#METABOLOMICS WORKBENCH nsouthwell_20220127_135649 DATATRACK_ID:3055 STUDY_ID:ST002068 ANALYSIS_ID:AN003371 PROJECT_ID:PR001310
VERSION             	1
CREATED_ON             	January 28, 2022, 3:19 pm
#PROJECT
PR:PROJECT_TITLE                 	Mutant CHCHD10 causes an extensive metabolic rewiring that precedes OXPHOS
PR:PROJECT_TITLE                 	dysfunction in a murine model of mitochondrial cardiomyopathy
PR:PROJECT_SUMMARY               	Mitochondrial cardiomyopathies are fatal diseases, with no effective treatment.
PR:PROJECT_SUMMARY               	Alterations of heart mitochondrial function activate the mitochondrial
PR:PROJECT_SUMMARY               	integrated stress response (ISRmt), a transcriptional program affecting cell
PR:PROJECT_SUMMARY               	metabolism, mitochondrial biogenesis, and proteostasis. In humans, mutations in
PR:PROJECT_SUMMARY               	CHCHD10, a mitochondrial protein with unknown function, were recently associated
PR:PROJECT_SUMMARY               	with dominant multi-system mitochondrial diseases, whose pathogenic mechanisms
PR:PROJECT_SUMMARY               	remain to be elucidated. Here, in CHCHD10 knock-in mutant mice, we identify an
PR:PROJECT_SUMMARY               	extensive cardiac metabolic rewiring triggered by proteotoxic ISRmt. The stress
PR:PROJECT_SUMMARY               	response arises early on, before the onset of bioenergetic impairments,
PR:PROJECT_SUMMARY               	triggering a switch from oxidative to glycolytic metabolism, enhancement of
PR:PROJECT_SUMMARY               	transsulfuration and one carbon (1C) metabolism, and widespread metabolic
PR:PROJECT_SUMMARY               	imbalance. In parallel, increased NADPH oxidases elicit antioxidant responses
PR:PROJECT_SUMMARY               	leading to heme depletion. As the disease progresses, the adaptive metabolic
PR:PROJECT_SUMMARY               	stress response fails, resulting in fatal cardiomyopathy. Our findings suggest
PR:PROJECT_SUMMARY               	that early interventions to counteract metabolic imbalance could ameliorate
PR:PROJECT_SUMMARY               	mitochondrial cardiomyopathy associated with proteotoxic ISRmt.
PR:INSTITUTE                     	Weill Cornell Medicine
PR:LAST_NAME                     	Southwell
PR:FIRST_NAME                    	Nneka
PR:ADDRESS                       	407 E 61st St
PR:EMAIL                         	nns4001@med.cornell.edu
PR:PHONE                         	646-962-8172
#STUDY
ST:STUDY_TITLE                   	Mutant CHCHD10 causes an extensive metabolic rewiring that precedes OXPHOS
ST:STUDY_TITLE                   	dysfunction in a murine model of mitochondrial cardiomyopathy
ST:STUDY_SUMMARY                 	Mitochondrial cardiomyopathies are fatal diseases, with no effective treatment.
ST:STUDY_SUMMARY                 	Alterations of heart mitochondrial function activate the mitochondrial
ST:STUDY_SUMMARY                 	integrated stress response (ISRmt), a transcriptional program affecting cell
ST:STUDY_SUMMARY                 	metabolism, mitochondrial biogenesis, and proteostasis. In humans, mutations in
ST:STUDY_SUMMARY                 	CHCHD10, a mitochondrial protein with unknown function, were recently associated
ST:STUDY_SUMMARY                 	with dominant multi-system mitochondrial diseases, whose pathogenic mechanisms
ST:STUDY_SUMMARY                 	remain to be elucidated. Here, in CHCHD10 knock-in mutant mice, we identify an
ST:STUDY_SUMMARY                 	extensive cardiac metabolic rewiring triggered by proteotoxic ISRmt. The stress
ST:STUDY_SUMMARY                 	response arises early on, before the onset of bioenergetic impairments,
ST:STUDY_SUMMARY                 	triggering a switch from oxidative to glycolytic metabolism, enhancement of
ST:STUDY_SUMMARY                 	transsulfuration and one carbon (1C) metabolism, and widespread metabolic
ST:STUDY_SUMMARY                 	imbalance. In parallel, increased NADPH oxidases elicit antioxidant responses
ST:STUDY_SUMMARY                 	leading to heme depletion. As the disease progresses, the adaptive metabolic
ST:STUDY_SUMMARY                 	stress response fails, resulting in fatal cardiomyopathy. Our findings suggest
ST:STUDY_SUMMARY                 	that early interventions to counteract metabolic imbalance could ameliorate
ST:STUDY_SUMMARY                 	mitochondrial cardiomyopathy associated with proteotoxic ISRmt.
ST:INSTITUTE                     	Weill Cornell Medicine
ST:LAST_NAME                     	Southwell
ST:FIRST_NAME                    	Nneka
ST:ADDRESS                       	407 E 61st St
ST:EMAIL                         	nns4001@med.cornell.edu
ST:PHONE                         	646-962-8172
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Mus musculus
SU:TAXONOMY_ID                   	10090
#FACTORS
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data
SUBJECT_SAMPLE_FACTORS           	-	S75dCtrl_1	Genotype:WT | Sex:M | Age (d):75	RAW_FILE_NAME=75dCtrl_1.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S75dCtrl_2	Genotype:WT | Sex:F | Age (d):75	RAW_FILE_NAME=75dCtrl_2.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S75dCtrl_3	Genotype:WT | Sex:F | Age (d):75	RAW_FILE_NAME=75dCtrl_3.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S75dCtrl_4	Genotype:WT | Sex:M | Age (d):75	RAW_FILE_NAME=75dCtrl_4.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S75dCtrl_5	Genotype:WT | Sex:M | Age (d):75	RAW_FILE_NAME=75dCtrl_5.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S75dMut_1	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):75	RAW_FILE_NAME=75dMut_1.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S75dMut_2	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):75	RAW_FILE_NAME=75dMut_2.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S75dMut_3	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):75	RAW_FILE_NAME=75dMut_3.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S75dMut_4	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):75	RAW_FILE_NAME=75dMut_4.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S75dMut_5	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):75	RAW_FILE_NAME=75dMut_5.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dCtrl_6	Genotype:WT | Sex:F | Age (d):125	RAW_FILE_NAME=125dCtrl_6.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dCtrl_7	Genotype:WT | Sex:M | Age (d):125	RAW_FILE_NAME=125dCtrl_7.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dCtrl_8	Genotype:WT | Sex:F | Age (d):125	RAW_FILE_NAME=125dCtrl_8.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dCtrl_9	Genotype:WT | Sex:M | Age (d):125	RAW_FILE_NAME=125dCtrl_9.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dCtrl_10	Genotype:WT | Sex:M | Age (d):125	RAW_FILE_NAME=125dCtrl_10.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dCtrl_11	Genotype:WT | Sex:M | Age (d):125	RAW_FILE_NAME=125dCtrl_11.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dMut_6	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):125	RAW_FILE_NAME=125dMut_6.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dMut_7	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):125	RAW_FILE_NAME=125dMut_7.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dMut_8	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):125	RAW_FILE_NAME=125dMut_8.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dMut_9	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):125	RAW_FILE_NAME=125dMut_9.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dMut_10	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):125	RAW_FILE_NAME=125dMut_10.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S125dMut_11	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):125	RAW_FILE_NAME=125dMut_11.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S225dCtrl_12	Genotype:WT | Sex:F | Age (d):225	RAW_FILE_NAME=225dCtrl_12.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S225dCtrl_13	Genotype:WT | Sex:F | Age (d):225	RAW_FILE_NAME=225dCtrl_13.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S225dCtrl_14	Genotype:WT | Sex:M | Age (d):225	RAW_FILE_NAME=225dCtrl_14.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S225dCtrl_15	Genotype:WT | Sex:M | Age (d):225	RAW_FILE_NAME=225dCtrl_15.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S225dCtrl_16	Genotype:WT | Sex:M | Age (d):225	RAW_FILE_NAME=225dCtrl_16.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S225dMut_12	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):225	RAW_FILE_NAME=225dMut_12.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S225dMut_13	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):225	RAW_FILE_NAME=225dMut_13.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S225dMut_14	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):225	RAW_FILE_NAME=225dMut_14.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S225dMut_15	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):225	RAW_FILE_NAME=225dMut_15.mzXML
SUBJECT_SAMPLE_FACTORS           	-	S225dMut_16	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):225	RAW_FILE_NAME=225dMut_16.mzXML
#COLLECTION
CO:COLLECTION_SUMMARY            	Murine heart tissue was excised and snap frozen in liquid N2.
CO:SAMPLE_TYPE                   	Heart
#TREATMENT
TR:TREATMENT_SUMMARY             	N/A
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	15 mg of cardiac tissue was homogenized in 80% methanol (Sigma) using Tissue
SP:SAMPLEPREP_SUMMARY            	Tearer (BioSpec) on dry ice. Samples were incubated at -80ºC for 4 hours.
SP:SAMPLEPREP_SUMMARY            	Homogenates were then centrifuged at 14,000 rfc for 20 min at 4ºC. The
SP:SAMPLEPREP_SUMMARY            	supernatant was extracted and stored at -80ºC for mass spectroscopy (Weill
SP:SAMPLEPREP_SUMMARY            	Cornell Medicine Meyer Cancer Center Proteomics & Metabolomics Core Facility).
SP:SAMPLEPREP_SUMMARY            	Peak intensities for metabolites were screened for missing values and analyzed
SP:SAMPLEPREP_SUMMARY            	by using MetaboAnalyst software (version 5.0).
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	HILIC
CH:INSTRUMENT_NAME               	Thermo Vanquish
CH:COLUMN_NAME                   	SeQuant ZIC- pHILIC (150 x 2.1mm, 5um)
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Thermo Q Exactive Orbitrap
MS:INSTRUMENT_TYPE               	Orbitrap
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	NEGATIVE
MS:MS_COMMENTS                   	-
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	Peak Intensity
MS_METABOLITE_DATA_START
Samples	S125dCtrl_10	S125dCtrl_11	S125dCtrl_6	S125dCtrl_7	S125dCtrl_8	S125dCtrl_9	S125dMut_10	S125dMut_11	S125dMut_6	S125dMut_7	S125dMut_8	S125dMut_9	S225dCtrl_12	S225dCtrl_13	S225dCtrl_14	S225dCtrl_15	S225dCtrl_16	S225dMut_12	S225dMut_13	S225dMut_14	S225dMut_15	S225dMut_16	S75dCtrl_1	S75dCtrl_2	S75dCtrl_3	S75dCtrl_4	S75dCtrl_5	S75dMut_1	S75dMut_2	S75dMut_3	S75dMut_4	S75dMut_5
Factors	Genotype:WT | Sex:M | Age (d):125	Genotype:WT | Sex:M | Age (d):125	Genotype:WT | Sex:F | Age (d):125	Genotype:WT | Sex:M | Age (d):125	Genotype:WT | Sex:F | Age (d):125	Genotype:WT | Sex:M | Age (d):125	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):125	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):125	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):125	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):125	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):125	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):125	Genotype:WT | Sex:F | Age (d):225	Genotype:WT | Sex:F | Age (d):225	Genotype:WT | Sex:M | Age (d):225	Genotype:WT | Sex:M | Age (d):225	Genotype:WT | Sex:M | Age (d):225	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):225	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):225	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):225	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):225	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):225	Genotype:WT | Sex:M | Age (d):75	Genotype:WT | Sex:F | Age (d):75	Genotype:WT | Sex:F | Age (d):75	Genotype:WT | Sex:M | Age (d):75	Genotype:WT | Sex:M | Age (d):75	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):75	Genotype:CHCHD10 S55L+/- | Sex:F | Age (d):75	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):75	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):75	Genotype:CHCHD10 S55L+/- | Sex:M | Age (d):75
D-Glucose	4865061	2042894	4096494	2043236	7834317	2408456	3860415	1195007	4571502	8291768	2937373	4246668	5244229	3480874	8684254	9754421	7897856	1650818	1655073	1314514	17594030	7170946	1546459	1620009	1960781	4063461	3306034	2577742	1753479	1658118	1767687	1938970
Myoinositol	11203540	2801385	3849758	4298243	3381177	2988894	4342773	5107156	5149885	14738650	7368278	6053654	15236220	6394965	4166778	5438236	11655530	7448058	7292486	7128891	10298740	11577140	1549197	2869198	3563225	3927945	2411717	6216615	3996265	6047882	5329106	3121092
Cyclic AMP	0	25889.21	0	9980.371	57404.77	13177.03	0	0	15490	18354.53	8608.538	0	19600.45	0	0	13653.1	0	0	0	0	0	13610.49	28125.83	35264.23	42775.94	541276.6	75432.55	169405.6	198649.6	0	23984.28	96684.59
Thiamine	4763023	1961573	5631280	5634242	8165995	1837912	8482564	3469358	8278699	4161858	5227805	11826510	1373710	4042074	2521650	3138167	2394270	4411451	7445160	3637800	7816517	2312774	196900.1	250414.5	169767.8	6073274	5615406	374494.7	379314.7	6355271	7262660	978008
Thiamine monophosphate	75237.73	196221.9	102842	154112.9	202701.8	61807.34	0	83587.44	68413.63	136604.2	56021.14	0	234060.3	423047.4	105519.5	217294.8	116573.7	131137.5	212780.3	141383.3	0	52226.48	108546.7	130180	137683.6	225074.3	167427.9	70346.95	151006.5	47199.72	139015.4	87867.57
Guanosine triphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Nicotinamide ribotide	85451.04	135871.8	14647.7	287726.2	0	135911.2	0	0	0	29707.03	58663.27	0	561783.8	98639.13	46407.16	52072.2	228152.6	0	0	0	0	42141.11	149289.8	105094.9	101498.4	46965.33	0	159899.5	106366.3	0	0	92652.98
Thymidine	398415.8	325867.1	289072	298385	659904.3	434643.5	233832.4	294555.7	199335.6	1122563	245481.1	238584.5	744038.7	459921.8	399305.2	612557.5	383253.9	296834.3	330479.1	291240.3	346848.2	310838.9	197676.9	255798.1	386016.8	1552076	712650.8	216758.8	420906.8	425849.2	508782.2	384821.4
Indoxyl sulfate	114448.7	249748.2	236697.2	152962.3	536596.1	284675.9	681392.4	402736.7	643286.4	886595	133921	810193.8	822345.6	681742.2	612744.2	270089.4	332961.3	815013.8	1903563	240098.5	489680.2	1495616	105871.5	417561.7	651171.8	440213.2	306404.7	1003770	2236382	1051831	567280.8	160274.5
1-Methylnicotinamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
N-acetyltryptophan	46969.95	17208.03	15040.64	7434.888	22237.19	39082.24	24958	22895.08	17196.01	45031.32	32250.21	19655.3	88114.62	42263.97	44806.84	47272.49	40784.94	47776.34	41355.5	47340.57	60024.14	81086.91	17540.17	16146.16	17182.56	62152.77	21755.81	34493.65	103297.2	86428.59	34894.32	33967.48
Isovalerylcarnitine	2106100	3744634	2375649	2886091	3160870	3922605	3084953	3046750	3357883	5122526	3355490	4146285	8440632	2010035	1768915	2835671	2451719	3205078	3063574	3723357	2685274	3375004	3265763	2329508	3458699	2006663	3446927	5487763	6252857	2622586	6203516	3887150
S-Adenosylhomocysteine	1510605	802524.1	872928	1132428	1023120	958518.4	1560703	1069642	1353745	1008885	833253.8	2062197	1359186	1872568	1025603	1199885	889553	1141774	1244154	857087.6	2147873	996817.6	487768.8	411453	488236.7	533486.2	444618.9	1487312	1849541	1098758	1780747	671580.7
Palmitic acid	204092100	211441100	226900700	175232200	322036200	223574100	177279000	128798000	130771900	316229300	182058300	267658600	190075500	301555600	278015600	217015000	154131900	232558800	74210740	160887100	47925180	167503200	75652940	37448740	30042560	327654100	39681900	19744820	22522090	121473600	195665400	153384200
3-Phosphoglyceric acid	78371.01	192410.5	132821.1	59619.54	310959.9	221251.2	185527.6	164084.8	284057.9	1667604	132663.8	129874.4	1199406	177990.1	198635.5	278321.4	115725.2	290576.8	312424.3	98048.48	201815.6	196353.1	17681.37	56768.89	77744.46	269925.3	55715.79	127740.2	151429.9	191653.9	270321.9	291635.3
L-Threonine	29634350	27687770	26652630	31130730	34950320	46102510	62581850	78432380	56595720	54316000	48084560	59965920	41356650	36253520	27154570	24312310	20908240	74612020	78244210	61339240	53662500	63574300	29713380	32273010	35961790	45033080	29071010	56393540	82880800	83846490	127418500	41776620
ADP	233319.7	519410.8	338621.6	330246.4	588983.3	806454.4	119213.7	375332.5	177907	182926	145107.2	125871.2	2471028	745853.9	785124.9	1150047	209795.2	386259.9	221031.5	150123.4	171873	115669.7	320956.8	1751020	1671513	1071374	436134.6	703327.1	1208617	265696.3	307472.2	1482024
5'-Methylthioadenosine	16257550	16555580	10298720	12064090	13824780	14338640	6647628	26217140	9813972	14155020	14044480	11063490	26094680	22960550	17802040	17858960	9772087	26416300	19796080	21584940	18968940	21603260	15931800	8771825	21979620	15150940	16191540	13009130	13251970	22622220	27913530	10166040
L-Acetylcarnitine	103315800	130625300	47535960	45647620	161854400	61490050	94348310	85246610	32635060	63919070	108987000	169004000	262781600	181104400	150234500	166152800	208254800	136806800	119878700	181374100	171563300	138050400	576466500	624135400	714975800	109752600	194649900	571472900	596720700	91350590	74985650	474749200
dCTP	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Leucine	57849020	38092250	40649090	40108780	103911400	62982080	98776480	85915500	88174040	125457300	54685720	93025580	64143780	43331490	40966860	31281460	47956690	73687380	93330200	58016650	86134340	69260260	27888210	25009410	35356020	354957400	81735580	74248340	80758780	119885500	164231100	128000500
Deoxyadenosine monophosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Deoxyadenosine triphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
GDP-glucose	16863.56	0	0	8841.253	9067.103	0	0	4742.868	0	0	0	0	19731.95	13819.64	0	7191.801	8233.377	0	0	0	0	0	0	8946.35	21625.43	20534.89	0	0	8780.598	0	0	16633.04
N-Acetylglutamine	107998.7	94448.61	98271.23	51035.69	110630.8	107543.9	33350.14	82275.61	42709.96	83130.88	78792.52	39442.46	126181.2	92356.02	138240.1	103818.3	110504.4	86228.17	79152.48	62678.14	96277.68	70928.16	50841.38	51946.53	93987.49	316132.3	126285.5	50551.82	89916.84	220497.4	107064.8	87009.77
Taurine	481088500	535265500	510408500	513605000	519752600	592699900	351380500	495208900	346509500	328029000	424059800	381746500	802724200	727216900	632236900	574610900	436906700	526908300	584363300	450244800	375919100	436958100	514538400	506922800	636247100	575354800	516825600	495209200	573732200	507809500	627083600	312168900
Sedoheptulose 1,7-bisphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Ascorbic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Deoxyinosine	114788.6	92099.63	65151.39	89940.48	234204.5	69143.29	88073.57	89142.67	106819.9	205748.1	100819.1	97440.57	110073.5	76512.56	78574.83	77015.75	48758.53	137598.4	186883	119867.8	102580.5	90689.14	59582.1	78378.53	174868.4	1314828	332451.6	55950.49	108962.4	142566.1	156478.6	225059.5
Butyrylcarnitine	32953050	36046420	14010170	18447130	26193970	27876960	16417060	26699860	10447830	13824470	25780060	20812060	88993420	49098360	36932040	50509220	45368260	30902940	20254440	34766630	21999890	26464160	126806600	98953730	122448400	37038740	40951770	93528030	90049260	18870110	24095310	40159590
L-Palmitoylcarnitine	11079530	2630231	1279226	4233891	914947.9	13943030	2625265	3570981	2216331	3978748	7349721	3738955	25723440	12657860	13638330	14114110	9433579	7220971	2087448	4400635	2935165	7903045	2469378	690934.8	1500324	4375143	576446.8	2163712	3619552	1531664	4209057	4840860
3-Methylhistidine	3599014	4856372	4099790	5064566	3793813	6531551	6882099	13342510	7649864	2961221	6592871	7672150	9815755	8142367	7401596	5826485	3368902	9447963	10045170	11161060	8920141	7772306	3179083	3079542	3002948	1959783	1796966	7528151	9556974	6566903	6742711	3678482
Allantoin	2192257	2610578	2082336	2415320	3060625	2579620	2279746	3097949	2325195	5534034	2558236	2333398	4651396	3931183	3585596	3099378	3219274	3808733	3825086	3155547	4182095	4874888	1578923	2351343	2404503	3331513	2533961	4157392	7762855	6122468	4024280	2216730
CDP-Ethanolamine	102953.3	212179.6	89987.44	189498.9	156920.8	112368.2	17883.71	62201.71	19023.58	92408.93	34642.18	0	327346.1	191798.8	149928.5	196583.7	94172.39	29725.45	54194.94	44734.21	31471.6	36721.12	639415.7	893987.9	1125486	137035.9	118472.7	628376.1	732507.9	36147.2	46305.84	396855.3
Fumaric acid	5648766	3054610	7166744	2942549	10540400	6077905	8797167	9298542	9070563	9139123	5056096	9992370	10210810	9625555	10519280	12684200	6023139	8949591	13810530	8281171	9910937	9016576	4403026	3144723	4334452	11000820	6855571	6838912	5994943	13334690	8831728	3500597
L-Dihydroorotic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Phenylacetylglycine	176143.1	193324.4	141905.7	235706.2	497977	376214.6	227316.7	254605.2	248081	407657.8	144012.7	392059.2	476587	743807.1	751666.8	605372.1	493228.1	313724	528792	255041.1	430849.5	527048.3	184097.6	311871.3	280714.9	458262.3	221690.6	331124.8	1259846	1250338	204620.9	155778.8
Oxoglutaric acid	652215.1	668533	442117.1	611599.5	678505.8	439034.9	398986.5	649321.3	464844.9	793343.1	812072.6	495292.3	731280.3	534351.9	476076.8	470245	694480.6	625689.4	477413	534598.9	745635	738734	715978.2	622835.9	519771.2	1517922	305193.6	1276461	1016884	289296.3	680664.8	1521989
Guanosine diphosphate	0	7230.815	0	8980.682	6540.221	0	0	7028.723	0	6780.144	0	0	12375.49	7287.088	14101.91	7700.387	7577.108	0	0	6982.184	9361.826	0	0	0	8178.611	0	8666.445	0	7134.174	0	0	18650.43
D-Sedoheptulose 7-phosphate	429056.5	308877	603746	333177.5	807122.4	361762.4	974863.8	1282459	1245114	4723744	771743.4	357787.3	787497.3	527380.9	681956.5	501964.2	680868.9	1253068	1118538	1149400	1003970	1045299	141327.9	111014.3	133829.7	587004.7	333758.2	415463.8	364896.3	1320191	1340101	375796.1
L-Arginine	36010230	34313190	55501170	42838020	59382890	43777920	66756280	67942520	68962330	75746610	55286710	76294130	49071400	43478520	46357510	36463550	37586060	69584100	65770480	55052110	64098250	75475190	42941200	48463340	63912010	41404820	27294680	67140850	71983980	62674960	80726180	41271700
Cytosine	791276.4	610263.2	456634.9	893759.3	1073057	938630.4	503237.5	933535.3	702482.4	1537123	661027.6	632506	1186376	845187.4	1351055	1286298	1045451	951312.9	952869.1	670253.6	977474.2	675193.8	324195.2	336582.8	412476.9	1437302	980133	616768.8	1071956	874319.6	1098429	766032.8
5-Methoxytryptophan	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Methionine	14345850	22980910	13162990	13785740	37623940	24625350	50743900	36746660	33572360	46905720	22342250	44321040	37394840	24281300	13622220	12768850	12187760	30527390	47368700	22791660	30110730	43710420	12444650	21612450	25103190	90035840	25636770	35844470	61027120	41198360	87900400	54177180
Orotic acid	480073.9	448204.8	469205.3	427576.4	654667.1	390722.8	2736978	2191678	1027969	2210611	805229.7	2300244	753003.8	701248.5	701349.4	603831.8	837373.4	2077991	3861215	2226963	2625432	3320284	224373.8	245212.7	256934.7	552015.8	398234.9	477405.2	1250282	3004552	2058008	508316.2
Oxidized glutathione	2648260	647277.8	360337.8	3516926	907458.6	376132.1	2355746	1831628	1092660	966669.5	1213916	3388255	1552077	3792333	687913.5	2218449	455005.4	4822515	4683313	1713512	6674817	1459411	6926665	8241712	10185230	730997.1	192955	20742690	21742110	2174111	6674088	11982880
L-Glutamic acid	400423300	442616100	403360300	397488400	453572500	281226800	476638500	571944100	433757600	385869100	406410900	442223800	669160100	659557200	420738200	472587100	313097300	618563600	638223900	469570500	462562400	419006000	256295200	419707500	444836300	441860400	351476800	319108200	430311100	569626900	727075600	305106900
Cholic acid	0	0	8978.471	32764.52	15083.82	0	39098.62	0	5186.161	34348.99	0	45078.72	56251.92	63276.63	15622.32	7084.149	7339.89	143320.6	30797.76	18275.66	19578.81	41319.69	22390.53	7339.647	8286.949	0	6679.395	17259.54	392576.1	0	34529.93	142468.7
4-Hydroxyproline	2103909	1851815	1191288	1821007	1292130	1976627	3351192	5150009	2462630	2386209	2942152	3014055	1972888	1477968	1978622	2033571	2128108	4354662	4452097	5437108	4582446	3977086	1393159	1423761	1484876	2428224	1800231	3270888	4793412	6779772	7857942	2527567
Caprylic acid	19464260	15925660	7924915	16164610	13038720	16026200	13191820	16266640	13964910	8894386	11748070	10904010	24187260	13102870	9613448	7559685	13099320	15690110	19932530	12609670	25209040	15436070	16714370	11625660	12293600	13676530	13946910	16652440	22365970	23966780	19929340	16394690
Cytidine	10653360	9439193	9656385	12838750	11699890	12445280	12221200	19333020	13374560	12684240	13104420	14938650	19385940	15991990	13665930	13772700	9305136	19774400	20521550	15377060	16550790	14202760	4215911	5294601	6477227	16974180	11991820	11701480	16711240	20433790	27336560	5683563
Adenine	36710050	34675700	25550630	59063720	26431780	25925470	4616970	7764539	3297381	8414910	8740183	18534020	33296920	33420400	32617290	33638600	16241430	8952271	5159805	5814984	14891930	9938695	37141900	32990510	39776380	24089490	20124710	32205140	34509360	5201639	14130960	16551640
Oxalacetic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Taurochenodesoxycholic acid	38619.96	0	32225.63	284425.9	103914.8	12861.46	21264.84	21501.98	10263.67	121502.5	17370.1	58420.89	136846.9	657717.4	35906.07	0	92193.82	1333201	35301.07	26961.9	9212.646	89375.02	92433.19	66497.92	37140.31	73779.1	69158.76	23766.11	69008.68	0	0	151075.9
Riboflavin	303484.2	49435.86	99136.93	130303.4	75925.85	81009.31	356460.9	156469.7	258629.1	142456.9	151010.6	1892748	85544.16	114585.8	126558.1	127440.4	120090.3	287700.5	362331.1	168758.3	771484.4	187875.1	13399.88	0	0	205026.7	109020.2	10591.08	42082.43	307406.9	303607.8	62672.64
Fructose 6-phosphate	1056957	1516371	1096217	815108.1	3709215	1595243	2229431	1843475	2788196	8732150	1266896	1058339	4415783	2303512	6590872	6007766	2975033	1806752	4617198	1378015	1766639	2368688	397565	876951.1	1189805	4194932	2376883	945016.8	963716.8	2431973	1827662	1191240
Malic acid	124260600	57357990	171521100	55770140	265225100	105658100	197638000	195416600	201645200	207198400	107786200	229293500	207366200	198454600	199543200	191716000	132637500	175541000	205377300	168990800	219560500	198105700	99573820	70172390	93413400	209849800	117420300	156453800	121377000	268839900	197218600	80574240
dCDP	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
dCMP	35320.97	67495.39	0	60379.59	26390.35	219649.2	0	32460.82	0	11135.23	0	0	209845.7	19935.59	54816.97	81064.44	0	0	0	0	0	0	13868.88	30711.77	31429.56	37762.18	15402.02	0	0	0	67775.83	0
ADP-glucose	0	0	0	0	0	0	0	0	0	0	0	0	15903.31	8331.861	0	7374.419	0	0	0	0	0	0	0	0	19798.38	0	0	0	16859.88	0	0	15854.46
Asymmetric dimethylarginine	3926900	4937202	5583085	6162474	6792368	7156404	6406445	7562152	8938743	6072435	4497534	8896205	6771566	6744916	6534831	7190387	3432895	6250916	6502436	5293381	5722629	4785008	5317102	6025465	8644362	7943365	6189717	12890710	11818090	7709809	8231713	5151168
Pyroglutamic acid	35574710	42588330	35416960	33624980	41043220	46135740	35424170	41321760	30087240	30926880	24914320	33313740	54873860	44367460	39905370	42691140	26822760	47944260	48814260	35575370	36952730	31507340	28837100	34533830	40664400	31064350	33465770	27559840	22288150	37120050	64163630	17318070
4-Acetamidobutanoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Cystathionine	100050.4	50977.1	53690.92	62496.4	157898.3	64186.95	665646.5	1146862	682389.6	535258.9	483874.5	1124011	146373.9	128953	71444.18	90983.66	147089	1111646	950916.7	1342459	1325981	969409.7	36062.33	44161.37	77504.25	94612.39	70582.14	423917.1	528111	771020.9	645054.9	525235.2
Homocysteine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Succinyl-CoA	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Deoxyuridine	365472.2	190362.8	269799.3	247635.9	487108.2	314070.6	234231.4	276255.4	251588.8	780700.9	228003.6	223617.4	545504.7	347930.5	343691.5	440401.3	383816.4	317700.6	339009.6	375023.9	290415	364917	146837.7	198409.5	331828.3	1188643	476402.8	182312.9	329540.8	484616.9	530254.1	270262
Purine	322719.1	28371.89	27873.93	176397.4	97800.94	24458.95	35488.77	5738.831	5205.823	6000.796	14332.59	115248.9	39336.77	487835.4	26213.31	224201	44190.37	41427.96	131907.5	33444.63	89626.4	13215.26	36111.6	28538.07	45610.44	79242.55	14675.54	25059.96	19325.49	6943.979	191608	27580.92
2-Oxo-4-methylthiobutanoic acid	9260.505	6659.216	7506.166	7136.501	21247.37	0	8559.828	7100.542	17750.73	52407.84	10893.09	9365.498	0	0	0	0	0	0	0	0	7884.875	27032.35	0	0	0	74271.07	0	14677.98	18321.21	0	26312.39	58820.91
N-Acetylasparagine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
dGDP	316700.3	544436.4	445632.9	408297.1	597596.1	1019621	137981.3	434005.7	198857.4	194306.3	176327	145108.5	3049844	858642.8	919181.4	1262592	235856.9	412192.7	306789.3	171644.2	175345.9	143625.7	287604.2	1930681	2162650	1321320	442460.3	688997.1	1355838	335385.4	360463.2	1754021
Acetylcholine	1361106	1208789	791194.8	904703.4	1755105	1096819	2503575	3298238	1487352	5425630	2277611	1290880	2765122	1164769	2173049	2146198	1795078	4111037	3976522	2701590	2014737	3018584	1859903	2827685	2110164	995772.5	1370090	3934399	4971779	3463973	3015945	8502327
Phenyllactic acid	560689.4	318330	308587.8	264203.8	328491.4	610378.8	314312.5	649737.7	349375.3	610538.3	516077.4	250853.7	1085211	487689	457427.6	498031.3	887428.8	795165.6	639632.6	647634.6	532945.7	1562912	280918.9	229024.1	224092.2	741268.1	432807.3	241864.3	514231	1453423	864792.6	269756.7
D-Ribulose 5-phosphate	4808213	5781214	9547034	3560243	19298890	6506492	6500135	14810660	10596030	20388190	6289797	3505100	15837230	20598110	16068630	14164660	7420716	14675580	18192640	16140590	6112332	9764449	1754597	1286702	1868123	19166990	8249823	3039993	4493697	18282530	18707730	2526380
Nicotinic acid	656163.3	428283.7	579631.1	429334.4	776158.4	440560.4	332497.6	395685.7	407124	422200.3	336805.1	355768.2	414380	592868.7	436202	591078.8	318455.2	473748.2	387541.5	342070.6	309176.3	364832.6	225336.4	260781.7	262359.8	637658.1	436646.6	228146.7	392867.2	432634.5	610952.8	838763.4
Coenzyme A	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Glyceric acid	38552700	79765180	43557190	33042130	73445320	84678680	66189550	153407000	90790660	60918410	56454660	55875260	158573700	58468360	110149800	85162760	52185280	90668200	116702300	85734900	58332290	82345530	4970259	4906816	9944582	84218320	84407780	8883516	5254165	153639400	178862100	4998256
N-Acetyl-glucosamine 1-phosphate	1523287	817893.1	1133338	852527.3	1149538	1055841	2151778	2939558	2770315	4491848	2172987	1826962	3465646	2186266	1405582	1530603	2903956	2942132	2751208	2965231	2594679	4714713	116659.7	84440.8	88243.42	1574915	827517.6	191210.2	338059.6	3617020	3246462	209020.3
N6,N6,N6-Trimethyl-L-lysine	11297710	10403840	10589200	10609450	16766580	14235730	12142050	22836380	17175500	23185210	21338360	18713650	26506890	19185520	24300420	25448510	25633170	28388800	23816280	21522730	27312080	24992350	7024276	8355748	14273990	24307800	12255130	27045860	25148000	17264740	29902440	13055730
Hypoxanthine	28657680	7427204	6013473	31001470	16559940	6403202	18846140	12259730	2913739	14285670	7591753	20159580	17699070	57022280	24417920	33189900	15745140	29786620	75534260	29597740	42611680	14561080	27321860	18032040	28799550	34183880	14684760	34985430	41301220	28881320	89307220	27547670
L-Asparagine	5950973	6346347	5571638	8064049	9000109	8155858	25612220	26606030	22703810	18042760	16404930	26086600	10035970	7052861	6870230	4362416	4067234	19354920	30128910	17497880	13754540	18084100	10022480	14744800	16046220	16678260	7021532	29385130	29705580	33133790	38897180	20357340
N-Acetyl-L-alanine	1509070	1821487	1681983	1731439	2673823	2285447	2602085	2706898	2867656	3464611	1799101	2938376	2510447	1979853	2055962	2005152	1067261	2700458	2707298	1966797	2182845	2230445	810328.9	694898.5	967506.6	3010370	1795983	1608984	2374229	3012043	3861110	1315115
L-Lactic acid	596635300	1089356000	812250700	611792800	1143161000	1033434000	715118500	1406425000	659674100	768388900	774574500	738745300	1398733000	1071827000	1252877000	1279724000	824736900	1072206000	1472226000	1153224000	1099017000	853066200	597423900	724750300	961560600	1133297000	1135395000	969167500	1114851000	1664313000	1818928000	571080100
L-Proline	18884330	19565650	18246200	15832160	42117680	31369110	104187500	81382100	73297650	88669120	45089550	95251300	26031770	18090870	14866750	14932400	24603810	70916380	81875580	67277520	70417060	96148600	31096310	30850290	39450980	86408880	25312060	145197100	235683700	105635100	168806800	125801000
D-Ribose	1032709	278423.3	627734.6	632255.9	684785.8	437892.4	1942873	1789811	1276412	416803.7	978133.3	3167471	566596.3	709442.3	403953.1	608984.9	1077502	1892709	2257933	2599650	3404474	1648389	40083.8	44357.68	44649.27	544645.8	628510.9	67078.66	86014.68	2070288	1440608	128314.9
Cytidine triphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Phosphoserine	0	17015.62	14722.24	6951.661	23519.08	32545.56	12291.91	19002.68	23594.55	59310.74	14912.01	0	42316.82	15192.59	9079.915	0	0	18336.65	15079.37	15266.46	5461.894	27208.2	0	0	0	38565.31	0	70170.43	46742.76	19182.14	37012.1	39760.14
L-Phenylalanine	27353970	24058470	19806410	24794110	69121830	32747150	59006010	67124130	59098940	60127680	38399690	63634860	47120060	27602850	25464230	23574950	23166510	60485170	70344180	42609610	56189780	65511220	18479450	19425450	29696890	214374000	44385430	51955210	64789520	74700900	102242100	108183300
Pantothenic acid	47660680	27996090	53754340	37761220	61292340	35549310	49362680	34942040	44865280	35775610	31218560	58333740	85738070	94642850	43872540	48376500	21634510	67253450	64605220	35382160	44046300	46669600	16779150	32603420	46344920	51180980	28687580	18983570	27513010	55043410	86973430	9196017
Ornithine	2658690	2254301	2236247	2201854	5114072	1983663	6012312	4511388	4548821	6153651	4372680	5306939	2627030	1889457	1636506	1256849	3852713	3700017	5030921	3682959	4042764	4840968	2408591	2358619	3880051	20325930	6063009	3536945	6689941	6944497	10563340	11991010
N-Acetyl-L-aspartic acid	131199300	148619400	72038540	96671300	160042000	93019770	46041200	89918350	32773200	63123140	91256980	37215020	216310300	95234170	111486100	79548080	118977600	57107040	38860820	60963880	56981190	106142200	20587210	24161860	66699500	62201440	89428580	33368280	23792740	31696020	36194830	35209870
Indolelactic acid	165784.8	94102.02	117476.4	56272.7	334287.4	141892.5	428724.1	211252.6	283532.6	673043.8	231742.3	399412.3	789822	288831.9	174990.6	202713.3	178834.4	339754.8	669040.6	258357.7	467882.3	1130494	35053.37	54787.25	66817.64	363512.9	133710.4	99224.45	462474.1	364153.3	383370.1	75455.87
Methionine sulfoxide	1334985	5405853	3089621	1065808	9711213	4209766	2757259	2982544	2484317	15006080	4874266	3177045	6965325	2353589	3417212	1650279	6285073	1360401	2542153	1459739	1720023	4683262	1117831	2305437	1983236	16790630	8053493	1144083	1833416	3876015	4053921	2761231
7-Methylguanosine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
5-Thymidylic acid	0	0	0	0	20603.33	0	0	0	0	0	0	0	82743.03	0	0	0	0	0	0	0	0	0	26247.56	50342.24	51248.14	60974.09	12225.29	17197.13	68479.12	0	0	39423.85
NAD	925360.1	4168113	581873.3	5769896	399969.7	4678490	233277.8	610257.9	333731.8	299979.2	994241.7	80063.2	8290706	932419.9	728824.6	1375919	940417.9	594049.7	495834.2	317102.2	186757.2	557474.6	7389212	10973270	9453301	646031.6	647564.9	9456875	8959349	292063	468706.4	5053730
N-Formyl-L-methionine	572953.2	609895.4	567884.9	689835.6	883385.3	1093795	491126.4	668450.6	422532.9	504055.5	437571.2	480551.6	1005673	825386.8	945624.2	1094880	399710.8	859632.3	898493.8	669599.4	759488.1	584192.9	225122.3	172307.1	287349.8	1132305	573347.4	430970.7	599835.8	1840836	1445008	322957.5
Gluconolactone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Deoxyribose 5-phosphate	53766.27	19375.89	0	0	184871.6	0	179759.8	204255.8	0	694244.8	90758.02	77168.7	257175.3	257394.7	279971.4	372392.5	278531.9	167412.5	311404.2	380955.6	310274.1	252811.1	0	0	0	381474.9	197179.5	52524.5	117139.6	183414.8	125615.2	49852.11
Pyruvic acid	1580261	1085741	1220606	1243064	1354622	1066474	1122443	1439482	1128977	1484359	1554902	1518881	1607942	1188692	1321967	1355606	1076032	1750416	1567374	1412540	1676839	1883126	1037646	1169738	1101540	2107934	966969.3	1772876	1923698	1182264	2076009	1887865
Nicotinamide riboside	2051640	827015.3	906814.9	4091831	691045	1438724	1235277	859076.2	1599302	678425.8	1668219	2045982	1527188	1169417	937275.4	1114539	918140.2	1081133	1136151	926394.2	1390519	890109.8	224538.8	126291.9	234068.2	968076.3	1228080	383501.5	316710.1	1011330	1038662	182844.1
Uridine 5'-monophosphate	118468.1	356484.9	332433.2	145891.7	414121	221385.5	35458.36	281177.5	118726.8	626824.1	134619.4	17784.65	993047	401437.4	301433.3	321851.5	300173.4	202819.6	241912.4	276374.5	92963.05	298688.8	174696.9	491372	693870.1	316409.8	184036.5	549371.1	1320964	252747	333431.4	635515
L-Cystine	0	0	9888.078	0	66017.84	24202.35	334034.4	138860.4	115551.1	110921	54850.22	527680.1	38312.47	0	45799.79	0	0	220050.7	353912.4	438299.4	122720.8	122526.9	0	0	0	198605.7	34125.7	0	0	267355.2	39320.64	0
Acetylcysteine	26910.69	14485.2	15483.55	19665.67	15310.52	18316.51	16877.76	13928.94	20301.06	11404.6	14843.29	17323.94	17590.89	24926.1	25327.07	26380.61	15563.04	39685.97	28361.2	22355.49	62380.3	25036.58	24033.15	30342.08	14245.87	32315.13	19275.32	70386.81	216002.2	221766	67126.68	208449.1
Indole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Phosphorylcholine	122015700	89771560	75056600	90391030	145900800	145027000	138552600	302637400	83576130	264952900	175721300	29488030	411628000	242930400	172089000	257961300	242580500	187617600	298481200	239143100	117212300	197373200	81928180	137057900	179787200	235750800	127509900	258778900	322865600	302327600	370763900	171043000
Citrulline	92884110	125839400	144272900	138571200	160176700	145326000	190460800	245379400	177945600	156018500	117660100	199416100	262114400	294966400	218443900	183657700	95674290	240718700	270493900	143618600	187307600	226145500	66406460	144643700	197332800	172650900	143596300	197256300	289800600	213477000	266069700	67727910
Guanosine	3836221	1823788	1743894	3883738	1622862	1723482	5924343	5232747	5878893	3306214	6031208	6132558	2272048	1791570	1864499	1538116	1640086	6746778	6320594	5212027	6526685	4237136	1793313	1120100	1466070	2824857	2048719	3221815	2806753	6317688	8576029	1746787
D-Ribulose	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Hydrocinnamic acid	790417.3	811567.9	659994.1	797821.4	699113.4	709737.5	602748.9	795546.7	629175.8	793450.2	843649.7	698478.6	1083072	846538.6	740550.9	694181.1	803083.9	799839.8	805698.2	742998.6	662208	833513.4	752154.6	459433.1	483986	817327	680370.8	615158.6	624398.8	804923.6	838555.6	557008.2
3-Hydroxymethylglutaric acid	1462909	1143046	853826.1	972141.5	1050007	1485511	1571358	1741067	1172689	1878508	1649165	1777803	1895125	830992.8	934642.8	1141071	1657368	1385494	1408079	1397547	2731243	2911141	636496.7	640059.6	799488.1	1154798	1141724	920496.3	1315083	2005525	1411243	836391.8
Arachidonic acid	170533400	87707530	128994100	84723460	220439900	141660500	109693700	97659000	51314670	158653400	100811800	84018030	312856000	196395300	196201500	149520000	113805400	323040200	52798810	168228000	38746840	304434900	6322226	8516502	9640107	136451100	12773910	7933938	49541300	45077360	193694700	105279700
NADP	0	14080.3	0	19330.9	0	25125.28	0	6350.134	0	0	0	0	36050.1	8656.235	0	14028.02	0	0	0	0	0	0	16024.23	14539.9	19949.73	12427.74	0	22487.42	22969.36	0	0	24842.18
Glucosamine	226264.2	39103.34	38865.23	65247.66	67138.86	32467.86	337570.1	33756.01	101870	228544.1	88643.66	154418.1	315726.8	56562.48	173198	89113.29	381399	50848.72	49709.59	24759.64	216627.6	302204.4	52506.64	39230.89	105331.4	217302	21213.14	255623.2	73839.37	38704.66	50296.13	52898.02
L-Aspartic acid	39914240	26965410	31043650	35092010	29910910	55751840	47935010	40445700	45465950	55809440	43026080	46551440	83349380	58525290	51701750	37866780	48458580	56215840	59445130	38172330	39832830	48732620	24168540	21951180	35265480	50921450	28287830	53890830	50550100	63043570	72062880	34184080
Uridine diphosphate-N-acetylglucosamine	587310	1657130	851361.9	973449.1	2281421	1106993	309590.2	2393872	524861.8	1264715	692994.9	101607.7	2861952	1950993	1409918	1925580	587595.5	1071323	1378337	1071588	230538.5	476151.1	688606.6	2182821	2043073	1055040	637180.1	2380286	6629746	803928.9	1462558	3180242
D-Glyceraldehyde 3-phosphate	49008.66	197708.3	106509.7	90773.86	319174.8	190110.3	8729.71	75368.01	28910.44	84081.17	28897.39	16733.62	297136.5	174752.8	211393	352283.7	56960.81	39374.76	119207.8	59029.13	0	40135.34	144197.8	539667.8	235739	225785.3	204003.8	67470.91	83647.36	74036.26	69866.58	130800.3
Inosinic acid	1719214	6441442	7579947	3612744	16165320	3741548	238558.5	4182224	1683735	5133360	1301759	145963.3	6489730	8888110	3695611	4674928	2006283	1935115	2396109	2548710	451174.1	1195881	4919601	5707146	3727119	6375358	3334395	6714962	12413240	3274021	5760294	4741731
Uric acid	17950220	14409550	19887260	8850768	14314300	14678140	24170720	29319530	34605870	9056991	23243160	22864210	23153000	17160630	20362140	18823910	18647890	23969720	21974990	23351140	16859290	24394920	1134600	471366.3	457458.5	19632850	12056290	3046980	2980469	23857890	15803060	1714188
Creatinine	69558580	111366400	81401730	74232390	120428600	106550500	54756650	86736340	62815170	72087340	76553020	60882850	131209900	110431700	124305300	137752600	68456720	103128100	96537050	72019310	66925470	61902960	56392660	69105640	64766900	97147900	93494140	59149270	82437400	111724700	135515500	35913920
Dimethylglycine	50912480	47193360	68152100	22905340	51670380	56159690	16141850	35126170	22187140	21687990	20714290	16164580	54037200	41836030	39071880	50030120	43793940	25964760	14647850	24622820	30643150	36694580	2382512	2667661	5857322	26117340	25402080	1448892	3392187	12931790	14662540	3985584
Adenosine	54671980	206775600	66305350	262760600	53272310	211847100	1891645	29658330	3252511	4592733	23165940	719138.1	164998800	68836750	68770070	63735530	67682910	7892251	10795960	8667677	2429905	20193250	310052700	217356800	207470000	77869250	132422900	201623400	207511400	8658586	30121220	125818900
3-hydroxyhexadecanoic acid	2328772	1606651	1587733	1447347	1711414	2189813	1174740	1372378	1589521	6409566	4191455	1721199	3413887	1636315	1173639	4674163	3859516	1326167	747324.9	1199518	1976832	2708640	1052258	870916.9	1313505	4408604	1347392	972135.4	2040089	1452647	2369339	2937541
Cytidine monophosphate	130672.8	775051.6	483593.9	350266.8	588082.8	397505.3	58521.1	216414.9	70133.47	391271.5	99899.85	97478.73	1128495	632867.6	475385.5	552442.2	241683.8	130320.6	164764.4	137592.3	94733.7	154514.9	191728.8	310263.2	442188.2	451674.3	328778.3	580545.6	1030886	92561.62	170924.7	477718
Propionylcarnitine	6927222	14718410	15916560	3662827	16147420	4428760	9000801	4927805	5358811	7317287	5338806	11289920	15531110	8997687	12626680	14853720	11789950	7286183	5323125	9953169	7140631	14167450	54398690	49218400	66322030	9696971	25379340	54040640	35421520	7190638	6744540	26213440
Betaine	217125900	227455600	228868700	188127800	284135800	230833500	340145300	422193200	327156700	417394700	363591100	322686600	278471800	315995600	163650100	243075300	251377500	445446800	461602200	473211200	331691800	393594000	142981700	125248900	167272300	256128900	175530200	388196100	387279400	453786900	503607800	264627600
Glucose 6-phosphate	3092799	805508	1491580	2039338	1588681	2467440	1919775	3333059	3157308	9649672	2615531	785788.8	8571168	3991177	2746797	2517629	2668258	6673670	4520288	11139600	3294683	8169959	367781.6	1550053	1222880	3821146	1685731	1168598	1138710	8102106	7110561	2178808
N-Acetylglutamic acid	295743.3	160413.3	141171.9	91073.91	205565.8	115298.2	141854.1	259602	148363.2	1065932	242667.7	209011	526808.2	173054.1	134190.7	247929.1	199130.9	264037.3	225312.4	180015.8	252506.5	425139.1	69563.05	67997.5	96171.26	196642	134850.3	123426.1	216626.6	368594.1	229653.3	91530
N6-Acetyl-L-lysine	463716.8	309707.9	320707.2	293627.3	659744.8	360548	654268.4	893829.1	548208.4	1068233	584232.7	986651.5	735013.9	408098.3	590331.4	593569.8	606883.4	844193.8	750274.7	768443.3	1104896	1053922	149891.6	308096.7	373187.2	1471223	381800.5	696449.3	1133937	1652415	1629811	1728488
Aminoadipic acid	357664.5	250395.1	280077.9	216932	442810.8	281175	1412895	2982191	1902606	1428431	1724618	1900784	513201.2	280775	340506.9	440438.5	447900.3	2888621	1673801	2074381	1994729	1691316	205553.9	218185.6	286635.5	374443.8	243876.9	1380057	887920.8	1933551	1997045	976907.9
Guanidoacetic acid	64778.66	51329.27	58119.7	62595.26	75434.25	77443.95	116937.8	122754.7	107599	104224.1	103865.4	103927.3	91234.46	97690.33	77416.63	80581.68	66603.46	130064.9	143875.6	137491.3	97853.42	114373.2	48004.26	49201.23	76965.02	63572.25	56215.89	182674.3	233656.5	273867.2	194222.4	103795.4
Fructose 1,6-bisphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Glycine	2050805	1416852	1330858	1680475	1848698	1667480	5298780	8004718	6556455	4735407	5027341	10245320	2736921	1874274	1478182	1451674	1818195	8422543	7686658	6062981	6179483	5061971	1069875	1406279	1708045	2621444	1268098	6972296	7871673	9392086	10584020	4422570
3-Indolepropionic acid	50224.19	75530.84	66705.97	33124.96	44477.88	28242.67	44320.26	163081	36508.04	104298.3	132086.9	49288.92	109337.4	33852.96	83751.23	45002.77	102295.8	221059.1	59691.03	89170.79	25365.23	91067.04	58013.25	71599.53	30458.77	155094.4	69296.74	128505.8	141413.2	135325.1	246694	131870.7
L-Serine	22197120	14223990	18945030	22718080	32976760	24333380	49572920	55049790	46239990	43642640	52136430	94367900	29538920	24399350	22157430	17247720	23418860	55654520	72176110	47632140	64812250	55343710	4231487	8155835	14158500	33803430	20460140	40752670	34501420	69108190	74954420	14838780
2-Ketobutyric acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Creatine	934401800	1151747000	1053400000	1125637000	1112361000	1161274000	879880100	1109596000	957466900	791760200	995888000	891529800	1367582000	1361229000	1214118000	1208892000	893950900	1240490000	1091217000	1016926000	947239400	880419100	1022765000	1125889000	1269854000	1196843000	1078854000	1142495000	1142614000	1270353000	1412561000	798005400
2-Hydroxycaproic acid	1106288	1271633	1093852	1128210	1278746	1532573	1048235	1560805	906829.6	1453379	1392960	1006822	2045816	1285405	1586532	1562999	1660407	1721942	1268072	1442347	1675133	1820101	1266995	819080.3	1023468	2386910	1390884	1054653	1528720	2390109	1850425	1083324
Hippuric acid	905782.6	299961.4	756603.1	1009796	912877	1267829	937023.1	1188128	757974.4	2413680	811245.3	513314.8	4032862	2306185	1148107	742554.4	526902.1	245528.5	2617264	957836.8	508399	3935088	1182252	147510.5	140117.9	339451.2	222946.8	279799.3	654418	1896179	298582.6	171553.5
Flavin Mononucleotide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
D-2-Hydroxyglutaric acid	1840461	1209216	4978848	1524670	1174517	2126803	1969333	1897920	4716539	2895379	2654627	3274237	2588391	2613714	1652100	2429307	1300595	4318855	3998375	5481121	4218073	2832065	1866199	2476308	3222537	1668718	1534223	6118214	6702747	3397793	3998285	3008643
Pyridoxine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
N-Acetylputrescine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
FAD	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
N-Acetyl-D-glucosamine	75284.76	15192.46	37718.5	41348.57	52404.59	39699.79	275838.8	106300.1	116584.4	96650.56	102230.6	351637.5	43082.24	19956.05	40667.13	64345.33	67150.12	119788.5	179850.6	149533.5	362678.8	132692.7	0	0	0	39508.14	43257.53	0	0	181436.9	110433.4	9538.139
1-Methyladenosine	47843.41	23427.88	24142.69	28176.69	42757.8	53854.06	13997.45	35083.55	23739.62	27837.24	34488.05	18728.2	60453.52	38007.39	43998.78	45635.92	43701.71	48570.98	26781.73	21481.6	24430.88	40418.86	15192.34	26304.72	34221.77	180023.9	48038.05	29887.7	69611.88	37487.7	58185.59	62856.3
Adenosine monophosphate	21975250	66308550	23207020	33109140	30589860	65766780	2597381	16650460	3986128	12016610	14135640	2101442	119431800	91266160	55486160	80261730	37041110	17242840	15632560	19050490	17844100	23006300	67794700	111658100	136577600	50854710	39379680	72582220	85485710	7685038	14201640	50555350
Uracil	9691686	9613968	12457240	9684896	16564260	12201330	15607820	24702600	16116630	20651930	11396280	13330210	13226700	16709450	10566140	12525470	5966200	24884420	22831020	18391090	14974630	14792300	7101882	4320340	7371449	40416190	12787160	13603270	23046180	22225870	37089960	19760710
L-Kynurenine	58372.46	47438.93	64316.49	64293.21	145998.3	81321.48	156574.9	141356.8	129046.4	134956.6	110057.8	239003	191976.3	103519.6	62748.59	77061.19	106434.8	158483.8	196257.8	179012	175270.7	263801.6	63061.04	86812.45	143131.4	130005.6	58071.93	194976.2	332242.5	68037.9	163018.9	97030.78
Thymidine 5'-triphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Nicotinic acid mononucleotide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
6-Phosphogluconic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Nicotinic acid adenine dinucleotide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Tryptophan	6728677	4150531	4812256	4796406	10647360	6918866	10814970	6740328	9224804	11782500	7977299	11904630	14710130	7245540	6177236	6391211	6279786	10385530	10784390	9837414	9845507	13074570	5164910	4884445	6469162	19648410	6448171	10462600	15416340	9221644	13079290	12292740
L-Valine	16834340	15318140	14694670	13770650	32434650	20353810	38155920	33430180	28806720	45803480	20837870	32560760	25970720	17729880	16426910	14622140	17750300	34065760	38328050	30439730	41650940	34235800	19529790	18436870	25082920	81506840	24061260	48909680	57311420	47011870	73282300	55897660
Phosphoenolpyruvic acid	68915.83	384209.5	145386.9	38231.77	466244.1	256810.3	97816.62	79622.07	204905.5	2517107	68150.45	42983.82	1020163	138220.9	254138.2	339419.4	200969.6	123567.7	223352.8	118431.2	123206.1	203578.8	18989.71	55646.47	38201.53	268583.8	42773.46	44418.49	113033	93267.71	105113.1	80248.43
Glucosamine 6-phosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Inosine	142443500	119652500	125714800	134462700	107114300	113542800	105632900	135390400	95979340	71074540	111783100	118683500	106576500	143055900	139908000	108051800	83098040	133665800	151421700	113080100	104308200	105717500	35579870	21429410	33284370	136583600	120137500	37526480	40725840	144436800	204695400	24031440
Niacinamide	65643370	80453380	67809710	57416790	86359470	96424140	58654850	97984230	53816000	59347170	65725490	66983690	129732100	127520500	129247800	145113200	65839500	95399620	110222400	73905170	73176260	64274990	21334940	30396970	37149680	112793100	93059380	22999630	28731190	96934850	138348800	21177910
Glutathione	80946.11	81215.66	152020.6	213114	130154.8	96587.36	60478.34	42010.3	48445.32	90508.18	41126.94	88542.75	63094.2	72454.47	82362.2	53612.66	61543.23	45058.79	54902.16	50734.63	167811.6	37251.35	2134163	4061603	1063440	74831.43	150594.5	13986070	22343230	166704.5	709915.4	21301240
Indole-3-carboxylic acid	13279.92	15924.97	32366.08	14135.46	17824.46	17158.47	15597.13	0	28274.99	17527	20401.36	38066.92	11219.06	13859.97	17787.73	19130.48	0	23447.34	0	11070.02	16703.03	26709.16	22689.23	19783.37	19435.88	26212.05	17867.39	0	18672.84	20716.71	0	21477.06
L-Carnitine	215771900	359954500	308376400	276653700	284812400	325214600	168112600	210681600	173286500	173429100	173586100	176520100	305402800	286583500	202093600	260135000	205168700	166688800	181709300	185015400	153443900	131810600	502688900	427212200	450543500	260377200	310828000	439690800	367333700	208995500	257834700	334713200
Gluconic acid	8065573	1520065	2410534	2744695	3378497	2958980	2910861	4397170	2814811	9518904	5662214	4422206	10971310	4453203	4039611	4753195	6946209	8962943	6785631	5286395	17164480	10283210	1597836	1473109	2085418	7456573	2502126	4383730	6318045	23767380	14073480	2669091
IDP	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Hypotaurine	2371531	1924943	1551436	2093662	1735023	2888080	2793732	3806453	2532769	2122409	2437065	2720108	2240114	2949163	1860022	3240330	1568389	6764003	5741690	6162414	4732937	2475262	1582085	1621072	2506386	2363532	1787149	3345894	5549058	5616613	7749831	2933678
D-Ribose 5-phosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Urocanic acid	4663680	3168603	1757726	3387886	9619009	1819526	1315352	1095350	1967382	4691822	1803917	2278812	2519834	1784199	1877105	3505253	2652957	2636411	3087920	3061857	3220289	2505494	3385009	4785156	6513499	38501210	12217920	2310978	11041590	10894500	4261981	21565470
S-Adenosylmethionine	1052622	1575019	1960141	1768668	2832592	1525822	3439604	3432490	4005918	1777954	2194004	3322613	1952564	1747538	2527003	2089349	1056058	2250769	4261652	2695814	2541780	2060498	872254.9	885362.1	948146.5	1320660	2420113	1425621	1238763	3593448	3114550	1369600
L-Tyrosine	6942045	6184642	4912060	6757682	13119580	9818776	10555430	10459860	10206410	12569240	8012663	11078100	9099696	5919524	5415986	4788116	5841874	13484030	6920295	8911851	10843080	8692417	5407725	5148668	5680823	34040390	7726586	11593840	12953370	9155260	13314780	17305290
cis-Aconitic acid	1631277	887461.1	1079444	549373.9	682704.1	1689051	898524.2	1371872	968651.8	2868242	1313530	579432	4303184	2307789	1714162	1999794	2258481	3131332	2674943	2775873	3792233	3677503	2335486	1048407	1264461	2131283	1061671	4064166	4928152	3686583	2211857	2758594
Adenosine triphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
D-Fructose	1134655	612428.4	403712.7	582658	730884.2	728449.8	1544821	1079616	725268.5	1725835	637157.1	1416749	859156.3	579015.7	1674425	1434646	2461859	2497628	2102585	1248375	3320789	1678244	235528.3	192541	374372.5	670546.3	796105.9	278036.4	441074.9	1186956	1561734	170402.5
Guanosine monophosphate	1299078	1611543	1601965	1169273	1669535	1337716	289767.1	2576001	868375.8	2329112	1612129	254648.9	2948073	2380364	1557417	1476279	1294773	2501796	3014583	2315830	1419555	2373782	940435.8	1292976	1486600	1562864	1000174	1465546	2279224	2746799	2997145	1549345
D-Glucuronic acid	35591.04	21748.29	15176.76	25673.52	55208.79	44451.78	32364.9	22534.95	36404.84	53545.46	46813.37	43942.41	39179.94	43082.99	43830.45	28645.47	47287.95	35796.98	38418.03	30886.16	53200.07	76270.63	90177.65	32601.47	26945.53	44409.67	25736.76	54439.29	64947.46	64930.96	25560.65	36553.4
Xanthine	35809490	18423570	22765620	38816610	45395720	12106580	54228540	33373190	27291290	36617640	21146500	74619470	25857030	69324300	51770700	38997730	30200680	44698510	75646080	44000620	66798910	28177900	22843850	21154500	27919370	68510920	48093550	27867270	34401830	70543200	53192250	35766310
NADPH	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Citicoline	205969.6	1138104	295726.2	876510.6	535024.1	715331.4	56092.29	323882.4	43786.02	318178.9	186020.8	0	1080369	501307	370271.7	696720.9	207961.3	106232.4	254004.8	168820.4	100454.1	120682.8	2821308	3421188	4095761	286928.1	562301.6	1961839	3171098	118884.8	255073.7	1082203
3-Hydroxybutyric acid	3391260	2975949	1531229	2130500	4923200	3747816	1830952	2998319	1677721	5343846	2004874	1975852	5979534	3299280	3949281	3723435	4337002	3334087	3451107	3019851	8049421	5329837	2045039	1271731	1971167	8383485	3120727	4004256	3641884	3581000	5144710	1589023
Galactonic acid	2886440	1230024	1108632	2119042	2256129	1821340	6824150	4494192	4235964	5666845	4478292	6027529	4601622	3110654	2136258	2133671	3560599	4827726	6171068	4650358	7631390	7746888	1286633	2021832	1818655	2227236	1501442	3227174	5420845	6295342	4112419	2641827
Xanthurenic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
2-Hydroxyvaleric acid	3053554	5040885	1428110	4384848	1599032	6108137	1062029	5405053	934284.4	1944867	4017822	1277721	4413858	2130609	5571202	5836638	5511402	4917523	2723999	4631501	5570294	3540661	3767111	1669836	1911773	7054163	4278400	2626958	5674068	4622900	8042593	2862059
Deoxyadenosine	62565.02	86954.38	57471.78	78173.64	187794.5	73520.98	13576.91	23190.58	22762.09	27084.26	32211.1	18332.38	204461.9	67050.27	106272	88228.05	43440.96	18966.47	16061.74	19511.15	26509.82	35495.85	192566.4	216331.7	211821	165345	82648.84	269098.3	385026.2	37125.02	41406.63	571738.8
Thymine	566309.2	289163.6	382433.7	449761.3	1222166	427562.6	263587.9	310556.2	323258.5	625722.4	267077.3	299320.1	398863	327146	290286.9	339748.8	247414.5	313410.8	310651	312941.7	259209	293305.6	342487.7	404993.8	476312	5371741	822932.7	355091.3	814324.3	449713.5	489576.4	2674454
Uridine	24939990	15710410	14164140	14694020	16021500	19019490	23328040	39571620	23861910	31817000	25196350	25646740	34668880	23790930	26530170	26971760	27802060	37416160	41641470	29857920	31199820	38127080	10100100	11043330	14101660	27762370	20000580	12007990	16659720	44081680	45230370	8746641
Threonic acid	22260540	24980910	24543690	14217010	30372130	35119580	32915040	56651430	46962740	49920070	37756090	32368870	59658610	22141990	34881630	26029580	37245170	48686340	36763120	38891600	38084560	46702880	3587548	4490427	3354394	28287830	22308920	14447550	18885310	62957740	62901200	4239520
L-Alanine	34956960	34993950	42953600	37227920	47808580	57835150	50993620	78672840	46089280	48782550	41878740	54355840	62723160	53280930	59179780	53567160	36866960	69701360	76799240	53109080	58190480	78137890	24821450	27098470	32782290	66480530	43298170	52169390	56724430	87048300	88163060	30499260
3-Methylthiopropionic acid	30110.45	0	0	52338.99	30997.73	37807.38	24693.59	24074.31	29819.31	31208.26	0	25555.23	35124.58	31513.84	0	19030.38	0	50386.63	47213.47	27912.21	29111.48	43532.31	0	0	0	118766.2	0	0	0	62961.76	77425.22	56545.01
Cholesterol sulfate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Choline	458184400	359818800	335394400	368287900	383358000	404749300	436552900	627018200	435121900	509058600	501202400	446897100	504554400	477136300	450657300	523154500	455740300	662090200	584163100	584446100	524129300	575206200	96472790	86307340	103425200	497181200	367636800	148213700	121233100	583156500	657883300	147395800
Uridine triphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Argininosuccinic acid	98657.7	59673.41	184577.8	132371.6	147720.6	153024.9	409669	187233.3	532101.9	401921.3	144741.7	477559.3	309193.7	230744	224783.8	213940.8	110414.1	346887.8	335333.7	265157	277952.3	274734.8	128035.4	74588.87	107666.1	118550.9	88416.71	375276.2	386383.2	308931.1	334244.3	92049.21
Uridine diphosphate glucose	95589.11	119440.3	92214.38	131397	111267.6	102331.7	21059.45	124765.3	29172.84	75427.98	46589.65	0	180108.7	135221.2	87474.9	169462.5	74211.7	93753.53	96213.43	90364.66	33922.03	50848.21	89485.06	239822.3	210675.2	125865.4	72547	254249.1	454342	84341.03	82504.13	316189
Ureidosuccinic acid	65934.2	62324.45	28068.32	65486.28	65436.89	74082.48	227434	144037.8	53609.04	169602.7	107143.4	388761.1	85089.59	95302.27	153048.7	85169.7	119154.7	125101.1	554884.1	119364	328794.8	327620	94820.01	84083.17	79943.01	115513.1	52605.78	214259.3	473828.6	168031	226243.4	204652.4
Hexanoylcarnitine	3782533	14461800	5400386	4788015	8491036	8635920	1789103	4685750	3660085	2253827	5699782	1116763	15236950	3840014	3926866	5101312	4229529	2565830	3243899	5182742	836291.2	3472151	7247793	6598247	8635829	3370628	5324845	5208478	6636772	2582336	6390071	1556893
N-Acetylaspartylglutamic acid	145099.8	198791.9	175359.5	83936.88	213867	64293.87	17307.23	125950.7	34615.41	282110.8	81031.84	113820.8	311832.8	131809.7	118346.4	178886.9	186857.4	47920.81	31068.22	52342.89	29862.34	180889.5	0	17014.94	124973.2	123091.6	187682.4	26391.56	135736	56144.32	67128.01	25784.5
Glycerol 3-phosphate	6856606	7419181	3017948	6409489	5756351	4614241	3092937	2179189	2885921	7074681	4045513	4775043	9484257	13542050	4900072	8204677	3492887	6284512	4079791	4662855	5422429	5008127	42365490	35238050	49054020	10266330	1731053	60165260	54252980	2728392	7779298	27484570
4-Pyridoxic acid	468229.6	114951.1	162816	202351.2	250971.2	208525.4	762868.3	1253449	858502.8	317846.4	1080938	3857473	426055.4	360481.8	172965.1	321943.4	378300.7	2490137	3421989	1208582	3189172	1505404	91571.16	110873.6	109128.4	160062.7	121919.6	172098.7	258081.9	2170761	2728559	154414
D-Erythrose 4-phosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Carnosine	17082620	11622580	3296376	14014020	6496564	15305890	25495110	44957430	17702400	9907983	29639540	20947300	7303109	9562539	8877388	12949380	11403080	43101160	36315990	53218340	45281510	23966810	6574894	5924903	7261032	17887720	12795470	16651540	70501540	42459740	62843360	38464690
Kynurenic acid	43897.68	19292.99	18524.14	20098.76	30928.03	26017.46	27953.86	15729.17	24919.78	49611.04	22679.64	25220.99	34916.64	32530.65	21606.25	34311.51	35080.89	28576.64	26706.82	21424.72	60519.58	46216.54	26489.84	33223.9	22618.85	59398.2	25963.2	25025.44	52396.33	170775.2	37745.69	38859.05
6-Phosphonoglucono-D-lactone	0	0	0	0	12353.46	0	11154.71	0	11697.63	40180.63	0	0	18800.14	0	14390.48	19323.02	13644.5	0	16312.8	0	0	9363.76	0	0	0	0	0	9368.396	0	0	0	15586.55
Citric acid	30909340	10566210	14872680	6213276	5368499	22489940	14087870	26431160	11761910	38252680	20755400	11198570	64573420	52919790	38912810	42262800	37350510	63672300	46071610	45585250	60706570	63797380	8928438	7158367	4576529	36513340	9071793	15643020	21228300	32304110	21421260	23841250
AICAR	5914.657	12247.71	16224.74	16617.05	16750.19	17702.43	0	52370.14	0	37197.72	25606.46	0	52228.48	40957.13	36589.17	63098.5	19394.7	42584.56	67722.17	73267.49	22366.26	62823.07	19336.23	17404.94	25163.67	26988.65	17683.11	96067.15	395689.2	32458.37	42913.41	140122.9
Glycerophosphocholine	12456190	10422890	6308158	5206834	12612010	15340530	18091280	131711200	11162940	18277740	57788640	32206170	43665250	40434990	49707250	54783090	35761860	167834300	210604600	154267000	68191260	79706990	14811170	22294770	29814380	51624020	42424780	62848000	70680860	293186800	177354400	49015600
L-Isoleucine	28149610	20006140	21641160	22546910	50346190	31168170	51822480	44014340	44354670	66373380	32652880	47292050	37241850	24288920	23240660	18547810	26923820	45999250	51798360	34334710	52306520	42006260	18312850	14220270	23472980	169947300	37005160	47680660	56707920	62117850	90123450	91615150
NADH	264478.9	635226.3	78115.57	598017.9	65007.2	182918.7	0	99426.73	43421.23	44947.12	55698.37	0	1974065	390120.7	356975.5	234458.1	49868.13	68127.3	25579.14	34327.43	0	98105.84	1753473	3754601	3244431	274623.4	89637.4	715488.7	1356935	27685.45	118112.9	631531.8
N-Acetyl-L-methionine	669916.4	819766.8	1158350	825071.8	2463081	891860.5	2393735	946614.6	2183429	3094788	605119.3	3468795	1071438	680718.5	538165.1	620196.9	428551.9	768712.3	1193267	640329	1005242	835037.1	323113.2	250652.9	386685.2	2615678	594800	943072.8	1586473	1018161	1859133	1077911
Uridine diphosphate glucuronic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Guanine	86266.3	59242.71	78758.53	84892.52	49717.72	54870.61	159336.5	147922.7	160481	69237.73	145371.9	253322.9	45510.63	58093.7	56565.71	56736.98	42875.77	219739.8	145083.9	69390.8	98315.52	111883.4	105022.2	115636.4	170813.1	164591.2	62401.65	379482.5	283747.7	295396.2	273980.4	195905.7
L-Lysine	23348600	22741000	29094580	25335240	38441280	32521260	32483480	44728280	41143390	32548460	33056140	42845640	44600940	31817190	33081550	30044460	20866770	43185750	40435540	31926230	32023770	30470570	22683790	25870450	32509420	85143980	28572490	46620340	45903790	52396570	76574220	46171990
L-Cysteine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Uridine 5'-diphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Glutamine	229044100	333776500	265986000	304992400	305794900	308888300	179097700	298728200	201635500	202454800	181177600	234106100	435511500	364046500	389635300	261536200	196729600	195642500	291425200	238520600	143986500	184450800	442176400	458415800	509345700	377010100	402061400	403829400	368236800	294272700	332824300	268969600
Acetyl-CoA	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Adenosine phosphosulfate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Histidine	51960740	85325610	81744620	67268800	99737860	97462900	106854700	98275430	88628670	79264650	73694500	109583700	84865090	80446540	88775650	75094670	64852410	71382900	100405300	72609100	101211500	93185700	57737770	55049620	75448010	108951600	76935360	76003260	102817100	114986800	109457900	59142920
Succinic acid	187811100	151205000	93825700	239809400	41103310	359150200	57171990	129066800	57507770	61889370	127562300	55569910	330717500	209891000	227466700	239130000	118861900	191612000	155242700	153815300	162473100	116298700	171921600	159089600	258680500	148936300	146832000	178081500	188638100	175747100	255666800	79898100
CDP	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
N-Acetylornithine	412117.8	506154.3	452020.8	485432.3	635772.6	645482	1214617	1431352	936456.9	925941.4	724743.8	930811.1	1294035	1122105	724503.1	646047	434984.9	1510836	1596268	972812.4	892232.9	1325026	355561.9	725657.4	829451.4	1163425	794008.6	1399520	1651229	1375639	2264024	615478.6
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	HMDB
D-Glucose	HMDB00122
Myoinositol	HMDB00211
Cyclic AMP	HMDB00058
Thiamine	HMDB00235
Thiamine monophosphate	HMDB02666
Guanosine triphosphate	HMDB01273
Nicotinamide ribotide	HMDB00229
Thymidine	HMDB00273
Indoxyl sulfate	HMDB00682
1-Methylnicotinamide	HMDB00699
N-acetyltryptophan	HMDB13713
Isovalerylcarnitine	HMDB00688
S-Adenosylhomocysteine	HMDB00939
Palmitic acid	HMDB00220
3-Phosphoglyceric acid	HMDB00807
L-Threonine	HMDB00167
ADP	HMDB01341
5'-Methylthioadenosine	HMDB01173
L-Acetylcarnitine	HMDB00201
dCTP	HMDB00998
L-Leucine	HMDB00687
Deoxyadenosine monophosphate	HMDB00905
Deoxyadenosine triphosphate	HMDB01532
GDP-glucose	HMDB03351
N-Acetylglutamine	HMDB06029
Taurine	HMDB00251
Sedoheptulose 1,7-bisphosphate	HMDB60274
Ascorbic acid	HMDB00044
Deoxyinosine	HMDB00071
Butyrylcarnitine	HMDB02013
L-Palmitoylcarnitine	HMDB00222
3-Methylhistidine	HMDB00479
Allantoin	HMDB00462
CDP-Ethanolamine	HMDB01564
Fumaric acid	HMDB00134
L-Dihydroorotic acid	HMDB03349
Phenylacetylglycine	HMDB00821
Oxoglutaric acid	HMDB00208
Guanosine diphosphate	HMDB01201
D-Sedoheptulose 7-phosphate	HMDB01068
L-Arginine	HMDB00517
Cytosine	HMDB00630
5-Methoxytryptophan	HMDB02339
L-Methionine	HMDB00696
Orotic acid	HMDB00226
Oxidized glutathione	HMDB03337
L-Glutamic acid	HMDB00148
Cholic acid	HMDB00619
4-Hydroxyproline	HMDB00725
Caprylic acid	HMDB00482
Cytidine	HMDB00089
Adenine	HMDB00034
Oxalacetic acid	HMDB00223
Taurochenodesoxycholic acid	HMDB00951
Riboflavin	HMDB00244
Fructose 6-phosphate	HMDB00124
Malic acid	HMDB00744
dCDP	HMDB01245
dCMP	HMDB01202
ADP-glucose	HMDB06557
Asymmetric dimethylarginine	HMDB01539
Pyroglutamic acid	HMDB00267
4-Acetamidobutanoic acid	HMDB03681
L-Cystathionine	HMDB00099
Homocysteine	HMDB00742
Succinyl-CoA	HMDB01022
Deoxyuridine	HMDB00012
Purine	HMDB01366
2-Oxo-4-methylthiobutanoic acid	HMDB01553
N-Acetylasparagine	HMDB06028
dGDP	HMDB00960
Acetylcholine	HMDB00895
Phenyllactic acid	HMDB00779
D-Ribulose 5-phosphate	HMDB00618
Nicotinic acid	HMDB01488
Coenzyme A	HMDB01423
L-Glyceric acid	HMDB06372
N-Acetyl-glucosamine 1-phosphate	HMDB01367
N6,N6,N6-Trimethyl-L-lysine	HMDB01325
Hypoxanthine	HMDB00157
L-Asparagine	HMDB00168
N-Acetyl-L-alanine	HMDB00766
L-Lactic acid	HMDB00190
L-Proline	HMDB00162
D-Ribose	HMDB00283
Cytidine triphosphate	HMDB00082
Phosphoserine	HMDB00272
L-Phenylalanine	HMDB00159
Pantothenic acid	HMDB00210
Ornithine	HMDB00214
N-Acetyl-L-aspartic acid	HMDB00812
Indolelactic acid	HMDB00671
Methionine sulfoxide	HMDB02005
7-Methylguanosine	HMDB01107
5-Thymidylic acid	HMDB01227
NAD	HMDB00902
N-Formyl-L-methionine	HMDB01015
Gluconolactone	HMDB00150
Deoxyribose 5-phosphate	HMDB01031
Pyruvic acid	HMDB00243
Nicotinamide riboside	HMDB00855
Uridine 5'-monophosphate	HMDB00288
L-Cystine	HMDB00192
Acetylcysteine	HMDB01890
Indole	HMDB00738
Phosphorylcholine	HMDB01565
Citrulline	HMDB00904
Guanosine	HMDB00133
D-Ribulose	HMDB00621
Hydrocinnamic acid	HMDB00764
3-Hydroxymethylglutaric acid	HMDB00355
Arachidonic acid	HMDB01043
NADP	HMDB00217
Glucosamine	HMDB01514
L-Aspartic acid	HMDB00191
Uridine diphosphate-N-acetylglucosamine	HMDB00290
D-Glyceraldehyde 3-phosphate	HMDB01112
Inosinic acid	HMDB00175
Uric acid	HMDB00289
Creatinine	HMDB00562
Dimethylglycine	HMDB00092
Adenosine	HMDB00050
3-hydroxyhexadecanoic acid	HMDB61658
Cytidine monophosphate	HMDB00095
Propionylcarnitine	HMDB00824
Betaine	HMDB00043
Glucose 6-phosphate	HMDB01401
N-Acetylglutamic acid	HMDB01138
N6-Acetyl-L-lysine	HMDB00206
Aminoadipic acid	HMDB00510
Guanidoacetic acid	HMDB00128
Fructose 1,6-bisphosphate	HMDB01058
Glycine	HMDB00123
3-Indolepropionic acid	HMDB02302
L-Serine	HMDB00187
2-Ketobutyric acid	HMDB00005
Creatine	HMDB00064
2-Hydroxycaproic acid	HMDB01624
Hippuric acid	HMDB00714
Flavin Mononucleotide	HMDB01520
D-2-Hydroxyglutaric acid	HMDB00606
Pyridoxine	HMDB00239
N-Acetylputrescine	HMDB02064
FAD	HMDB01248
N-Acetyl-D-glucosamine	HMDB00215
1-Methyladenosine	HMDB03331
Adenosine monophosphate	HMDB00045
Uracil	HMDB00300
L-Kynurenine	HMDB00684
Thymidine 5'-triphosphate	HMDB01342
Nicotinic acid mononucleotide	HMDB01132
6-Phosphogluconic acid	HMDB01316
Nicotinic acid adenine dinucleotide	HMDB01179
L-Tryptophan	HMDB00929
L-Valine	HMDB00883
Phosphoenolpyruvic acid	HMDB00263
Glucosamine 6-phosphate	HMDB01254
Inosine	HMDB00195
Niacinamide	HMDB01406
Glutathione	HMDB00125
Indole-3-carboxylic acid	HMDB03320
L-Carnitine	HMDB00062
Gluconic acid	HMDB00625
IDP	HMDB03335
Hypotaurine	HMDB00965
D-Ribose 5-phosphate	HMDB01548
Urocanic acid	HMDB00301
S-Adenosylmethionine	HMDB01185
L-Tyrosine	HMDB00158
cis-Aconitic acid	HMDB00072
Adenosine triphosphate	HMDB00538
D-Fructose	HMDB00660
Guanosine monophosphate	HMDB01397
D-Glucuronic acid	HMDB00127
Xanthine	HMDB00292
NADPH	HMDB00221
Citicoline	HMDB01413
3-Hydroxybutyric acid	HMDB00357
Galactonic acid	HMDB00565
Xanthurenic acid	HMDB00881
2-Hydroxyvaleric acid	HMDB01863
Deoxyadenosine	HMDB00101
Thymine	HMDB00262
Uridine	HMDB00296
Threonic acid	HMDB00943
L-Alanine	HMDB00161
3-Methylthiopropionic acid	HMDB01527
Cholesterol sulfate	HMDB00653
Choline	HMDB00097
Uridine triphosphate	HMDB00285
Argininosuccinic acid	HMDB00052
Uridine diphosphate glucose	HMDB00286
Ureidosuccinic acid	HMDB00828
Hexanoylcarnitine	HMDB00705
N-Acetylaspartylglutamic acid	HMDB01067
Glycerol 3-phosphate	HMDB00126
4-Pyridoxic acid	HMDB00017
D-Erythrose 4-phosphate	HMDB01321
Carnosine	HMDB00033
Kynurenic acid	HMDB00715
6-Phosphonoglucono-D-lactone	HMDB01127
Citric acid	HMDB00094
AICAR	HMDB01517
Glycerophosphocholine	HMDB00086
L-Isoleucine	HMDB00172
NADH	HMDB01487
N-Acetyl-L-methionine	HMDB11745
Uridine diphosphate glucuronic acid	HMDB00935
Guanine	HMDB00132
L-Lysine	HMDB00182
L-Cysteine	HMDB00574
Uridine 5'-diphosphate	HMDB00295
L-Glutamine	HMDB00641
Acetyl-CoA	HMDB01206
Adenosine phosphosulfate	HMDB01003
L-Histidine	HMDB00177
Succinic acid	HMDB00254
CDP	HMDB01546
N-Acetylornithine	HMDB03357
METABOLITES_END
#END