metabolite_name	PD1	PD2	PD3	PD4	CD1	CD2	CD3
Alanine	3738351.177	4107228.975	3297035.981	4215511.609	47561055.41	47150449.19	44168781.33
Valerolactam	10572517.86	9452215.072	10639758.29	10071073.82	459256213.7	456358058.6	445241753.8
2-Ketobutyrate	2835833.256	1228233.467	3572553.483	3372488.827	15050121.17	16774622.88	18175033.75
Cadaverine	504672.3525	452697.8617	488199.6649	617791.5369	19799623.44	21196971.16	23497347.28
Gamma-Aminobutyrate	8393844.568	7962231.293	8262938.906	7582228.926	81125551.06	80041169.47	72273282.94
3-Hydroxybutyrate	180015144.2	171821964.3	195805564.4	170185394.9	241594119.1	237387324.8	237437037.1
Benzaldehyde	1916033.188	1796364.323	1786544.244	1740931.046	11365625.5	11535317.12	11668767.67
Pyrrole-2-Carboxylate	46148301.53	46131191.02	48532972.62	42973446.77	36703299.17	37535400.91	36875004.67
Cytosine	2272583.497	2140945.566	1985489.836	1974970.083	58690632.07	56944298.15	55460404.63
Pantolactone	1936375.584	1811088.838	1933854.233	2031960.995	6176766.033	6745474.019	6750175.001
Valine	6722347.31	1209524.048	1467997.046	1219850.115	45926257.59	44624092.82	45270445.17
Fumarate	3091292.307	2781903.828	3012013.697	2893644.792	18195495.2	17141390.45	17785319.06
Indole	41843385.39	40295171.91	43581797.06	40933065.72	488738581.4	506533218.2	508030673.1
Niacinamide	57323284.5	33732407.49	7890248.612	8936853.621	4256698120	3760904093	3456707759
Thymine	48856325.57	8011894.51	46593947.1	7895646.688	128223735.3	126953482.7	124433217.4
Pyroglutamate	16505943.51	16048475.98	18442871.4	15733873.03	783682960.4	731409644	758096381.1
Quinoline	16395408.74	24578848.01	9774006.57	19875068.08	28119862.35	33369392.62	32172338.71
Pipecolate	17838303.09	11102918.96	11483917.63	13777313.54	2273885102	2291653849	1602440470
Leucine	72642593.59	28604772.12	17619819.66	48607148.72	206046582.2	298693965.9	289401869
Cinnamate	2089444.46	2077121.648	2065600.211	1834315.785	26548186.4	24581413.26	24730737.56
4-Hydroxy-D-Proline	9460114.425	10615851.59	11862202.47	9609508.413	6311712.52	4641765.781	4312303.757
N-Acetyl-L-Alanine	2811374.955	2746175.632	2682514.152	2566526.011	11181938.52	11781052.28	10490474.74
Isoleucine	71788325.23	81641149.8	59746671.1	122824647.7	2102230001	1995144161	1988269663
Malate	655284.3273	564353.0709	499591.5853	556664.1453	27954690.04	27579221.36	31154849.46
Adenine	108751108.7	115529485.2	105002031.2	106904123.2	246226341	259624244.4	204492669.6
Threonate	7380628.963	7828704.331	6402994.877	7102813.955	149464676.7	181673226.5	168140459
Urocanate	3521760.597	4363044.502	3957324.748	5162677.261	5990322.252	6802906.003	5626597.676
Hypoxanthine	9024286.014	8665449.689	8798006.196	9930382.995	1301867742	1165946255	1174883656
2-Methoxyhydroquinone	6278608.642	5968127.117	1627874.742	1479579.455	18586645.4	18148443.68	17823614.67
Caprylate	3569605.467	3639728.214	3833184.402	3662206.339	1773561.731	1190923.27	1183962.703
Coumarin	28464526.18	29364393.07	33569056.1	29675459.7	527101644.6	483742002.2	553963886.6
Glutamate	3166125.015	4514682.567	3036720.484	3361319.604	3658004340	3820384108	2761821457
Lysine	4360303.166	3451052.01	4318364.826	3723268.778	117102988.9	116667826	89322553.5
Ribose	24998684.54	32023103.31	37005960.44	23979361.42	144793670.7	118537380.1	98950109.25
Methionine	1160898.4	1201612.93	1451206.997	1276247.083	65667629.91	76153669.23	73036299.04
Guanine	4237756.033	4234101.554	4761603.568	4302172.645	63070388.08	72490237.51	66353454.32
Lyxose	60797111.85	64138150.26	61406297.27	58136927.96	43940222.07	45543971.8	44896378.2
Arabitol	3542946.152	3321101.606	3086274.553	3749602.951	68833324.39	73649134.73	70420424.34
Xanthine	14222998.13	15544133.44	16243581.29	14762851.34	522842286.2	480155000.4	494484903.3
Gentisate	60.29200215	60.29200215	60.29200215	60.29200215	258321094.3	276742801.6	65997648.03
Oxoadipate	138059257.6	139951597.8	111471619.9	154348975.7	91605979.03	59389926.99	71646439.43
Tryptamine	6536332.495	6470254.666	6675788.934	6494557.621	34288884.49	34645002.01	33413727.99
Carnitine	12943149.61	13023682.69	13293973.64	13234883.5	58275282.24	59349122.3	52687196.42
Pterin	13105146.42	14248703.89	16349110.45	14403532.45	6879515.06	7016439.807	6922277.637
7-Methylguanine	172086.6304	156319.377	187481.8327	217537.2394	3867111.476	3802639.977	3794755.973
Beta-Homomethionine	1162489.326	1104800.585	5559120.148	1123000.363	18923357.71	20850211.95	18592494.63
Coumarate	8912113.374	9261330.303	10036673.89	9095491.382	7198996.001	7469340.423	7621757.267
Methionine S-Oxide	15146313.23	8162029.001	28034906.78	11570937.86	212711253.8	196674745.4	246040268.6
Phenylalanine	190714908.5	197199123.4	204171993.4	196803406.3	3098768897	2888155627	2886758738
Vanillate	2715751.383	2571501.244	3034873.961	2711326.722	9047976.84	8986605.197	9281045.54
4-Hydroxyphenylglycine	602499.2479	1185946.87	1921310.794	1225966.113	11628908.99	12922640.62	15072060.76
Stachyose	66475308.77	56106385.25	70654751.81	64645949.06	136962579.6	98642021.93	107652508.7
Quinaldate	1943094.702	1337998.155	1607383.079	1541496.592	4527414.998	3931208.461	3493063.386
N-Formyl-L-Methionine	411747.4814	375741.5149	308566.342	391800.9367	4649448.514	5158689.399	5046063.895
Guanidinosuccinate	52446553.23	21784077.76	14852871.84	29956293.93	105181862.4	102930150.1	102026604.3
Coniferyl Aldehyde	1584879.132	1564929.584	1650837.242	1443209.007	3067067.614	3638252.924	3597957.162
Theophylline	14209363.21	12843105.39	13184510.11	12969522.7	7950943.884	1918299.075	1874013.395
Tyrosine	17383952.38	16187984.47	18383441.9	16967206.26	177995517.8	179668803.1	168799473.6
Sorbitol	297026868	164683604.8	219554817.8	262855072.8	913353616.2	993514887	907491720.2
Sebacate	3530483.989	2253051.096	2406387.587	2126310.149	6936735.632	11117931.71	10216004.51
Indoleacrylate	365175.2615	304530.7331	289521.8834	321948.1542	10788490.55	11430759.26	10906696.11
Azelaic acid	22383843.62	24583850.42	22203905.61	24959056.48	85615740.21	84634075.62	83024247.99
Alpha-Acetyllysine	80333351.54	83131406.86	91506486.4	83283447.26	17968905212	18531686515	18542487513
Glycylleucine	1322673.997	1561324.219	1082332.338	1190817.348	46113458.25	43238428.56	40444326.43
N-Acetylglutamate	17760612.16	20267361.68	24633249.59	18976317.61	11703855.14	11482966.47	11921447.02
N-Acetyl-DL-Methionine	658771.8917	821832.9789	151446.8679	940615.1564	20494286.68	17929896.02	19277392.14
Daidzin	263582.0268	247055.9071	234615.8994	2403.396568	832577.8493	594589.2556	584831.942
Citrate	1369684825	1430630733	1500360580	1456216580	424545372.3	318429884.9	379555088.4
Phenylacetylglycine	5531173.17	5661916.073	5096500.327	5885321.371	20937475.79	17963330.48	19868880.1
Ferulate	5453169.969	5147177.827	5854033.303	5320100.243	71539318.92	71431914.61	65454671.33
Gluconate	379609.339	440364.769	338838.4115	387103.6208	190248196.1	229161988.3	203960443.9
Gulonate	466329.0863	498470.5615	501093.3769	609324.4229	2620443.547	2880523.686	2258337.949
Mannonate	516444.2179	527328.2034	707215.5761	504053.3769	1041837.582	959874.0126	936744.4253
Dopa	14944423.29	15304719.57	21418424.88	15972014.07	1944309.434	6113568.149	6006136.627
Ala-Ile	373997.9665	411835.241	195739.6998	523360.9292	6346175.171	7110190.095	6116684.304
Maltotriose	95313988.87	74906620.27	110008205.2	91903490.73	266757084.4	255797737.8	257320561.7
Leucyl-Alanine	2068572.318	2296566.841	2420555.642	2219353.155	13475747.6	11589698.99	13823111.87
Tryptophan	67107.63133	46000.05766	55098.99218	111209.3157	25024912.47	25517250.46	25164776.64
Kynurenine	32060051.38	40170010.86	32547759.41	37898981.94	15885834.48	15851401.92	16861395.05
Sinapate	3578277.454	3713859.607	3273895.193	3558501.665	10359433.93	9419276.399	10047870.94
Astragalin	31015.85688	1918237.978	2599.218857	1881380.722	4935676.328	3764039.816	3244725.889
Myristoleate	19446464.46	21804953.43	19069160.33	21457777.74	6006743.17	957712.1798	4784783.595
Dodecanedioate	115027.0343	103259.4288	103568.815	113645.0048	3839342.818	3697296.558	4111757.982
Myristic acid	8387078.863	8724236.77	9063625.984	8496805.648	6927132.021	7145829.876	6930174.62
Butyryl-L-Carnitine	1200678.429	1271381.131	1223670.179	1241855.671	8128544.028	7583699.412	7953078.804
N-Lactoyl-Phenylalanine	722236.0418	1006710.693	950973.7308	943692.9746	12281555.19	11409692.09	11205785.48
Uridine	498567.5283	443610.0136	450468.02	474968.3142	131872982.4	119271011.3	117904011.3
4-Oxododecanedioic acid	1041138.686	1087074.571	992758.409	1096173.09	9643837.803	9237292.804	9265129.846
3-Hydroxy-Tetradecanoic acid	49615633.74	51800655.11	49799388.35	50438561.35	107545320.4	95903197.79	94238219.69
Cytidine	349526.6102	433785.3493	375677.8057	573145.405	48172939.42	45987713.22	48473049.77
N-Acetyl-DL-Tryptophan	161732.4479	185017.1037	165157.9701	172494.8542	6501214.317	6548811.79	6251824.095
Phe-Pro	4882699.64	4942001.151	4853386.95	5009536.571	74374798.47	71046439.37	68588887.05
Glycitin	24491509.32	4453.806534	23242209.12	2887.17312	97066971.02	67883445.93	59705207.14
2-Deoxyadenosine	2527178.028	2515578.259	2534312.551	2453862.667	27877484.53	27265963.9	25352722.5
5,7-Dihydroxyflavone	1268600.446	1070137.848	1149156.226	922050.2986	107645722	68272821.02	77534355.78
Palmitoleic acid	22360632.08	20850533.14	24716099.81	19282976.85	1033864742	852299629.5	811832404.6
Naringenin	639089.2627	4785668.063	3872878.81	2940205.04	27715768.21	30940340.61	32894426.85
Glu-Leu	816608.9279	751195.7392	742054.0932	808743.8307	32933838.71	26587151.42	27820718.6
Thiamine	6501175.378	5355097.665	3108232.682	6193506.402	20183576.82	19187875.44	24421045.2
Valyl-Phenylalanine	2759381.918	3008304.627	3333915.371	2958321.582	18871127.29	15849580.13	18315842.72
2-Deoxyguanosine	588229.9354	637492.1684	779918.1699	694037.1205	12957823.18	13087157.61	11871817.07
Adenosine	59104.76361	79558.91772	76052.24543	75140.94798	13783898.5	12478153.2	11051674.83
Hesperetin	1366157.283	12449047.29	12227767.72	11561773.84	16290845.67	23129270.89	22945904.41
Inosine	13127411.59	13646226.49	15137360.8	13964167.9	1032210697	876869454.7	885305520.2
12-OPDA	2567936.882	1675895.335	2169677.67	2641088.41	19225861.21	21338876.7	20215474.18
Stearidonic acid	72460159.47	83374924.07	78056912.75	80582037.08	924589078	862289959.6	868857004.8
Linoleic acid	48045611.41	49922728.53	56108159.94	49492570.06	74108801.94	82397654.84	80263938.47
Guanosine	143921.5328	11977.1195	15984.32994	59024.98625	19492270.3	17734764.86	18126586.28
Hexadecanedioic acid	10815775.09	10084735.12	9880561.931	6610822.683	18654980.72	19116943.53	28768991.08
13-L-Hydroperoxylinoleic acid	335238933.4	363799508.5	343429516.9	358222086.2	6644440177	6503057708	6546701778
Gingerol	1469600.23	3532586.721	2490570.082	1975676.156	14075395.85	12653052.01	14158198.58
13S-Hydroxyoctadecadienoic acid	9371241.057	8557641.276	17200167.59	8432513.835	1157392434	1059127509	1122151136
9,10-Epoxyoctadecenoic acid	1423880255	1516234890	1467502678	1496553631	11942847690	12047634250	12011722979
Nonadecanoic acid	1395992347	1651005331	1624445569	1601347274	2089329772	2070011921	2051346212
2-O-Methylguanosine	221232.0591	206319.059	108637.4156	147522.9998	14312770.18	12981589.09	12503980.5
Arachidonic acid	122295.2138	133236.625	182030.4783	164039.6516	3622053.841	3078362.964	2890439.83
dCMP	3613232.534	3133327.427	3381381.377	3042395.124	2254395.226	2443975.356	2563846.092
Ribose-1,5-Bisphosphate	28465589.15	24515986.91	26008649.86	39552909.62	14294912.06	15673989.73	13484934.74
9,10-DHOME	193186887.6	202611826.6	201909483.7	217465680	3135732061	3261326923	3162441152
Malvidin	1537146.334	1800957.576	1804019.677	2003452.061	10392399.2	19784164.47	29801594.23
15-Deoxy-D-12,14-PGJ2	4063912.228	4384562.897	4225291.815	3814959.027	8138915.06	7498221.075	10281875.2
Alpha-Linolenoyl Ethanolamide	1186598.178	516378.102	543654.8414	3557113.606	65367719.35	64077115.36	65946740.95
Cellobiose	14114.03585	8154.49118	16342.97193	9701027.599	24896751.04	23524504.64	25030999
Cyclic AMP	1019398.9	1176078.391	1124491.013	1113352.411	11454154.3	10207083.9	10618144.57
3-AMP	339601.0039	1097370.848	954636.8568	307673.8741	14838611.36	12661737.85	12922853.01
5-O-Beta-D-Glucosylpyridoxine	973.1869568	896.2745847	2357.632803	1392.629396	6625051.437	6123802.196	5907727.262
5,6-DiHETE	257067.0615	274761.348	241064.6178	281512.9638	127530445.6	120463026.7	128312358
5,6-DHET	1137860.89	1329299.675	1283619.315	2016535.415	148627015.9	130646281.7	135723042.1
Trehalose	598696478.5	546761950.2	898804295.7	868622399.1	171277906.9	209528734.4	160953979.8
MG(18:2/0:0/0:0)	3934237.902	4693024.569	5470858.932	4218710.698	47467776.35	26704944.84	40233699.31
2-Linoleoyl Glycerol	30771252.04	20411693.14	2181734.201	19878934.05	1257796497	1237972600	1066413197
Rosmarinate	3415.307294	1126.214346	1123.93335	1543.545126	6446582.584	5624955.003	5764339.953
N-Oleoyl-Serine	781177.2727	676936.5773	813407.7998	708708.6372	26143338.5	21577617.74	21691585.08
N-Arachidonoyl-Alanine	67924.22222	134157.7246	144270.6875	123806.6614	20686765.04	21456458.31	20250606.33
S-Adenosylhomocysteine	2253.367392	2099.226329	3133.290834	1332.637297	3153366.739	2961036.151	2786501.397
Acetyl-Maltose	27901.64695	244577.0258	28967.2605	216568.831	4981903.325	4262796.154	4230313.837
Deoxycholic acid	45096695.43	39883780.49	33503138.68	40617882.22	20413835.47	20873920	20786052.57
Cosmosiin	1104138.611	1159203.111	1339334.297	895.3126968	4035439.028	3193056.554	2256161.555
Oleanoic acid	29450.07838	19126.23406	22813.05568	37816.46161	12072189.73	9932993.453	12168287.86
Folic acid	8732868.965	8252387.89	7019440.999	9453627.17	425131.0734	999566.5676	725986.5619
PC(14:0/0:0)	47337245.29	60753819.77	58161455.34	52824141.85	570659605.9	573047141.5	522884084.6
Raffinose	1721080.344	1730532.037	1895449.419	2018421.616	32330461.34	43123269.88	33146094.79
1-Heptadecanoyl-sn-Glycero-3-Phosphocholine	6802609.405	2321944.293	1466619.082	2506326.448	15565130.72	23248156.16	23757485.64
6-Malonylgenistin	1202203.146	1434033.518	3127.441414	1252905.091	5397204.988	3674027.645	3579945.805
Syringaresinol O-Beta-D-Glucoside	1114289.639	1094744.949	1129460.628	1090179.722	2088439.068	2270503.646	2477705.026
Maltotetraose	10957927.58	16361920.43	9220976.836	13070700.13	542135.6085	8605313.767	2610862.984
Maltohexaose	24264316.13	36033985.93	21405868.14	24027413.67	51699.29307	150068.6749	87742.45286

metabolite_name
Alanine
Valerolactam
2-Ketobutyrate
Cadaverine
Gamma-Aminobutyrate
3-Hydroxybutyrate
Benzaldehyde
Pyrrole-2-Carboxylate
Cytosine
Pantolactone
Valine
Fumarate
Indole
Niacinamide
Thymine
Pyroglutamate
Quinoline
Pipecolate
Leucine
Cinnamate
4-Hydroxy-D-Proline
N-Acetyl-L-Alanine
Isoleucine
Malate
Adenine
Threonate
Urocanate
Hypoxanthine
2-Methoxyhydroquinone
Caprylate
Coumarin
Glutamate
Lysine
Ribose
Methionine
Guanine
Lyxose
Arabitol
Xanthine
Gentisate
Oxoadipate
Tryptamine
Carnitine
Pterin
7-Methylguanine
Beta-Homomethionine
Coumarate
Methionine S-Oxide
Phenylalanine
Vanillate
4-Hydroxyphenylglycine
Stachyose
Quinaldate
N-Formyl-L-Methionine
Guanidinosuccinate
Coniferyl Aldehyde
Theophylline
Tyrosine
Sorbitol
Sebacate
Indoleacrylate
Azelaic acid
Alpha-Acetyllysine
Glycylleucine
N-Acetylglutamate
N-Acetyl-DL-Methionine
Daidzin
Citrate
Phenylacetylglycine
Ferulate
Gluconate
Gulonate
Mannonate
Dopa
Ala-Ile
Maltotriose
Leucyl-Alanine
Tryptophan
Kynurenine
Sinapate
Astragalin
Myristoleate
Dodecanedioate
Myristic acid
Butyryl-L-Carnitine
N-Lactoyl-Phenylalanine
Uridine
4-Oxododecanedioic acid
3-Hydroxy-Tetradecanoic acid
Cytidine
N-Acetyl-DL-Tryptophan
Phe-Pro
Glycitin
2-Deoxyadenosine
5,7-Dihydroxyflavone
Palmitoleic acid
Naringenin
Glu-Leu
Thiamine
Valyl-Phenylalanine
2-Deoxyguanosine
Adenosine
Hesperetin
Inosine
12-OPDA
Stearidonic acid
Linoleic acid
Guanosine
Hexadecanedioic acid
13-L-Hydroperoxylinoleic acid
Gingerol
13S-Hydroxyoctadecadienoic acid
9,10-Epoxyoctadecenoic acid
Nonadecanoic acid
2-O-Methylguanosine
Arachidonic acid
dCMP
Ribose-1,5-Bisphosphate
9,10-DHOME
Malvidin
15-Deoxy-D-12,14-PGJ2
Alpha-Linolenoyl Ethanolamide
Cellobiose
Cyclic AMP
3-AMP
5-O-Beta-D-Glucosylpyridoxine
5,6-DiHETE
5,6-DHET
Trehalose
MG(18:2/0:0/0:0)
2-Linoleoyl Glycerol
Rosmarinate
N-Oleoyl-Serine
N-Arachidonoyl-Alanine
S-Adenosylhomocysteine
Acetyl-Maltose
Deoxycholic acid
Cosmosiin
Oleanoic acid
Folic acid
PC(14:0/0:0)
Raffinose
1-Heptadecanoyl-sn-Glycero-3-Phosphocholine
6-Malonylgenistin
Syringaresinol O-Beta-D-Glucoside
Maltotetraose
Maltohexaose