159144	0.47	0.50	0.80	0.58	1.51	2.14
Phe-Trp	ME159186	0.48	0.62	0.62	0.76	1.64	1.88
Glu-Met-Thr	ME158965	0.21	0.64	1.03	0.49	1.76	1.87
L-proline amide	ME158945	0.41	0.72	0.99	0.40	1.76	1.72
gamma-Glutamyl-beta-cyanoalanine	ME158704	0.27	0.52	1.08	0.36	1.42	2.03
Val-Ser	ME159146	0.46	0.49	0.96	0.24	1.67	2.17
Calophyllin B	ME158800	0.06	NA	0.26	NA	1.94	1.74
Aspidofractine	ME159224	NA	NA	0.23	NA	1.32	0.93
Cys-Thr-Cys-Cys	ME159233	NA	NA	NA	0.53	1.59	0.89
Met-Gly	ME159242	NA	NA	0.42	0.60	1.81	1.17
Urethane	ME158812	0.27	0.29	0.23	0.47	2.58	1.18
Urethane 2	ME159113	0.27	0.29	0.23	0.47	2.58	1.18
4,6-Dihydroxyquinoline	ME158791	NA	NA	0.74	0.13	2.09	1.05
Gln-Leu-Lys-His	ME158972	NA	0.13	0.22	0.09	2.47	0.90
[PC (16:0/3:0)] 1-hexadecanoyl-2-(2E-propionyl)-sn-glycero-3-phosphocholine	ME158974	NA	0.17	0.36	0.18	2.05	0.71
Diacetylhydrazine	ME159078	1.04	0.98	0.48	2.51	0.13	0.86
[PC acetyl(16:1)] 1-(9Z-hexadecenoyl)-2-acetyl-sn-glycero-3-phosphocholine	ME158893	0.77	0.88	0.40	2.45	0.53	0.96
SM(d18:0/24:1(15Z)(OH))	ME159028	0.65	0.68	0.33	2.54	0.69	1.10
LysoPE(0:0/20:5(5Z,8Z,11Z,14Z,17Z))	ME158823	0.85	0.57	0.69	2.57	0.55	0.78
3-Methyleneoxindole	ME159195	0.53	0.80	0.64	2.78	0.55	0.71
Tenuazonic acid	ME159168	0.52	0.61	0.70	2.63	0.61	0.92
1-Nitronaphthalene	ME159082	0.42	1.01	0.54	3.19	0.09	0.74
3-(Dimethylamino)propyl benzoate	ME158890	0.52	0.59	0.48	2.57	NA	0.54
3,5-dihydro-5-methylidene-4H-imidazol-4-one	ME158967	0.24	1.12	0.26	2.46	NA	0.91
Indole-3-acetamide	ME159066	0.27	0.84	0.54	2.39	NA	0.82
FMLP	ME158777	0.12	0.15	0.13	2.59	0.90	0.96
indole-3-acetonitrile oxide	ME158952	0.41	0.78	0.40	2.53	0.23	1.64
[FA methyl,hydroxy,ethyl,dimethyl(22:4)] N-(2R-methyl-3-hydroxy-ethyl)-16,16-dimethyl-5Z,8Z,11Z,14Z-docosatetraenoyl amine	ME159209	0.36	0.88	0.59	1.83	0.35	1.28
Deoxyvasicinone	ME158961	0.34	0.90	0.34	2.36	0.43	1.26
Pro-Pro	ME158959	0.37	0.92	0.39	2.13	0.76	1.43
Thiomorpholine 3-carboxylate	ME158949	0.26	0.48	0.94	2.31	0.95	1.06
Thiomorpholine 3-carboxylate 2	ME158969	0.26	0.48	0.94	2.31	0.95	1.06
[ST (3:0)] (5Z,7E)-(1S,3R)-24-nor-9,10-seco-5,7,10(19)-cholatriene-1,3,23-triol	ME158813	0.62	0.33	0.45	1.87	1.56	1.18
N-hydroxyvaline	ME159185	0.48	0.62	0.50	1.69	1.06	1.65
[PE (18:1)] 1-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine	ME159169	0.60	0.70	0.48	1.91	0.90	1.41
Valeroidine	ME159204	0.43	0.55	0.47	1.90	0.93	1.36
LysoPC(22:4(7Z,10Z,13Z,16Z))	ME158995	0.43	0.35	0.39	2.56	0.99	1.28
LysoPC(20:4(5Z,8Z,11Z,14Z))	ME159007	0.50	0.48	0.45	2.21	1.09	1.27
LysoPE(0:0/22:4(7Z,10Z,13Z,16Z))	ME158829	0.61	0.45	0.51	2.18	1.00	1.25
[PE (20:4)] 1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoethanolamine	ME158827	0.60	0.44	0.49	2.13	1.10	1.25
PC(18:0/P-18:1(11Z))	ME159049	0.21	0.25	NA	1.10	1.14	1.27
Asn-Asp	ME159098	0.26	0.32	0.31	1.18	1.43	1.34
Lys-Asn-Gly	ME159089	0.13	NA	0.15	1.28	1.42	1.16
Ala-Lys-Asn-His	ME158802	0.18	NA	0.24	1.26	1.39	1.41
Neopterin	ME158702	0.12	0.07	0.08	1.25	1.24	1.43
Asp-Arg	ME159212	0.06	0.15	0.09	1.31	1.79	1.37
Glaucarubolone	ME158801	0.11	NA	0.08	0.96	1.76	1.18
S-Butyl-DL-homocysteine-[S,R]-sulfoximine	ME159217	NA	0.56	NA	0.78	1.03	1.34
Asp-Met-Pro-Pro	ME159227	NA	NA	NA	0.36	0.87	1.34
Fructoselysine 6-phosphate	ME159088	0.15	NA	NA	1.02	1.03	1.24
cyclo-dopa 5-O-glucoside	ME158977	NA	NA	NA	1.06	0.77	1.17
Maltose	ME158797	NA	NA	NA	1.08	0.79	1.13
CMP	ME158798	NA	NA	NA	1.15	0.82	1.03
O-Phospho-L-serine	ME158792	NA	NA	NA	1.11	0.83	1.07
D-Glucosamine 6-phosphate	ME158793	NA	NA	NA	1.09	0.92	1.00
N-(2,3-Dihydroxybenzoyl)-L-serine	ME158989	NA	NA	NA	1.03	0.94	1.03
[SP] Sphinganine-1-phosphate	ME159072	NA	NA	NA	1.05	0.93	1.02
CDP-ethanolamine	ME159070	NA	NA	NA	0.93	0.97	1.10
Ala-Met-Pro-Tyr	ME159228	NA	NA	NA	0.98	0.84	1.17
Bis(glycerophospho)-glycerol	ME158975	NA	NA	NA	1.01	0.88	1.11
CDP-ribitol	ME159071	NA	NA	NA	0.97	0.91	1.11
L-a-glutamyl-L-Lysine	ME158973	NA	0.07	NA	1.09	1.13	1.09
[SP] Sphing-4-enine-1-phosphate	ME159075	NA	NA	NA	0.93	1.05	1.02
Glu-Gly	ME159232	NA	NA	NA	0.99	1.03	0.99
L-Tyrosyl-L-arginine	ME159246	NA	NA	NA	1.01	1.06	0.93
Homocystine	ME158794	NA	NA	NA	0.59	1.00	1.21
(S)-Norcoclaurine	ME159074	NA	NA	NA	0.67	1.10	1.23
Asp-Gly	ME158981	NA	NA	NA	0.73	1.22	1.05
N6-Hydroxy-L-lysine	ME159077	NA	NA	NA	0.87	1.19	1.06
Ala-Asp-Asp-Gln	ME158984	NA	NA	NA	0.87	1.19	0.94
Deacetoxycephalosporin C	ME158795	NA	NA	NA	0.84	1.23	0.94
2,3,4,5-Tetrahydrodipicolinate	ME159068	NA	NA	NA	1.20	0.65	1.16
Asn-Cys-Pro-Ser	ME159231	NA	NA	NA	1.03	0.59	1.37
Dihydroneopterin phosphate	ME159076	NA	NA	NA	0.82	0.58	1.60
Maleimide	ME159245	NA	NA	0.21	0.90	0.85	1.51
[ST hydroxy(5:0)] 3-hydroxy-estra-1,3,5(10),6,8-pentaen-17-one	ME159235	NA	NA	NA	0.76	0.84	1.40
PS(O-18:0/20:5(5Z,8Z,11Z,14Z,17Z))	ME159216	NA	0.40	NA	1.81	0.37	0.80
Quinolin-2-ol	ME159221	NA	1.01	NA	1.32	NA	0.67
ketoconazol	ME159220	NA	0.67	NA	1.25	NA	0.80
(-)-jasmonoyl-L-isoleucine	ME159213	NA	0.56	NA	1.53	NA	0.90
N-(3-Oxooctanoyl)homoserine lactone	ME159219	NA	0.45	NA	1.55	NA	0.63
Leu-Val-Gly	ME159239	NA	NA	NA	1.49	0.15	1.37
3-(ADP)-2-phosphoglycerate	ME159084	0.28	NA	NA	1.60	NA	0.88
GTP	ME158698	0.32	NA	NA	1.47	NA	0.98
[PC (19:3)] 1-(10Z,13Z,16Z-nonadecatrienoyl)-sn-glycero-3-phosphocholine	ME159090	0.09	0.03	NA	1.94	0.85	1.14
N-stearoyl histidine	ME159087	0.22	NA	NA	1.55	0.58	1.13
Protoporphyrin	ME158790	NA	NA	NA	1.48	0.54	0.98
(+/-)-5-[(tert-Butylamino)-2-hydroxypropoxy]-3,4-dihydro-1(2H)- naphthalenone	ME159222	NA	0.31	NA	1.38	0.54	1.31
Tyr-OEt	ME159215	NA	0.66	NA	1.46	0.61	1.27
Boc-Asn	ME159100	0.25	0.33	0.29	1.51	0.87	1.58
DL-Methionine sulfone	ME158810	0.33	0.27	NA	1.62	0.70	1.38
O-Succinyl-L-homoserine	ME158774	0.32	0.39	0.48	1.62	0.69	2.50
O-Succinyl-L-homoserine 2	ME158785	0.32	0.39	0.48	1.62	0.69	2.50
PC(16:0/5:0(CHO))	ME159206	0.39	0.77	0.40	1.48	0.87	2.09
3-Hydroxy-L-kynurenine	ME159064	0.34	0.37	0.44	1.29	0.69	2.03
Erythrulose 1-phosphate	ME159093	0.32	0.32	0.54	1.39	0.89	2.10
Ala-Asn-Gly	ME159106	1.07	0.83	NA	1.06	0.56	1.47
p-aminobenzoyl glutamate	ME159095	0.81	0.59	NA	1.56	0.52	1.39
beta-Citryl-L-glutamic acid	ME158839	0.03	0.02	0.02	2.85	0.53	2.55
Asp-Asp-Gly	ME158842	0.09	0.08	0.09	2.46	1.03	2.25
Phosphocreatine	ME158673	0.05	0.05	0.05	2.28	1.48	2.10
Asp-Cys-Cys-Ser	ME158828	0.44	0.32	0.38	1.21	2.35	1.30
di-n-Undecylamine	ME158968	0.06	0.41	0.05	1.61	2.15	1.72
Tetrapentylammonium	ME158816	0.07	0.04	0.06	1.67	2.30	1.86
Acetylcholine	ME158780	0.00	0.00	0.00	2.13	1.91	1.96
CDP-choline	ME158752	0.05	0.05	0.05	1.96	1.73	2.16
Glu-Asp	ME159161	0.04	0.04	0.05	1.92	1.74	2.21
1-deoxyxylonojirimycin	ME158878	0.12	0.13	0.14	1.74	1.86	2.02
[SP] 3-dehydrosphinganine	ME158746	0.07	0.07	0.08	1.83	1.96	1.98
Carnosine	ME159067	NA	0.05	0.04	1.62	1.56	1.72
N1,N8-diacetylspermidine	ME159167	0.26	0.30	0.17	1.74	1.46	2.07
Arg-Asp-Asp-Gly	ME159121	0.31	0.29	0.34	1.40	1.67	1.99
NG,NG-Dimethyl-L-arginine	ME158733	0.20	0.21	0.19	2.00	1.71	1.68
Ne,Ne dimethyllysine	ME158738	0.17	0.18	0.17	1.89	1.67	1.92
N-Carbamyl-L-glutamate	ME159045	0.18	0.21	0.23	1.64	1.82	1.94
Thr-Ala	ME158870	0.26	0.28	0.27	1.64	1.65	1.91
UDP	ME158762	0.26	0.31	0.31	1.70	1.58	1.84
Choline	ME158686	0.21	0.24	0.25	1.75	1.76	1.80
Choline phosphate	ME158767	0.22	0.26	0.24	1.81	1.64	1.83
4-Imidazolone-5-propanoate	ME159056	0.24	0.32	0.32	1.59	1.79	1.74
Glu-Pro	ME159147	0.33	0.35	0.33	1.50	1.69	1.81
3-Hydroxy-N6,N6,N6-trimethyl-L-lysine	ME158720	0.32	0.31	0.30	1.71	1.83	1.53
N6,N6,N6-Trimethyl-L-lysine	ME158763	0.28	0.33	0.31	1.73	1.68	1.66
Arg-Leu-Asn-Asp	ME158821	1.45	0.91	0.47	NA	NA	NA
Met-Ala-Gly	ME159175	0.76	0.92	1.32	NA	NA	NA
Biotin amide	ME158769	0.82	0.99	1.19	NA	NA	NA
Methyl 2-diazoacetamidohexonate	ME158882	0.85	0.94	1.21	NA	NA	NA
Epinephrinesulfate	ME158840	1.11	0.98	0.87	NA	NA	NA
Ovothiol disulfide	ME158939	0.89	1.26	0.86	NA	NA	NA
1,6-anhydrous-N-Acetylmuramyl-tetrapeptide	ME158883	1.02	1.13	0.85	NA	NA	NA
L-Homocitrulline	ME158894	0.97	1.11	0.93	NA	NA	NA
L-Homocitrulline 2	ME159183	0.97	1.11	0.93	NA	NA	NA
Ala-Ser-Ser	ME159148	0.95	1.01	1.05	NA	NA	NA
Isoquinoline	ME159180	0.91	1.10	0.98	NA	NA	NA
3-beta-D-Galactosyl-sn-glycerol	ME159053	0.87	1.09	1.04	NA	NA	NA
[FA (5:2)] 2,4-pentadienoic acid	ME159176	0.90	1.08	1.02	NA	NA	NA
N-stearoyl tyrosine	ME159153	1.14	1.25	1.54	0.07	0.06	NA
Homostachydrine	ME158928	1.20	1.60	1.45	0.06	NA	0.07
Phe-Pro	ME159198	0.97	1.51	1.64	NA	0.18	0.15
[FA] O-Palmitoyl-R-carnitine	ME158775	1.52	1.88	1.81	0.28	0.25	0.26
Leu-Lys-Asp	ME159163	1.59	1.81	1.82	0.29	0.24	0.25
Retronecine	ME158915	1.50	1.89	1.94	0.20	0.24	0.23
Stearoylcarnitine	ME159171	1.58	1.84	1.98	0.20	0.20	0.19
Elaidiccarnitine	ME158861	1.71	1.76	1.91	0.19	0.23	0.20
Linoelaidylcarnitine	ME159139	1.72	1.76	1.92	0.19	0.25	0.17
DL-2-Aminooctanoicacid	ME159152	1.73	1.90	1.92	0.14	0.16	0.15
L-Citrulline	ME158689	1.61	1.94	2.00	0.19	0.14	0.13
Hypaphorine	ME158919	1.70	2.16	1.76	0.15	0.11	0.13
Indoleacrylicacid	ME159188	1.68	2.22	1.74	0.12	0.12	0.12
Asn-Leu-Asn-Tyr	ME158864	1.83	1.91	2.08	0.10	0.04	0.04
Asn-Pro	ME158929	1.56	2.10	1.96	0.12	0.13	0.13
Leu-Ala	ME158913	1.68	2.10	2.03	0.06	0.06	0.06
Stachydrine	ME158910	1.73	2.13	2.11	0.01	0.01	0.01
[ST (3:0)] (5Z,7E)-(1S,3R,24R)-22-oxa-9,10-seco-5,7,10(19)-cholestatriene-1,3,24-triol	ME158817	1.58	0.98	1.06	0.68	1.02	0.68
3,4-Dehydrothiomorpholine-3-carboxylate	ME158819	1.76	1.10	1.29	0.73	0.29	0.83
3,4-Dehydrothiomorpholine-3-carboxylate 2	ME158831	1.76	1.10	1.29	0.73	0.29	0.83
a Cysteine adduct	ME158815	1.78	1.03	1.26	0.76	0.45	0.72
a Cysteine adduct 2	ME158825	1.78	1.03	1.26	0.76	0.45	0.72
Folate	ME158703	1.61	0.95	0.95	0.93	0.55	1.01
Hexanoylglycine	ME158811	1.79	0.83	0.90	0.74	0.73	1.01
S-Adenosyl-L-homocysteine	ME158696	0.75	1.60	1.61	1.06	0.56	0.42
Val-Gly	ME158950	0.95	1.79	1.84	0.43	0.39	0.59
Betaine	ME158677	1.65	1.76	1.72	0.27	0.28	0.32
CMP-N-trimethyl-2-aminoethylphosphonate	ME159159	1.54	1.72	1.73	0.34	0.31	0.36
sn-glycero-3-Phosphocholine	ME158682	1.52	1.72	1.74	0.38	0.27	0.37
Linamarin	ME158722	1.59	1.58	1.65	0.30	0.24	0.38
PC(14:1(9Z)/15:0)	ME158712	1.64	1.51	1.72	0.39	0.35	0.38
Thr-Ala-Asp	ME159124	1.61	1.55	1.47	0.57	0.40	0.41
N-Carbamoyl-L-aspartate	ME158739	1.49	1.58	1.51	0.45	0.39	0.58
Pro-Ser-Ser	ME158851	1.57	1.53	1.58	0.33	0.38	0.60
Heptadecanoylcarnitine	ME159151	1.42	1.55	1.57	0.54	0.35	0.43
[PE (16:0/18:3)] 1-hexadecanoyl-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphoethanolamine	ME159015	1.43	1.43	1.65	0.55	0.49	0.44
1-Methylnicotinamide	ME158757	1.33	1.55	1.62	0.45	0.53	0.52
O-Propanoylcarnitine	ME158920	1.27	1.62	1.71	0.43	0.47	0.50
Cerulenin	ME158901	1.44	1.71	1.65	0.42	0.40	0.39
[PE (16:0/16:0)] 1,2-dihexadecanoyl-sn-glycero-3-phosphoethanolamine	ME159046	1.48	1.70	1.60	0.42	0.36	0.44
Leu-Lys-Pro	ME158867	1.49	1.57	1.61	0.39	0.51	0.42
trans-Hexadec-2-enoylcarnitine	ME159156	1.43	1.59	1.67	0.42	0.51	0.39
sn-glycero-3-Phosphoethanolamine	ME158776	1.19	1.48	1.25	0.88	0.45	0.75
AMP	ME158694	1.13	1.63	1.47	0.64	0.51	0.63
N-acetyl -D- glucosaminitol	ME158930	1.14	1.54	1.36	0.55	0.66	0.75
N-acetyl -D- glucosaminitol 2	ME158934	1.14	1.54	1.36	0.55	0.66	0.75
O-Butanoylcarnitine	ME158907	1.30	1.56	1.49	0.60	0.51	0.54
[PC (18:1/18:1)] 1-(9Z-octadecenoyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine	ME159025	1.42	1.47	1.44	0.57	0.57	0.53
Asp-Gly-Arg	ME159141	1.32	1.36	1.24	0.74	0.68	0.65
Asp-Gly-Arg 2	ME159158	1.32	1.36	1.24	0.74	0.68	0.65
Tetradecanoylcarnitine	ME158880	1.24	1.36	1.49	0.61	0.74	0.56
Hydroxybutyrylcarnitine	ME158892	1.24	1.42	1.51	0.59	0.58	0.66
L-Carnitine	ME158676	1.33	1.37	1.44	0.61	0.58	0.67
4-Trimethylammoniobutanoate	ME158756	1.21	1.41	1.43	0.63	0.68	0.65
[PC (16:0/18:2)] 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine	ME158737	1.29	1.37	1.35	0.67	0.67	0.65
Lysergic acid	ME159155	1.21	1.34	1.24	0.61	1.19	0.40
PE(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z))	ME159011	1.33	1.31	1.62	0.45	0.79	0.50
PE(20:4(5Z,8Z,11Z,14Z)/P-18:1(11Z))	ME159023	1.23	1.27	1.48	0.49	1.05	0.49
[PC (16:1)] 1-(1Z-hexadecenyl)-sn-glycero-3-phosphocholine	ME159018	1.29	1.29	1.35	0.44	0.95	0.69
[PE (18:1/20:4)] 1-(1Z-octadecenyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoethanolamine	ME158713	1.30	1.19	1.49	0.50	0.92	0.60
PE(18:3(6Z,9Z,12Z)/P-18:1(11Z))	ME159017	1.34	1.33	1.40	0.50	0.87	0.56
Lophophorine	ME158902	1.32	1.56	0.59	0.32	NA	0.98
Casein K	ME158830	1.89	1.45	0.90	1.02	0.20	0.54
Casein K 2	ME158960	1.89	1.45	0.90	1.02	0.20	0.54
Phe-Gly	ME158836	1.82	1.51	0.86	0.53	NA	0.27
Phenylethylmalonamide	ME158858	1.62	1.66	0.87	0.52	NA	0.33
L-Indospicine	ME158916	1.68	2.11	0.86	0.88	0.16	0.30
Lys-Val-Val	ME158863	1.89	1.97	0.97	0.68	0.10	0.40
Ergothioneine	ME158748	1.73	1.93	1.34	0.00	0.00	NA
Hercynine	ME158735	1.91	2.01	0.70	0.04	NA	0.01
Hercynine 2	ME159055	1.91	2.01	0.70	0.04	NA	0.01
3-Butylidene-7-hydroxyphthalide	ME159092	1.93	0.52	0.61	1.99	0.39	0.57
Alatanin 2	ME159091	1.82	0.59	0.72	1.43	0.68	0.42
[ST (20:5)] cholest-5-en-3beta-yl (5Z,8Z,11Z,14Z,17Z-eicosapentaenoate)	ME158992	1.12	0.83	NA	1.11	0.93	NA
Cys-Met-Tyr-Tyr	ME158826	1.58	1.10	NA	1.34	0.58	0.39
Lys-Lys-Met-Pro	ME158818	1.50	0.94	0.20	1.59	0.80	0.13
beta-Carboline	ME158966	0.65	2.21	1.06	0.42	0.51	1.16
Urocanate	ME158789	0.67	2.03	0.63	0.75	0.62	1.30
gamma-Glutamyl-Se-methylselenocysteine	ME158991	0.30	0.27	2.08	0.57	0.29	1.77
metabolite 3	ME159123	0.36	0.34	1.57	0.86	0.67	2.21
(+/-)-5-[(tert-Butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydro-1- naphthol	ME158956	0.43	0.85	1.47	1.28	0.78	1.19
2,3-Dimethylmaleate	ME158999	0.84	0.75	1.51	0.73	0.78	1.40
Asp-Pro-Ser	ME158879	0.82	0.90	1.71	0.54	0.64	1.40
Lactosamine	ME158784	0.59	0.84	1.83	0.51	0.38	1.86
N-Ethylglycocyamine	ME158962	0.42	1.11	1.51	0.62	0.60	1.74
2-Phenyl-1,3-propanediol monocarbamate	ME159079	0.36	0.43	0.97	1.30	1.26	1.68
ZAPA	ME159094	0.68	0.38	0.78	0.99	1.32	1.64
2-Aminobutan-4-olide	ME159143	0.56	0.59	0.78	1.06	1.20	1.81
Thalicsessine	ME158848	0.64	0.62	0.51	1.15	1.28	1.81
Arg-Asn-Pro-His	ME158874	0.40	0.44	0.46	1.26	1.93	1.52
mildronate	ME159177	0.30	0.36	0.39	1.33	1.94	1.69
Lys-Val	ME158871	0.39	0.42	0.40	1.44	1.77	1.58
Glu-Lys-Val	ME158932	0.38	0.51	0.42	1.54	1.63	1.52
N-Acetylputrescine	ME159013	0.44	0.44	0.40	1.63	1.65	1.44
PC(22:4(7Z,10Z,13Z,16Z)/P-18:0)	ME159002	0.57	0.53	0.57	1.45	1.64	1.23
N6-Methyl-L-lysine	ME158869	0.49	0.52	0.52	1.27	1.69	1.51
PC(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z))	ME159029	0.46	0.48	0.52	1.43	1.74	1.38
Hexadecasphinganine	ME158923	0.43	0.56	0.74	1.29	1.40	1.59
4-Aminobutanoate	ME158675	0.59	0.61	0.63	1.40	1.38	1.39
L-Glutamine	ME158661	0.69	0.59	0.62	1.40	1.30	1.39
4-Hydroxy-4-methylglutamate	ME158886	0.58	0.65	0.66	1.22	1.38	1.52
Acetone cyanohydrin	ME159005	0.60	0.57	0.63	1.31	1.36	1.52
Phosphonoacetaldehyde	ME159057	0.51	0.68	0.70	1.38	1.25	1.47
[PC (16:0/16:0)] 1-hexadecanoyl-2-hexadecanoyl-sn-glycero-3-phosphocholine	ME159043	0.57	0.63	0.55	1.45	1.27	1.53
Picolinamide	ME159157	0.57	0.64	0.58	1.36	1.31	1.54
NAD+	ME158664	0.51	0.47	0.62	1.49	1.23	1.67
Pyridoxine	ME158670	0.55	0.55	0.44	1.47	1.35	1.64
5,6-Dihydrothymine	ME158759	0.48	0.57	0.51	1.49	1.41	1.53
5,6-Dihydrothymine 2	ME158783	0.48	0.57	0.51	1.49	1.41	1.53
Met-Thr-Asp	ME159189	0.39	0.53	0.53	1.56	1.41	1.58
N2-Succinyl-L-ornithine	ME159048	0.43	0.50	0.45	1.53	1.44	1.65
Hexanoylcarnitine	ME158891	0.48	0.54	0.58	1.55	1.41	1.45
Leu-Asp	ME158941	0.38	0.57	0.60	1.58	1.42	1.44
[FA (6:0)] O-hexanoyl-R-carnitine	ME159130	0.50	0.49	0.48	1.62	1.51	1.39
[SP (16:0)] N-(hexadecanoyl)-sphing-4-enine	ME159024	0.50	0.52	0.56	1.48	1.55	1.40
Trp-Trp-Tyr-Tyr	ME159129	0.48	0.47	0.46	1.43	1.20	1.96
Ala-Asp-Cys-Ser	ME158853	0.40	0.39	0.36	1.59	1.55	1.71
Thr-Cys	ME158896	0.41	0.48	0.31	1.51	1.54	1.76
Thr-Cys 2	ME158970	0.41	0.48	0.31	1.51	1.54	1.76
Lys-Trp-Asn	ME159197	0.32	0.49	0.44	1.66	1.32	1.77
N-Acetyl-L-glutamate	ME158687	0.39	0.46	0.40	1.57	1.42	1.77
Hypoxanthine	ME158695	0.66	1.16	0.88	1.19	1.33	0.78
[FA (20:5)] 5Z,8Z,11Z,14Z,17Z-eicosapentaenoic acid	ME158773	0.76	0.93	0.54	1.50	0.98	1.30
12-OPDA	ME159061	0.72	1.08	0.66	1.37	1.04	1.14
CTAB	ME158925	0.80	1.05	0.72	1.15	1.10	1.17
Val-Asn-Asp	ME159103	0.88	0.63	0.70	1.35	1.13	1.32
N2-(D-1-Carboxyethyl)-L-lysine	ME158732	0.69	0.72	0.64	1.39	1.05	1.51
PS(O-18:0/22:4(7Z,10Z,13Z,16Z))	ME159112	0.77	0.62	0.50	1.52	1.17	1.42
cis-5-Tetradecenoylcarnitine	ME158895	0.74	0.86	0.79	1.24	1.33	1.05
PC(22:2(13Z,16Z)/P-18:1(11Z))	ME159016	0.63	0.62	0.73	1.42	1.38	1.22
[PC (16:0/20:4)] 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphocholine	ME159010	0.68	0.68	0.76	1.32	1.41	1.15
Betaine aldehyde	ME159037	0.69	0.75	0.71	1.24	1.38	1.23
Glu-Val	ME159134	0.72	0.72	0.65	1.27	1.41	1.22
L-Lysine	ME158663	0.90	0.82	0.85	1.06	1.21	1.16
methiin	ME159118	0.88	0.78	0.78	1.03	1.27	1.27
Thiamin	ME158666	0.88	0.83	0.77	1.05	1.26	1.21
L-Asparagine	ME158667	0.78	0.73	0.72	1.23	1.25	1.29
L-Serine	ME158679	0.74	0.81	0.76	1.24	1.17	1.28
Anthranilate	ME159080	0.69	0.85	0.69	1.15	1.26	1.36
3-Butynoate	ME158760	0.68	0.80	0.68	1.24	1.26	1.35
O-Acetylcarnitine	ME158753	0.67	0.76	0.71	1.24	1.22	1.39
O-Acetylcarnitine 2	ME159062	0.67	0.76	0.71	1.24	1.22	1.39
Dethiobiotin	ME159051	0.69	0.83	0.92	1.18	1.16	1.22
allopurinol	ME159181	0.73	0.91	0.75	1.22	1.20	1.20
L-Alanine	ME158669	0.83	0.82	0.80	1.17	1.11	1.27
[FA methyl(4:1)] 3-methyl-2-butenoic acid	ME158900	0.70	0.83	0.80	1.16	1.22	1.28
N-Ethylmaleimide	ME158987	0.73	0.86	0.79	1.07	1.22	1.33
N-Ethylmaleimide 2	ME159172	0.73	0.86	0.79	1.07	1.22	1.33
Ala-Leu-Lys-Pro	ME158859	0.73	0.74	0.62	1.15	1.22	1.54
5-Aminopentanamide	ME158726	0.68	0.69	0.81	1.11	1.36	1.34
N-acetyl-(L)-arginine	ME158832	0.80	0.62	0.79	1.02	1.31	1.46
Riboflavin	ME158768	0.85	1.02	0.88	0.88	0.61	1.64
[ST (2:0)] 5alpha-cholesta-8,24-dien-3beta-ol	ME159058	0.84	1.14	0.69	0.79	0.78	1.76
beta-Alanyl-L-arginine	ME158706	0.76	1.07	0.88	0.54	0.94	1.65
D-Galactosamine	ME158716	0.92	0.87	1.01	0.69	0.95	1.55
D-Galactosamine 2	ME158771	0.92	0.87	1.01	0.69	0.95	1.55
Isovalerylalanine	ME158954	0.92	0.90	0.88	0.82	0.92	1.49
[SP amino,tetramethyl(4:0/18:0/3:0)] 2S-amino-5,9,13,17-tetramethyl-8E,16-octadecadiene-1,3R,14-triol	ME158844	0.96	0.86	0.76	0.86	0.99	1.58
Chelilutine	ME158958	0.42	0.94	0.94	0.77	1.45	1.48
Bendiocarb	ME158903	0.66	0.78	0.83	0.87	1.23	1.63
[FA oxo(6:0)] N-(3-oxo-hexanoyl)-homoserine lactone	ME158926	0.61	0.81	0.89	0.99	1.18	1.52
5-Hydroxytryptophol	ME158911	0.63	0.78	0.88	0.73	1.41	1.57
5-Methoxytryptophol	ME159174	0.72	0.85	0.80	0.68	1.32	1.63
Behenoylglycine	ME159190	0.72	0.97	0.85	0.59	1.24	1.63
PC(16:0/5:0(COOH))	ME159205	0.50	0.97	0.76	0.62	1.01	2.13
Diacetylmonoxime	ME159142	0.70	0.72	0.92	0.74	1.12	1.80
Gly-Pro-Ser	ME158847	0.65	0.62	0.85	0.74	1.13	2.01
N-ethylsuccinimide	ME158860	0.66	0.68	0.97	0.59	1.16	1.94
7alpha-Hydroxycholest-4-en-3-one	ME158787	0.76	1.45	0.69	0.61	0.55	1.92
PS(18:0/18:1(9Z))	ME159063	0.73	1.52	0.53	1.03	0.66	1.53
[ST (3:0)] cholest-5Z,7Z,24-trien-3beta-ol	ME159065	0.72	1.60	0.52	0.79	0.81	1.55
psicoselysine	ME158906	0.70	0.84	0.97	1.20	0.50	1.78
PS(22:1(11Z)/0:0)	ME159202	0.69	1.19	0.66	1.31	0.60	1.55
d1-piperidine-dicarboxylate	ME159203	0.57	1.07	0.64	1.19	0.92	1.61
PS(38:2)	ME159199	0.70	1.13	0.57	1.13	0.85	1.61
6-Acetamido-2-oxohexanoate	ME158788	0.61	1.33	0.30	1.19	0.59	1.98
dihydrocapsaicin	ME158942	0.72	1.07	0.29	1.33	0.42	1.69
N2-Succinyl-L-arginine	ME158990	0.84	0.51	0.66	0.41	1.58	1.28
L-Methionine S-oxide	ME158781	0.54	0.70	0.86	0.94	1.68	1.27
S-Adenosyl-L-methionine	ME158747	0.56	0.62	0.71	0.91	1.98	1.22
L-glycyl-L-hydroxyproline	ME159162	0.85	0.96	0.78	0.95	1.47	0.98
Creatinine	ME158684	0.72	0.83	0.89	0.76	1.64	1.16
Pyridoxamine	ME158745	0.80	0.87	0.99	0.70	1.64	1.00
Iridodial	ME158718	0.57	0.56	1.47	1.13	1.54	0.72
alpha-Methylstyrene	ME159096	1.10	0.59	1.33	0.65	1.57	0.76
[FA (8:2)] 2,4-octadienal	ME159102	0.99	0.67	1.22	0.93	1.21	0.98
1,2,4-Trimethylbenzene	ME159109	0.90	0.71	1.33	0.94	1.28	0.84
3,5,7-Trimethyl-2E,4E,6E,8E-undecatetraene	ME159114	0.87	0.73	1.30	0.94	1.38	0.78
[FA (14:2)] 5,8-tetradecadienal	ME159111	0.91	0.72	1.32	0.73	1.46	0.85
DMNT	ME159104	0.95	0.69	1.20	0.86	1.43	0.88
Perillyl alcohol	ME159107	0.89	0.70	1.23	0.81	1.50	0.87
[FA hydroxy(9:1)] 4-hydroxy-2-nonenal	ME158888	0.76	0.85	1.45	0.58	1.47	0.88
Pyridoxal	ME158680	0.89	0.98	1.24	0.45	1.57	0.88
10-Hydroxycarbazepine	ME159081	0.55	1.11	1.34	0.53	1.51	0.64
Indoleamine	ME158904	0.94	1.12	1.21	0.66	1.48	0.58
PS(12:0/15:0)	ME158918	1.13	1.43	1.11	0.57	0.55	1.22
Val-Pro-Arg	ME158931	1.08	1.47	1.08	0.50	0.56	1.32
L-thiazolidine-4-carboxylate	ME158849	1.40	1.36	0.76	0.52	0.67	1.29
N-Decanoylglycine	ME158905	1.15	1.38	0.84	0.60	0.61	1.41
nornorcapsaicin	ME159165	1.18	1.35	0.79	0.55	0.61	1.52
Asn-Asn-Asn	ME159200	0.81	1.32	1.26	0.60	0.45	1.56
D-myo-Inositol 1,2-cyclic phosphate	ME158736	1.23	1.30	1.35	0.50	0.31	1.32
4-(1-methyl-5-hydroxy-2-pyrrolidinyl)-3-oxobutanoate methyl ester	ME158912	0.95	1.18	0.87	1.06	0.66	1.27
Adenine	ME158692	0.82	1.08	0.88	1.08	0.84	1.30
[FA oxo(5:1/5:0/8:0)] (1S,2S)-3-oxo-2-(2Z-pentenyl)-cyclopentaneoctanoic acid	ME159059	0.84	1.16	0.73	1.16	0.81	1.31
N-acetyl-demethylphophinothricin	ME158953	0.65	1.26	1.09	1.03	0.85	1.12
5,8,13,13a-Tetrahydrocolumbamine	ME159201	0.73	1.21	1.08	0.82	0.93	1.24
[PC (15:0)] 1-pentadecanoyl-sn-glycero-3-phosphocholine	ME159060	0.83	1.19	1.13	0.87	0.78	1.20
2,3,4,5-Tetrahydropyridine-2-carboxylate	ME158761	0.92	1.09	0.94	0.90	0.84	1.31
gamma-Glutamyl-beta-aminopropiononitrile	ME158764	0.88	1.05	0.94	0.84	0.84	1.45
Lichenin	ME159154	0.91	1.01	1.09	0.75	0.92	1.32
N-Acetylornithine	ME158688	0.89	1.07	1.12	0.82	0.76	1.33
4-8dimethylnonanoylcarnitine	ME159131	1.11	1.10	1.03	0.75	0.73	1.26
N3-(4-methoxyfumaroyl)-L-2,3-diaminopropanoate	ME158872	1.04	1.13	1.10	0.77	0.67	1.28
Butenylcarnitine	ME159193	0.90	1.23	1.01	0.83	0.72	1.32
N5-(L-1-Carboxyethyl)-L-ornithine	ME159194	0.95	1.37	1.04	0.70	0.75	1.19
Furfural	ME159136	0.85	0.86	1.38	1.00	0.83	1.07
O-Acetylneuraminic acid	ME158838	0.97	0.82	1.20	1.02	0.78	1.20
1-deoxynojirimycin	ME158834	1.13	0.91	0.77	1.01	1.13	1.05
L-Ornithine	ME158681	0.88	0.97	0.87	0.99	1.24	1.05
PS(38:5)	ME159120	0.96	0.88	1.02	1.10	1.13	0.91
[PC (14:0/18:2)] 1-tetradecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine	ME159004	0.88	0.84	0.99	1.04	1.20	1.05
[PC (18:1/20:3)] 1-(9Z-octadecenoyl)-2-(5Z,8Z,11Z-eicosatrienoyl)-sn-glycero-3-phosphocholine	ME158725	0.85	0.86	0.96	1.15	1.18	0.99
[PE (16:0/20:4)] 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoethanolamine	ME159008	0.87	0.84	0.94	1.18	1.21	0.97
2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate	ME158914	0.87	1.05	0.86	0.94	1.04	1.22
2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate 2	ME159179	0.87	1.05	0.86	0.94	1.04	1.22
D-Pipecolicacid	ME158898	0.84	0.99	0.94	1.01	1.06	1.16
[FA amino(11:0)] 11-amino-undecanoic acid	ME158873	0.85	0.92	0.95	0.97	1.13	1.18
(-)-Salsolinol	ME158837	0.98	0.81	0.83	0.90	1.05	1.16
Asp-Gly-Pro	ME158833	1.06	0.82	0.80	1.10	0.99	1.22
[SP (16:0)] N-(hexadecanoyl)-sphing-4-enine-1-phosphocholine	ME158841	0.95	0.84	0.87	1.09	1.01	1.23
[PE (18:0)] 1-octadecanoyl-sn-glycero-3-phosphoethanolamine	ME159137	0.89	0.90	0.88	1.26	0.85	1.22
Guanidinoacetate	ME159052	0.81	1.00	0.92	1.18	1.00	1.09
5-Guanidino-2-oxopentanoate	ME159041	0.87	0.95	0.91	1.08	1.09	1.09
Creatine	ME158741	0.85	0.91	0.91	1.12	1.03	1.19
LysoPC(O-18:0)	ME159026	0.89	0.92	0.91	1.11	1.01	1.15
nicotinamide riboside	ME158719	0.90	0.88	0.77	1.09	0.92	1.14
4-Aminobutanal	ME159009	0.90	0.89	0.86	1.23	0.99	1.12
metabolite 1	ME158744	0.93	1.01	0.78	1.20	0.96	1.11
L-Arginine	ME158662	1.06	0.94	0.95	0.92	1.04	1.08
Isopyridoxal	ME159054	0.92	1.16	0.94	0.92	1.00	1.06
N(pi)-Methyl-L-histidine	ME158734	0.95	1.00	1.02	0.94	1.04	1.05
[PC (18:1)] 1-(11Z-octadecenyl)-sn-glycero-3-phosphocholine	ME159150	0.89	0.97	1.02	1.00	1.05	1.07
L-Leucine	ME158683	0.92	1.05	0.98	0.93	0.99	1.13
N,N-Dimethylglycine	ME159050	0.92	1.07	1.04	0.94	0.99	1.04
[PC (16:0/18:1)] 1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphocholine	ME158749	0.93	1.03	0.95	1.02	0.99	1.08
Pro-Arg-His	ME158885	0.94	1.04	0.98	0.98	1.01	1.05
Pro-Arg-His 2	ME158933	0.94	1.04	0.98	0.98	1.01	1.05
Leu-Leu-Pro	ME159127	1.07	1.04	0.93	0.95	0.98	1.02
4-Guanidinobutanal	ME159040	0.98	1.07	0.95	0.98	1.04	0.97
L-Proline	ME158674	1.00	1.02	0.97	0.94	1.08	0.99
N2-Acetyl-L-lysine	ME158685	0.85	0.99	1.10	0.99	1.00	1.07
[PC (14:0/18:1)] 1-tetradecanoyl-2-(11Z-octadecenoyl)-sn-glycero-3-phosphocholine	ME159027	0.95	0.99	1.11	0.94	0.98	1.03
[ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene	ME158852	0.96	0.95	1.14	0.96	0.93	1.06
[ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene 2	ME158889	0.96	0.95	1.14	0.96	0.93	1.06
Imidazole-4-acetaldehyde	ME159003	1.07	0.99	0.98	1.00	0.92	1.04
LysoPC(18:0)	ME158711	1.05	0.96	1.05	1.01	0.93	1.00
[PC (16:0)] 1-hexadecanoyl-sn-glycero-3-phosphocholine	ME158717	1.02	0.99	1.05	0.99	0.92	1.02
L-Glutamate	ME158665	0.98	0.92	0.98	1.07	0.95	1.11
LysoPC(17:0)	ME159006	1.00	0.95	1.04	1.11	0.87	1.03
[PC (16:2)] 1-hexadecyl-sn-glycero-3-phosphocholine	ME159122	0.96	0.92	0.99	1.18	0.90	1.07
Piperidine	ME158724	0.96	0.96	0.98	1.19	0.99	0.92
[PC (18:0/22:4)] 1-octadecanoyl-2-(7Z,10Z,13Z,16Z-docosatetraenoyl)-sn-glycero-3-phosphocholine	ME159044	0.85	0.93	1.03	1.20	1.07	0.92
[PE (16:0/22:6)] 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine	ME159032	0.85	0.90	1.00	1.20	1.02	1.02
LysoPC(18:1(9Z))	ME159021	0.94	0.96	0.93	1.26	0.86	1.05
Asp-Cys-Gln	ME159164	0.90	1.03	1.02	1.18	0.83	1.03
N-dimethylethanolamine	ME158908	0.84	1.01	1.03	1.19	0.93	0.99
7,8-benzoflavone	ME158946	0.59	1.05	1.05	0.96	1.25	1.09
nitrocyclohexane	ME159138	0.80	0.81	1.09	0.96	1.12	1.23
Cyclo(deltaAla-L-Val)	ME158857	0.91	0.91	1.14	0.71	1.33	1.00
Dopaminequinone	ME158729	0.82	0.84	1.12	0.77	1.36	1.08
4-PIOL	ME158850	0.92	0.90	1.06	0.85	1.23	1.04
Lys-Asp-Gly	ME158917	0.80	1.01	1.10	0.88	1.17	1.04
N-palmitoyl phenylalanine	ME159116	1.09	0.96	1.02	0.50	1.09	1.34
Verticine	ME159182	0.84	1.05	1.12	0.53	1.14	1.31
Leucyl-leucine	ME158822	1.15	0.75	0.99	0.72	1.11	1.29
Tris(butoxyethyl)phosphate	ME158846	1.11	1.03	0.98	0.76	1.19	0.94
N-Acetyl-L-citrulline	ME158708	1.23	0.98	1.21	0.57	1.00	1.01
L-1-Pyrroline-3-hydroxy-5-carboxylate	ME158743	1.21	1.00	1.18	0.56	0.98	1.06
L-1-Pyrroline-3-hydroxy-5-carboxylate 2	ME158997	1.21	1.00	1.18	0.56	0.98	1.06
2-Dehydro-3-deoxy-L-rhamnonate	ME158994	1.21	0.91	1.05	0.62	1.06	1.16
Ala-Asp-Gly	ME158921	1.23	0.97	1.01	0.66	1.05	1.08
Ala-Asp-Gly 2	ME159108	1.23	0.97	1.01	0.66	1.05	1.08
Tributyl phosphate	ME158875	0.94	1.02	1.49	0.69	0.97	0.88
SM(d18:1/22:1(13Z))	ME158765	1.17	1.39	0.89	0.83	0.76	0.95
SM(d18:1/18:0)	ME159014	1.17	1.16	0.80	0.91	0.85	1.11
SM(d18:1/24:1(15Z))	ME158714	1.22	1.15	0.96	0.94	0.71	1.02
1,2-dioctanoyl-1-amino-2,3-propanediol	ME158877	0.95	1.04	1.12	0.93	1.11	0.84
[PS (18:0/20:4)] 1-octadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoserine	ME158715	1.02	0.97	1.13	0.97	1.03	0.88
(S)-Coclaurine	ME158723	1.00	0.99	1.07	0.98	1.09	0.87
LysoPC(20:1(11Z))	ME158710	1.12	0.98	1.19	0.98	0.79	0.94
SM(d16:1/18:1)	ME159117	1.10	0.98	1.14	0.90	0.91	0.96
SM(d18:1/18:1(9Z))	ME159001	1.10	1.01	1.19	0.88	0.87	0.95
[PC (16:0/22:6)] 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine	ME159019	1.07	1.08	1.29	0.86	0.89	0.81
SM(d18:1/14:0)	ME159125	1.09	1.06	1.30	0.85	0.81	0.89
Glu-Thr	ME158866	1.08	1.13	1.14	0.95	0.85	0.84
[PC (18:2)] 1-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine	ME158727	1.07	1.09	1.12	0.93	0.93	0.85
[PC (18:0/22:5)] 1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-glycero-3-phosphocholine	ME159042	0.95	1.04	1.24	1.00	0.95	0.82
[PC (16:0/18:3)] 1-hexadecanoyl-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphocholine	ME159012	1.03	1.02	1.19	0.96	0.96	0.84
PS(40:4)	ME159132	1.05	1.04	1.23	0.94	0.91	0.82
Fasoracetam	ME159160	0.96	1.08	1.17	0.71	1.01	1.06
Nicotinamide	ME158678	1.08	1.15	1.20	0.74	0.95	0.87
PC(16:0/P-18:1(11Z))	ME159033	1.08	1.14	1.04	0.74	0.97	1.03
L-Tyrosine	ME158672	1.06	1.07	1.05	0.88	0.96	0.98
L-Histidine	ME158671	1.09	1.09	1.07	0.81	0.99	0.94
L-Valine	ME158731	1.04	1.08	1.08	0.82	1.02	0.96
N1-Methyl-2-pyridone-5-carboxamide	ME158754	0.97	1.11	1.08	0.83	0.90	1.11
[PC (14:0)] 1-tetradecanoyl-sn-glycero-3-phosphocholine	ME158742	1.03	1.11	1.07	1.00	0.79	1.00
Imidazole lactate	ME158750	0.96	1.07	1.11	0.93	0.81	1.12
[PC (15:0/15:0)] 1,2-dipentadecanoyl-sn-glycero-3-phosphocholine	ME159030	1.01	1.06	1.15	0.92	0.82	1.04
Ricinine	ME159133	1.19	1.18	1.10	0.69	0.77	1.07
SM(d16:1/22:1)	ME159128	1.20	1.17	0.98	0.75	0.80	1.10
Indole	ME159039	1.06	1.16	1.12	0.82	0.77	1.07
Indole 2	ME159047	1.06	1.16	1.12	0.82	0.77	1.07
Ile-Pro	ME158899	1.02	1.21	1.13	0.83	0.87	0.93
L-Phenylalanine	ME158691	1.00	1.27	1.14	0.77	0.87	0.95
1(2H)-Isoquinolinone	ME159173	1.02	1.21	1.04	0.78	0.89	1.05
5-Methylcytosine	ME158766	1.06	1.26	1.09	0.73	0.82	1.04
L-Tryptophan	ME158758	1.05	1.23	1.11	0.77	0.84	1.00
[SP hydrox] 6-hydroxysphing-4E-enine	ME158881	1.00	1.10	1.30	0.95	0.71	0.95
L-Methionine	ME158690	1.04	1.31	1.18	0.90	0.67	0.92
SM(d18:1/22:0)	ME159038	1.14	1.24	1.09	1.00	0.65	0.88
PS(18:0/22:5(7Z,10Z,13Z,16Z,19Z))	ME158998	1.33	1.16	1.44	0.71	0.74	0.62
[PC (18:1/22:5)] 1-(11Z-octadecenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine	ME158730	1.20	1.22	1.36	0.81	0.74	0.67
[PE (16:0/18:2)] 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine	ME159000	1.29	1.17	1.31	0.84	0.64	0.74
Gyromitrin	ME159170	1.08	1.26	1.28	0.77	0.94	0.67
N6-Acetyl-L-lysine	ME158782	0.96	1.30	1.23	0.87	0.79	0.86
3-Methoxyanthranilate	ME158770	1.04	1.25	1.27	0.77	0.82	0.86
Imidazole-4-acetate	ME158779	1.03	1.33	1.26	0.77	0.83	0.78
SM(d18:1/17:0)	ME159145	1.23	1.29	1.18	0.65	0.53	0.85
N2-(D-1-Carboxyethyl)-L-arginine	ME159034	1.18	1.25	1.36	0.67	0.67	0.88
CMP-2-aminoethylphosphonate	ME159035	1.15	1.24	1.30	0.70	0.73	0.87
Leu-Pro	ME158876	1.14	1.25	1.29	0.71	0.76	0.84
N-(octanoyl)-L-homoserine	ME158868	1.23	1.30	1.18	0.76	0.70	0.83
N-Acetylindoxyl	ME159020	1.23	1.25	1.22	0.69	0.81	0.80
Slaframine	ME158855	1.23	1.22	1.21	0.75	0.77	0.83
Slaframine 2	ME158922	1.23	1.22	1.21	0.75	0.77	0.83
metabolite 4	ME159208	0.77	1.80	0.87	0.81	1.09	0.67
Codonopsine	ME159097	0.95	1.68	0.77	0.53	1.16	1.02
[Fv] Homoflemingin	ME158944	0.85	1.31	1.13	0.65	1.17	0.89
Succinyl proline	ME158955	0.74	1.48	0.93	0.61	1.16	1.05
Asn-Asn-Pro-His	ME159184	0.85	1.08	1.06	1.33	NA	0.68
Cys-Lys-Met-Gln	ME159196	0.80	1.20	1.06	1.22	NA	0.73
Ala-Pro	ME158924	1.13	1.47	1.09	1.43	0.31	0.58
N-Nonanoylglycine	ME158897	0.94	1.10	1.16	1.44	0.62	0.75
[SP (2:0)] sphinga-4E,14Z-dienine	ME158937	0.94	1.33	1.20	1.28	0.63	0.62
Fructoselysine	ME158887	1.22	1.18	1.45	1.09	0.08	0.99
Fructoselysine 2	ME159126	1.22	1.18	1.45	1.09	0.08	0.99
Acetyl phosphate	ME158707	1.16	0.82	1.13	1.14	0.54	1.21
Glutathione disulfide	ME158721	1.14	1.13	0.93	1.32	0.47	1.00
NADP+	ME158668	1.06	1.03	0.87	1.28	0.57	1.18
Ile-Met-Met-Thr	ME159115	1.02	0.87	1.02	1.07	NA	1.03
ATP	ME158660	1.44	1.06	0.89	1.37	0.18	1.06
Linatine	ME158996	1.29	1.06	0.89	1.29	0.11	1.07
Met-Met-Val	ME158835	1.32	1.07	1.00	1.37	0.12	1.11
5-guanidino-3-methyl-2-oxo-pentanoate	ME158865	1.28	1.33	0.66	1.73	0.20	0.81
PS(36:2)	ME158957	0.65	1.36	0.67	1.96	0.54	0.81
Glu-Glu-Glu	ME158854	0.65	0.65	0.55	1.37	0.53	1.33
S-Succinylglutathione	ME158935	0.73	1.00	0.30	1.71	0.80	1.46
PS(O-20:0/20:5(5Z,8Z,11Z,14Z,17Z))	ME159140	0.66	0.68	0.53	1.74	0.87	1.00
Ala-Leu-Thr-Pro	ME158940	0.71	1.02	0.60	1.79	0.67	1.20
PS(O-18:0/20:3(8Z,11Z,14Z))	ME159187	0.83	1.08	0.59	1.62	0.79	1.10
GDP	ME158709	0.78	0.67	0.63	1.81	0.60	1.51
LysoPE(0:0/18:2(9Z,12Z))	ME159135	0.79	0.79	0.64	1.77	0.75	1.27
L-2-Amino-6-oxoheptanedioate	ME158778	0.68	1.29	1.08	1.40	0.66	1.14
5-Methylthioadenosine	ME158693	0.73	0.96	0.86	1.42	0.63	1.40
Ectoine	ME158786	0.66	1.09	0.86	1.49	0.75	1.15
[PC (22:6)] 1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine	ME158993	0.91	0.61	0.88	1.64	1.04	0.93
LysoPE(0:0/22:5(4Z,7Z,10Z,13Z,16Z))	ME159101	0.95	0.64	0.82	1.70	0.85	1.03
LysoPE(0:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	ME159105	0.89	0.65	0.90	1.74	0.88	0.94
Ac-Tyr-OEt	ME159119	0.92	0.84	0.95	1.44	0.81	1.03
metabolite 2	ME159110	1.01	0.79	1.03	1.47	0.76	0.94
N-Heptanoylhomoserine lactone	ME158909	0.78	0.95	0.84	1.44	0.87	1.12
(Z)-4-Hydroxyphenylacetaldehyde-oxime	ME158751	0.86	0.96	0.92	1.39	0.92	0.95
Medicagol	ME158820	1.37	0.86	0.78	1.23	0.89	0.87
3-methyl-1-heptene	ME159099	1.39	0.87	0.68	1.37	0.91	0.78
Bis(2-ethylhexyl)phthalate	ME158814	1.41	0.81	0.70	1.36	0.90	0.82
3-nitro-2-pentanol	ME158927	1.25	1.66	0.69	1.08	0.46	0.85
Costunolide	ME159191	0.99	1.35	0.57	1.21	0.67	1.20
N-Benzyloxycarbonylglycine	ME159166	1.10	1.27	0.57	1.27	0.87	0.93
N-Formimino-L-glutamate	ME159022	1.08	1.11	0.63	1.52	0.65	1.02
PS(O-16:0/22:2(13Z,16Z))	ME159149	1.22	1.31	0.72	1.43	0.53	0.78
2-Methylcholine	ME158951	0.49	0.93	1.94	0.32	1.44	0.87
Ala-Asp-Cys-Gly	ME159211	0.68	1.04	0.89	NA	1.03	1.15
N-Acetyl-aspartyl-glutamate 3	ME159031	1.02	1.08	0.89	NA	0.83	1.19
N-Acetyl-aspartyl-glutamate	ME158772	1.02	1.08	0.89	NA	0.83	1.19
N-Acetyl-aspartyl-glutamate 2	ME159069	1.02	1.08	0.89	NA	0.83	1.19
[Fv] Ovalitenin A	ME159207	0.62	1.23	1.22	0.32	1.42	1.19
Glabranin	ME159210	0.37	1.05	1.22	NA	1.22	1.13
[Fv] Desmosdumotin C	ME158803	2.86	0.09	0.10	2.81	0.05	0.08
Cyclopamine	ME158884	0.26	0.29	0.21	4.65	0.43	0.16
[FA (20:2)] N-(11Z,14Z-eicosadienoyl)-ethanolamine	ME158947	0.31	0.55	0.49	3.97	0.44	0.24

Factors:

F1	Cell type:Mature erythrocyte \| Glucose labelling:C13 glucose \| timepoint:1 hour
F2	Cell type:Mature erythrocyte \| Glucose labelling:C13 glucose \| timepoint:20 hours
F3	Cell type:Mature erythrocyte \| Glucose labelling:unlabelled \| timepoint:20 hours
F4	Cell type:Reticulocyte \| Glucose labelling:C13 glucose \| timepoint:1 hour
F5	Cell type:Reticulocyte \| Glucose labelling:C13 glucose \| timepoint:20 hours
F6	Cell type:Reticulocyte \| Glucose labelling:unlabelled \| timepoint:20 hours

Data matrix