#METABOLOMICS WORKBENCH hik2004_20240229_112251 DATATRACK_ID:4680 STUDY_ID:ST003112 ANALYSIS_ID:AN005111 PROJECT_ID:PR001934
VERSION             	1
CREATED_ON             	March 7, 2024, 1:02 pm
#PROJECT
PR:PROJECT_TITLE                 	Glucose Hypometabolism Prompts RAN Translation and Exacerbates C9orf72-related
PR:PROJECT_TITLE                 	ALS/FTD Phenotypes
PR:PROJECT_SUMMARY               	The most prevalent genetic cause of both amyotrophic lateral sclerosis and
PR:PROJECT_SUMMARY               	frontotemporal dementia is a (GGGGCC)n nucleotide repeat expansion (NRE)
PR:PROJECT_SUMMARY               	occurring in the first intron of the C9orf72 gene (C9). Brain glucose
PR:PROJECT_SUMMARY               	hypometabolism is consistently observed in C9-NRE carriers, even at
PR:PROJECT_SUMMARY               	pre-symptomatic stages, although its potential role in disease pathogenesis is
PR:PROJECT_SUMMARY               	unknown. Here, we identified alterations in glucose metabolic pathways and ATP
PR:PROJECT_SUMMARY               	levels in the brains of asymptomatic C9-BAC mice. We found that, through
PR:PROJECT_SUMMARY               	activation of the GCN2 kinase, glucose hypometabolism drives the production of
PR:PROJECT_SUMMARY               	dipeptide repeat proteins (DPRs), impairs the survival of C9 patient-derived
PR:PROJECT_SUMMARY               	neurons, and triggers motor dysfunction in C9-BAC mice. We also found that one
PR:PROJECT_SUMMARY               	of the arginine-rich DPRs (PR) can directly contribute to glucose metabolism and
PR:PROJECT_SUMMARY               	metabolic stress. These findings provide a potential mechanistic link between
PR:PROJECT_SUMMARY               	energy imbalances and C9-ALS/FTD pathogenesis and suggest a feedforward loop
PR:PROJECT_SUMMARY               	model that opens several opportunities for therapeutic intervention.
PR:INSTITUTE                     	Thomas Jefferson University
PR:LAST_NAME                     	Davide
PR:FIRST_NAME                    	Trotti
PR:ADDRESS                       	900 Walnut Street, Philadelphia, PA 19107, USA
PR:EMAIL                         	davide.trotti@jefferson.edu
PR:PHONE                         	215-955-8416
#STUDY
ST:STUDY_TITLE                   	Glucose Hypometabolism Prompts RAN Translation and Exacerbates C9orf72-related
ST:STUDY_TITLE                   	ALS/FTD Phenotypes
ST:STUDY_SUMMARY                 	The most prevalent genetic cause of both amyotrophic lateral sclerosis and
ST:STUDY_SUMMARY                 	frontotemporal dementia is a (GGGGCC)n nucleotide repeat expansion (NRE)
ST:STUDY_SUMMARY                 	occurring in the first intron of the C9orf72 gene (C9). Brain glucose
ST:STUDY_SUMMARY                 	hypometabolism is consistently observed in C9-NRE carriers, even at
ST:STUDY_SUMMARY                 	pre-symptomatic stages, although its potential role in disease pathogenesis is
ST:STUDY_SUMMARY                 	unknown. Here, we identified alterations in glucose metabolic pathways and ATP
ST:STUDY_SUMMARY                 	levels in the brains of asymptomatic C9-BAC mice. We found that, through
ST:STUDY_SUMMARY                 	activation of the GCN2 kinase, glucose hypometabolism drives the production of
ST:STUDY_SUMMARY                 	dipeptide repeat proteins (DPRs), impairs the survival of C9 patient-derived
ST:STUDY_SUMMARY                 	neurons, and triggers motor dysfunction in C9-BAC mice. We also found that one
ST:STUDY_SUMMARY                 	of the arginine-rich DPRs (PR) can directly contribute to glucose metabolism and
ST:STUDY_SUMMARY                 	metabolic stress. These findings provide a potential mechanistic link between
ST:STUDY_SUMMARY                 	energy imbalances and C9-ALS/FTD pathogenesis and suggest a feedforward loop
ST:STUDY_SUMMARY                 	model that opens several opportunities for therapeutic intervention.
ST:INSTITUTE                     	Thomas Jefferson University
ST:LAST_NAME                     	Trotti
ST:FIRST_NAME                    	Davide
ST:ADDRESS                       	900 Walnut Street, Philadelphia, PA 19107, USA
ST:EMAIL                         	davide.trotti@jefferson.edu
ST:PHONE                         	215-955-8416
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Mus musculus
SU:TAXONOMY_ID                   	10090
#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           	-	C92DG_07	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C92DG_07.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C92DG_26	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C92DG_26.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C92DG_30	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C92DG_30.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C92DG_34	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C92DG_34.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C92DG_45	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C92DG_45.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C92DG_47	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C92DG_47.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C92DG_56	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C92DG_56.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C9S_11	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C9S_11.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C9S_29	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C9S_29.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C9S_33	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C9S_33.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C9S_43	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C9S_43.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C9S_50	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C9S_50.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C9S_57	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C9S_57.mzXML
SUBJECT_SAMPLE_FACTORS           	-	C9S_69	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_C9S_69.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WTS_31	Sample source:Brain | Genotype:WT | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_WTS_31.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WTS_39	Sample source:Brain | Genotype:WT | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_WTS_39.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WTS_51	Sample source:Brain | Genotype:WT | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_WTS_51.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WTS_53	Sample source:Brain | Genotype:WT | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_WTS_53.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WTS_58	Sample source:Brain | Genotype:WT | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_WTS_58.mzXML
SUBJECT_SAMPLE_FACTORS           	-	WTS_59	Sample source:Brain | Genotype:WT | Treatment:Saline	Sex=M; RAW_FILE_NAME(Raw file name)=HF1170_WTS_59.mzXML
#COLLECTION
CO:COLLECTION_SUMMARY            	Animals were euthanized by CO2 inhalation 16 hours following the final injection
CO:COLLECTION_SUMMARY            	and transcardially perfused with ice-cold PBS. Whole brains and spinal cords
CO:COLLECTION_SUMMARY            	were then excised, flash frozen in liquid N2, and stored at –80°C
CO:SAMPLE_TYPE                   	Brain cortex
#TREATMENT
TR:TREATMENT_SUMMARY             	Animals were administered i.p. injections of saline or4 g/kg 2DG twice weekly
TR:TREATMENT_SUMMARY             	for six weeks
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Metabolites from equal amounts of frontal cortex tissue were rapidly extracted
SP:SAMPLEPREP_SUMMARY            	in 80% ice-cold methanol. Extracted samples were vortexed twice, cleared by
SP:SAMPLEPREP_SUMMARY            	centrifugation at 14,000 x g for 20 minutes at 4°C, and stored at -80°C.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	HILIC
CH:INSTRUMENT_NAME               	Thermo Vanquish
CH:COLUMN_NAME                   	Merck SeQuant ZIC-pHILIC (150 x 2.1mm,5um)
CH:SOLVENT_A                     	100% acetonitrile
CH:SOLVENT_B                     	0.1% NH4OH/20 mM CH3COONH4 in water
CH:FLOW_GRADIENT                 	85% to 30% A in 20 min followed by a wash with 30% A and re-equilibration at 85%
CH:FLOW_GRADIENT                 	A
CH:FLOW_RATE                     	150 μL/min
CH:COLUMN_TEMPERATURE            	30
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Thermo Q Exactive Orbitrap
MS:INSTRUMENT_TYPE               	Orbitrap
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	UNSPECIFIED
MS:MS_COMMENTS                   	A Sequant ZIC-pHILIC column (2.1 mm i.d. × 150 mm, particle size of 5 µm,
MS:MS_COMMENTS                   	Millipore Sigma) was used for separation of metabolites. A 2.1 × 20 mm
MS:MS_COMMENTS                   	guard column with the same packing material was used for protection of the
MS:MS_COMMENTS                   	analytical column. Flow rate was set at 150 μL/min. Buffers consisted of 100%
MS:MS_COMMENTS                   	acetonitrile for mobile phase A, and 0.1% NH4OH/20 mM CH3COONH4 in water for
MS:MS_COMMENTS                   	mobile phase B. The chromatographic gradient ran from 85% to 30% A in 20 min
MS:MS_COMMENTS                   	followed by a wash with 30% A and re-equilibration at 85% A. Column temperature
MS:MS_COMMENTS                   	was 30 C.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	peak intensity
MS_METABOLITE_DATA_START
Samples	C92DG_07	C92DG_26	C92DG_30	C92DG_34	C92DG_45	C92DG_47	C92DG_56	C9S_11	C9S_29	C9S_33	C9S_43	C9S_50	C9S_57	C9S_69	WTS_31	WTS_39	WTS_51	WTS_53	WTS_58	WTS_59
Factors	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sample source:Brain | Genotype:C9orf72 | Treatment:2DG	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sample source:Brain | Genotype:C9orf72 | Treatment:Saline	Sample source:Brain | Genotype:WT | Treatment:Saline	Sample source:Brain | Genotype:WT | Treatment:Saline	Sample source:Brain | Genotype:WT | Treatment:Saline	Sample source:Brain | Genotype:WT | Treatment:Saline	Sample source:Brain | Genotype:WT | Treatment:Saline	Sample source:Brain | Genotype:WT | Treatment:Saline
1-Methyladenosine	32617.51	13589.21	17550.16	14579.14	24581.4	10393.55	23581.61	17135.79	6183.92	3205.882	22935.13	30999.28	14765.45	21999.67	20756.85	14962.61	10067.7	9564.473	13554.18	15764.18
1-Methylnicotinamide	1841007	1822386	2718988	4048276	688253.6	1131924	1370287	2228298	1856145	2501936	1516392	3333350	2220781	2493598	863027	1715365	1386362	1732681	2033457	2404083
2DG	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
2DGP	1142208	5765284	3171172	3409532	3425847	2534675	4221022	0	79711.85	84458.56	609323.9	100214.5	91255.3	98635.8	322796.1	39111.83	334947.6	127164.3	225007.6	222710.2
2-Hydroxycaproic acid	1493785	738976.2	787589.1	882673.2	878327.1	1072232	473638.9	723708.3	503513.9	413687.8	428152.3	881504	442938.1	581325.1	1030926	558206.3	988875.9	546005.7	819152.1	948766
2-Hydroxyvaleric acid	1786160	2013362	1812120	2281630	1299487	1826766	2240205	2265580	1460612	701437.8	1634673	3061003	2739082	1760775	1199602	1817412	2131307	1898601	2717337	1795729
3-Hydroxymethylglutaric acid	6871342	7208425	7909773	8807470	3802989	5161551	5561114	5613614	5979359	4723424	4886748	6777701	5942222	4827469	4337369	5899910	5544885	6513512	7142908	9241531
3-Indolepropionic acid	6480.795	4296.553	4321.637	8103.824	3463.247	7244.678	6293.21	8503.848	5235.161	2868.246	4797.81	5596.526	5175.813	3256.446	2974.045	6200.765	3855.611	7870.383	4325.25	7757.958
3-Methylhistidine	3209961	5886811	4186838	4295106	2501087	4280228	5209526	4254567	4983342	2131721	2978088	7089334	6117056	5205673	3390343	3253151	6593800	5011118	9165029	7773793
3-Phosphoglyceric acid	292058.1	374590.8	224060.3	369201	309884.6	662231.3	410955.5	465306	284887.6	107345.5	288491.3	470891.8	464510.8	166406.9	383866.4	349232.5	486476.7	405851.3	430072.2	691187.1
4-Acetamidobutanoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
4-Hydroxyproline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
4-Pyridoxic acid	250103.5	208616.3	196308	217139.4	194310.2	230841	180077.5	208649	171939.6	115284	136693.4	310870.8	190266.8	156890.7	189076.4	216055.6	221708.2	221993.8	245587.3	210657.7
4-Trimethylammoniobutanoic acid	5444141	15619190	13888740	16743310	5397229	15800820	7550785	7648567	10546330	5213951	4841650	5249534	6472307	4263275	6027153	11679830	10448560	6236550	8219130	3749197
5-Thymidylic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
6-Phosphogluconic acid	37665.94	105125.6	59622.15	49489.09	44703.85	90840.52	65541.87	73054.8	91996.31	32162.44	86015.13	191999.9	126793.3	51239.47	91083.04	87446.49	137464	111082	239210.7	151435
6-Phosphonoglucono-D-lactone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Acetylcholine	16664480	16699340	18217530	11866710	8909207	8016229	21827720	13198940	6085752	9326806	23643210	34405530	16849300	18372660	18029500	12518470	11569350	5204649	17580170	7384588
Acetyl-CoA	69137.05	209799	150238.2	149986.1	104226.3	114144.6	117235.2	174275.4	71152.3	78335.48	96200.22	165158.8	87188.09	133383.2	115940.2	87879.34	122464.9	58290.55	190318.7	138331.8
Acetylcysteine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Adenine	27935120	44859970	46465160	51481740	36494460	46710750	45328300	49999660	39221840	25887920	40462830	55998150	44472520	40011320	37906020	39527220	43529690	43388600	59184210	45573280
Adenosine	168540100	321890500	340984900	278476300	311149100	275883200	387621400	322054600	293672000	207504100	365011500	442188200	354617200	332568800	297520600	330522300	322696100	302646600	365729400	353945800
Adenosine monophosphate	54511230	92134290	82923690	75790130	43761050	73982650	51673920	68165250	79986780	37375410	56705320	64128410	96207020	62301170	82052640	56173570	92732620	82721350	114179000	102448200
Adenosine triphosphate	49775.12	182668.2	89216.31	63445.72	83843.05	131892	85207.15	120736.6	76142.33	41684.87	50219.25	189532.8	134841.4	84115.3	143835.4	144091	210267.3	182203.6	319223.8	204677.4
ADP	1817405	4802441	3836711	2716643	2385557	3704669	2225790	3694761	2502138	1243253	1643776	3282894	3025243	2159929	2756327	2377085	3926871	4002469	4643719	5066076
ADP-glucose	105359.1	161440.7	112100.2	98475.52	107801.1	91236.83	104820.4	137828.4	73026.53	49420.69	68400.2	151334.8	117863.8	98955.75	106900.5	122738.6	109196.9	125661.4	187874.2	153080
AICAR	34477.83	57372.49	84663.15	46963.79	45879.8	58621.23	54551.07	44572.39	29392.96	18123.54	34054.59	47485.44	32264.05	28425.54	31397.99	39335.2	54270.85	48482.8	60228.81	50489.8
Allantoin	565375.7	683594.3	1145795	858917.9	466425.9	553297.9	539916.8	565428.9	443150.9	341833.4	410674.1	570496.4	710328.9	572191.3	441428.6	500903.7	636140.2	494013.8	966297.1	712182.3
Aminoadipic acid	1333422	2061158	680446	876288.4	1000707	1574747	1858437	1618342	1653394	915890.9	796948.5	999969.9	1426852	852074.4	1392275	1563448	1104345	1931424	2730706	1607297
Argininosuccinic acid	445278.3	326950.9	278001.9	530821.1	359211.5	243564.7	320294.3	402811.6	290240.6	128181.9	196081.6	212328.2	329366.8	331349.1	201786.5	301376.6	286360.7	296154.1	373733.6	331982
Ascorbic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Asymmetric dimethylarginine	485243.7	403763.4	664932.1	460838.3	409630.2	490310.2	400451.7	436667.4	298772.7	356491.6	316885.3	573597.1	476287.8	559490.9	280641.8	305761.2	419943.3	285067	502147.9	358483.6
Betaine	124600800	78714900	65091200	78790600	84598240	115111900	79410280	174874800	66410020	80542990	91168310	118489500	126427600	101602400	141355100	131267500	180256600	72307980	101857100	93419690
Butyrylcarnitine	2919574	11599850	8724196	5686167	3467297	8272738	8639731	7163531	7357487	2514595	5099390	6444073	8106257	3529171	4581283	6438297	5723592	6309639	9900576	8596793
Caprylic acid	2590645	1188516	1859069	542849.2	462434.5	2630193	292375.6	315030.8	346508.8	347690.5	304270.6	487017.7	341375.1	377463.3	4108265	357196.1	768450.2	362065.8	809726.4	452968.5
Carnosine	51890060	46060430	35482770	28324700	19152130	21302780	25546420	25517640	16615730	8275956	31623960	19224870	35174940	23062430	15773720	17504920	20162290	13556650	18555800	15452020
CDP	4392.876	14865.97	13294.92	10539.19	12046.2	12481.44	10897.96	15078.53	7626.062	11909.41	8294.13	17631.75	14375.09	13481.42	7000.437	8499.733	8630.377	11332.32	0	8668.575
CDP-Ethanolamine	1696303	2318202	2276533	2150184	1302794	1498935	1837019	1896499	1544540	913887.9	1656522	2527714	2031865	1495515	1382937	1486081	1674300	1666717	2689981	2144010
Choline	194567200	186536900	244046900	221410700	176592700	138309200	169901900	165294500	110009600	82230400	147845800	200697800	145773400	160811600	107292700	119667300	125773400	98065830	127009700	106522500
cis-Aconitic acid	11479970	8383529	16950350	11688290	7720450	6054598	8916777	8549078	5174132	5493882	7686235	9983010	6409895	10496480	7695792	6740513	8438766	6407915	10382440	9101454
Citicoline	2626475	4002022	3516155	3622668	2055645	2882527	3411159	2826054	3137522	1722232	2748772	3674102	3526132	2567778	2552096	2458665	2914417	2840480	4133549	3451851
Citric acid	49022100	47000200	67168510	63781690	52005650	60554200	39874320	51583620	36639420	32419560	33786030	44366100	40946640	51776430	44074490	45185920	45649060	43432000	57577340	57531130
Citrulline	7734311	8574218	12611970	9883884	6583947	8105708	5893173	7828661	7236944	7528796	5328017	8387398	7736031	6760895	6961415	7320739	7477317	8964334	7626634	11190230
Coenzyme A	394316.9	569201.2	446472.4	353739.2	355845.5	344587.2	399836.5	664624.3	266735.2	175804.4	245874.1	539249.1	565605.8	423436.5	334571.2	498501.3	346773.3	462861.3	694939.3	618699.8
Creatine	937194400	1002323000	1010613000	1004906000	915798600	974327400	954885100	1023706000	926376400	768772900	904144500	1008031000	954354600	931229200	880642600	870336900	959443400	919164000	1077634000	986193200
Creatinine	67455200	90141680	97444750	102027600	73090760	96673890	95927520	102716800	76865770	41316830	74612340	104273600	97730390	79922410	67626130	75521940	93275880	90514340	122684800	104738500
Cyclic AMP	46314.73	75310.98	55569.27	0	22106.06	49765.4	59283.47	39763.18	22948.88	23297.32	53788.15	87658.04	49997.61	44172.65	58055.54	34109.05	52956.89	24639.76	105199.1	16066.03
Cytidine	2899345	8384580	6026204	5537725	6708398	5982405	6235124	7399248	5235774	1950710	4405060	8770025	6531578	5614516	6805553	3937312	7552627	7851989	12379660	9878709
Cytidine monophosphate	914253.5	1093515	1228489	1081305	965162.4	904176.6	904797.4	1021324	767073.1	494558.8	879471.8	1337408	1076437	1001375	828493	704217.2	1009646	820603.9	1321585	1190083
Cytidine triphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Cytosine	224749	186974	196594.7	183121.9	185123.4	196684.5	139885.1	180566.3	152467.5	92927.91	100340	157472.2	175199.9	162676.4	310075.2	118633.8	219390.8	167023.6	256673.7	251120.8
D-2-Hydroxyglutaric acid	17043290	19987270	19642020	14213260	14342030	12976620	15925440	18371200	13186380	6131028	14067790	12119330	18439540	16195010	17542320	10936670	17039930	14513540	20551220	16395990
dCDP	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
dCMP	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
dCTP	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Deoxyadenosine	190055.5	196514	202300.5	132838.2	131218.5	148497.4	154055	174333.9	157041.6	77286.55	137778.8	224413.9	155674.4	144082.1	177333.4	137363.3	221943.1	184800.8	262424.3	306090.5
Deoxyadenosine monophosphate	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
Deoxyinosine	309401.7	40875.39	44855.02	34163.36	27823.77	48809.55	21728.38	33024.22	15280.42	14438	15321.22	27700.08	25311.2	21461.96	101755.9	20847.88	38795.21	20198.83	45452.6	33821.91
Deoxyribose 5-phosphate	50271.21	17043.3	0	19375.4	17510.96	14014.82	19232.4	30126.76	0	0	0	0	0	14086.82	16031.09	0	0	17639.86	0	0
Deoxyuridine	414371.3	215602.7	260486.7	235181.1	155199.2	181655.2	201216.5	207149.8	146674.5	76767.17	164916.1	255877.8	200846.7	166193.2	221115.4	177913.8	230062.8	195965	384917.7	278225.6
D-Erythrose 4-phosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
D-Fructose	168537.1	208311.5	173537.3	270303.8	178290.7	195268.2	265910.5	304350.2	219411.3	166483.3	284712.8	315690.1	360899.1	330994.8	208585.1	288655	192737	218595.4	297386	244272
D-Glucose	809017.6	416143.3	1297140	496408.8	1068297	993185.2	357004.9	2300024	264180	941268.7	234711.4	1134486	694756.1	803165	2265172	1863226	3200818	228287.2	320310.6	285507.6
D-Glucuronic acid	115868	114006.1	261653.7	111835.4	124746.6	167524.9	0	21750.36	0	10023.1	0	27792.83	27270.62	162760	23063.3	10393.36	17993.66	0	0	0
D-Glyceraldehyde 3-phosphate	1132329	276839.7	946173.3	2409458	213660.2	181295	915442.5	694713.1	231627.1	202401.1	372143.9	589105.1	379002.1	331653.5	128459.8	393547.7	147466.3	115793.9	652699.2	129905.3
D-Ribose	162066.2	185503.2	202717.5	248691.9	158529.9	131092.9	212171.5	201865.3	163476.3	96726.07	145356.7	294542.6	183300.8	175632.3	105504.9	198625.5	191974.7	193376.1	233924.5	203320.1
D-Ribose 5-phosphate	3845533	3508578	3755267	4186040	1800028	2331378	2763693	3365642	2741401	2372031	2808329	3254133	2700924	2731315	3844753	2654656	3470107	2333951	4209237	3053307
D-Ribulose	21296.73	29232.9	35251.49	34985.93	20223.48	28175.04	31892.89	43230.76	31046.93	18167.13	23432.58	49929.21	32980.45	25577.35	25062.18	25467.69	28704.32	33036.4	45069.87	32262.86
D-Ribulose 5-phosphate	9983310	9309127	11722880	13021600	9294157	7823655	10087890	10423140	6061253	3799957	6613069	10488620	9163284	7708151	5639694	8621583	7852915	7954868	9893292	8454896
D-Sedoheptulose 7-phosphate	1501414	828169.5	1102518	1828782	1129337	544485	1274858	1226456	318181.9	612508.1	1785113	2822689	1543057	2497515	1520709	978298.7	670942.7	405060.5	2156364	389558.6
FAD	102189.3	144551.6	165672.3	134857.1	99549.41	96878.95	107716.7	218085.5	0	83312.25	104484.9	172979.3	148605.7	150528.5	76306.57	113996.6	89869.83	111517.1	223627	145465.7
Flavin Mononucleotide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
"Fructose 1,6-bisphosphate"	155361.1	236411.2	221073.3	105527.9	46438.33	127383.5	34968.27	107054.9	61160.48	25600.26	13047.19	29642.22	57041.97	80835.8	71819.14	48306.35	309386.1	97071	114753	88353.02
Fructose 6-phosphate	1088362	859310.1	851392.4	2029307	467524.9	798060	1287571	956110.5	445992	582481	661532.3	1670344	830396.3	527260.6	747671.8	1050091	837762.8	799109.3	1778449	968904.5
Fumaric acid	13746020	16855220	14245360	15722760	12419840	15574430	12813550	17097190	16338980	6713729	7674147	10328580	15286420	11998140	10017650	13439460	19023550	20468390	16553550	21272760
Galactonic acid	447460.4	893219.7	974390.8	629824.7	517326.9	786115.1	619573.9	1172833	967471.1	637510.3	665685.8	2759383	2052041	712380.9	1394806	839880.8	2066927	1183941	1569601	1367923
GDP-glucose	210916.7	389075.1	298359.2	192129.8	204770.3	221772.3	259182.2	287938.7	206346	101637.1	156009.3	319780.5	359100.3	243918.5	226686.8	229118.7	299729.6	288269.5	427111.8	331963.3
Gluconic acid	1094375	1248591	1704471	1238655	1409639	1538782	1381047	6462522	1076987	2885605	1182921	5669962	3875519	1867959	3654179	3477319	5366592	1311189	1595755	1381907
Glucosamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Glucosamine 6-phosphate	64837	70057.85	64876.51	115755.8	37816.94	57862.89	75683.91	75802.85	43714.07	38855.26	58125.31	181010.1	70400.14	46579.14	46488.7	86909.54	62953.15	68123.23	131011.5	74093.18
Glucose 6-phosphate	2583280	1169496	1492103	3836049	1033920	943994.3	1944895	1702451	1787342	744554.1	1255660	3574433	2668360	1173520	2749465	2120038	4324919	2979804	4864454	3296319
Glutathione	44303560	71951550	56992520	59523970	48092650	66478620	63211490	61914930	53938860	34386480	52989730	73240270	62691760	53211040	50563730	56021080	64442020	59198380	83107250	69924380
Glycerol 3-phosphate	2329985	10607640	1780529	1325312	15134240	5857644	15717170	6352049	899974.7	1584591	16674870	26218950	12571990	11450420	11523400	7801057	4997204	2672151	18680170	2384976
Glycerophosphocholine	105296200	135859600	54046260	138545300	53984260	102969600	124419400	91188470	91754500	62236030	105648300	138625600	116666300	60683530	72500940	115205000	88998340	94750280	134564800	128993800
Glycine	1850184	1964703	2648952	2714398	1174656	1243293	1995164	2390124	1461615	824577.3	1360471	1956449	1894737	1667969	1420890	1571717	1605781	1532566	2460352	2028803
Guanidoacetic acid	78380.08	66519.11	65415.9	90737.27	47782.85	55244.15	73066.82	83130.34	51889.96	33706.99	47060.21	64987.73	85499.27	48388.18	63584.74	60340.38	62134.46	54170.27	98608.27	70855.19
Guanine	2133286	1511389	1523961	1612803	1246543	1126437	2609790	2066191	918624.9	764306.4	1946673	2962026	1706937	1551199	910448.5	1995076	886843.3	1186669	1673317	1406821
Guanosine	3923170	2760603	2749641	3081164	2462577	2035002	4904672	3480829	1679314	1428875	3391010	5259821	2902641	2882725	1783454	3648835	1697064	2180692	3237242	2778557
Guanosine diphosphate	641930.4	1845166	963685.8	712553.5	1033503	1053250	570380.6	1024240	662715.3	327394.6	342313.8	1329576	979738.1	794196.4	1365788	894526.7	1607209	1324064	1721720	1637259
Guanosine monophosphate	8008794	9816361	10547050	8116493	5369407	8508293	5576548	8841134	6961635	4012299	4985352	7570489	8489700	7133766	7702190	5726651	9627393	9256299	11779090	11345500
Guanosine triphosphate	11966.99	81264.38	26286.63	10955.92	30252.99	26251.56	14005.19	32805.43	9456.524	13856.88	10077.01	76110.04	41580.48	35686.18	82118.7	44610.29	80544.45	32032.64	148946.3	33614.47
Hexanoylcarnitine	51098.81	191116.8	112857.5	93664.21	51386.88	157965.5	124474.9	86656.6	125677.9	35774.84	56454.81	98126.3	110370.8	45221.24	46878.87	106851.2	99316.07	105313.4	108092	152498.5
Hippuric acid	70281.66	196291.7	47883.27	89653.62	88745.25	180520.2	455636.7	82341.36	106944.4	80229.13	191563.4	57984.78	108347.8	144729.2	52293.45	73754.88	403772.7	127620.6	418282.2	475895.5
Homocysteine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Hypotaurine	128696.8	177773.1	316154.7	237558.2	110823	122337.9	156163.1	192534.4	142018.9	101316.9	101842	191642.6	139183.7	199631.6	137776.7	134642.6	213684.3	153083.4	278395.1	125328.2
Hypoxanthine	80953460	63032670	65572690	80249840	41970340	40762130	73822260	82227720	54265100	41464640	57533640	93442050	67767410	76754060	50323160	65613820	68613830	69170820	85343760	69802190
IDP	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Imidazoleacetic acid	322790.4	488150.9	435445.8	433502.4	526317.3	515898.2	350666.7	346111.2	233266.9	184841.9	352266.2	424857	322856.4	351807.5	393294	296043.2	496436	313252.5	366833.7	347860.9
Indole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Indolelactic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Indoxyl sulfate	49903.13	90000.05	186813.5	89059.67	51102.13	84213.67	240678.3	109456.6	52059.55	26039.85	66949.6	58720.43	214356.6	61211.11	33813.49	84839.92	190790	80466.82	284889.5	253555.3
Inosine	51926590	32573520	28827670	39130770	18729300	17841660	44331720	39143170	16659290	17308680	31714710	43696980	30468120	33482780	13732900	29640630	18084100	21618520	34239530	16539910
Inosinic acid	6442036	4206840	5135833	5027236	2950067	4206537	2081276	4465141	2174445	2038640	2492953	3176375	3604515	4002407	3623274	2433823	3652046	3422171	5278581	5435789
Isovalerylcarnitine	1175178	1776714	2339036	1422819	1002926	1368923	1578293	1213975	1149610	448120.6	1016753	948055.4	1487308	1031235	897180.6	928177.3	1389360	927002.1	1563436	1285492
Kynurenic acid	18814.78	12424.22	43032.83	21400.71	16709.54	17112.23	14618.54	17171.12	9520.358	14013.28	10015.42	27114.28	12891.64	20105.34	14898.22	13193.22	19409.35	12364.38	18995.98	22682.42
L-Acetylcarnitine	223752300	305532200	299062100	326699700	221555200	268980500	267627100	279330100	223662800	127092000	224745800	305195800	264487000	216588500	203898500	204171300	235040600	221235200	298566300	271639800
L-Alanine	11061750	16966330	13675840	15114250	11746740	14243910	13587800	13483010	13183610	7287567	10838100	16842250	13880170	11267570	10634190	11643080	14603140	13228570	17872060	15824590
L-Arginine	60952800	41078080	57092450	68563840	46327820	49642480	53922810	46001090	42140320	35017570	54481770	47743960	45018680	44403560	35053960	40737700	44158000	37926800	46045280	38005620
L-Asparagine	5311838	6031795	5376091	6011268	4022689	4755053	5834956	4837146	4503042	3116013	5296307	6938502	5809873	4584518	3741692	4785556	4947245	4907937	6544568	5586495
L-Aspartic acid	67631340	63059100	76054930	75227370	44778140	54452140	65935670	67587110	61702150	36020120	57949100	73255450	75534760	55216090	51479960	46977050	68337470	51347190	80601200	54889800
L-Carnitine	287342600	252384500	262622200	272320600	183802300	260920400	266941200	270173200	259107100	188137900	216737200	219303500	268324600	203552900	216191200	265131700	282699600	239963100	334227500	276258800
L-Cystathionine	2530691	2176042	2759430	2303426	775111.2	898812.5	1409285	1910605	1662906	613525.9	1095900	1357473	1785825	2211419	1355729	1565022	1566852	946971.5	1753748	1203556
L-Cysteine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Cystine	790208.1	200093.9	470885.6	451805.6	355658.9	85819.11	247209.5	293841.2	219377.6	196284.9	318994	301786.1	194275	391119.8	225643.2	242786.1	173986.3	168386.1	163421.9	164828.8
L-Dihydroorotic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Glutamic acid	633961300	823990500	799910900	715489200	615326000	712213900	675275500	693608800	597536200	427951000	696221500	795674400	715841900	633964000	630226000	583575200	725434300	713268400	882695700	838171500
L-Glutamine	371835000	378117900	799004700	456977300	300931700	342085200	342827600	437639700	345980500	271083100	381957000	518433700	367958600	343025600	300872400	370189700	392741100	402417800	434527100	458188000
L-Glyceric acid	1525798	1777895	1438799	1392200	1745375	2029309	1262524	2480585	1077081	899837.2	988692.3	2619148	1579111	1386908	1892899	1073534	2344812	1215965	2261212	1649557
L-Histidine	9863065	13910420	23763260	13919800	10880220	11531200	11961440	12774280	11578650	9655231	12551430	18841430	12153920	12427420	8859861	12529460	13017520	14577520	16521900	13814120
L-Homoserine	8841247	10697260	8361735	10881800	8353248	9082341	8534157	10170900	8598656	4581970	8177904	13420010	8793974	7775662	7107757	10009540	8597787	8781035	12351590	9202037
L-Isoleucine	15704390	15443250	12824050	7781258	6255645	6323780	16226090	21544340	15298970	8249297	16285980	23892910	21170230	17063330	8926018	10960180	10289510	16949830	21025510	10461870
L-Kynurenine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Lactic acid	408441900	562605700	507697800	529864200	301691100	431169500	486700500	469210700	381730700	203829300	362226200	579547500	453768100	375043500	272390400	376383800	416689800	398983300	605751900	486514100
L-Leucine	31879560	25049840	31098990	32730910	22420200	25015860	27054940	28865480	21703820	12861360	26395550	39435930	27856080	26258070	18854400	23861910	27583180	24714040	34732990	27071080
L-Lysine	18005640	16495280	21065420	20630280	11248280	18088840	15643520	19811790	11176400	11307640	12485230	19465950	17118700	15283100	10366950	11271430	15077440	11585040	19202520	9652380
L-Methionine	16677530	16002680	20838740	18584470	12642300	17423280	17236930	13813260	10110120	6879002	12061350	24272830	13079420	12927130	9460422	13144100	14212540	16127980	22840950	17325000
L-Palmitoylcarnitine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
L-Phenylalanine	24512610	22132700	50254290	27666190	19552380	22528160	22419730	21089980	16216740	8848197	19783540	33813440	19785170	17792990	12670250	20518570	19812310	18989360	28078310	19515290
L-Pipecolic acid	2190842	3143792	1449384	2579772	1957426	2366840	2991240	3754665	2471055	1130348	2557300	3651658	3766037	2731709	2396979	3507601	3141445	3217154	6256764	3724515
L-Proline	41742000	55813790	59552120	55554650	70613120	71733350	59704520	72420300	62680780	33627910	68448370	92198140	83356780	65626690	55362130	72988000	86066260	78293950	117142700	110655400
L-Serine	13681420	15782390	14424290	11834700	11400310	15525170	11408480	12664950	9455817	5331340	9739147	11848650	12266980	9499530	8435030	7707104	9684998	10274480	14902560	12268750
L-Threonine	19760990	22792150	20090750	22885870	19023770	21319130	22718250	24255210	19522860	12357860	22358680	28491010	23328070	21412490	18244940	21128770	19441710	23171320	29373460	22878320
L-Tryptophan	3301460	3443507	6113157	2780317	2442774	2380666	3123201	3029517	2552595	1137273	2769691	4017808	2731932	2450956	1749159	2763368	2407655	2702943	4591717	2412423
L-Tyrosine	7574890	8423679	14302380	7752869	5884213	6387013	6773230	6419532	5117745	4317810	5325491	8860095	7864375	5267111	4094786	5374303	8536057	6971084	10648140	7489235
L-Valine	15017350	17697490	20078830	16445610	15170660	15897510	17712950	20951670	16728660	8240321	14389960	21127630	19399120	15412440	13573400	16441060	20414400	16775040	25312870	19077750
Malic acid	143464500	180116900	152286200	158547600	134504400	152005800	164259600	174518000	137734100	81417070	113611500	143203500	160815200	142521900	127436400	137724300	167175200	175338600	202803300	195965700
Myoinositol	35069500	31330620	21530110	46028120	18763590	27650080	30968670	36179230	26165240	19121670	24428230	49821420	35540100	24555280	19114150	31444560	27852570	33965550	46250610	38034380
"N6,N6,N6-Trimethyl-L-lysine"	13267450	19272360	18794700	16628710	12354180	15950250	17800120	15537770	15985310	9287243	16041670	20656020	18861260	14097580	13505490	12489180	18583320	18154530	23915750	20529140
N6-Acetyl-L-lysine	802398.4	757403.1	1337626	925811.2	489972.4	637644.4	435093.8	605667.8	397568.7	384243.2	400402.3	421569.7	390184	529707.9	389029.8	394465.3	443680	450935.8	652596.1	401099.3
N-Acetylasparagine	243675.2	296148.1	497539	255955	170591.6	191549.6	256560.1	350193.6	299141.3	259896.6	277642.6	425583.1	326910.9	258921.4	247598	312810.1	514532.1	371633.3	449031.2	349619.5
N-Acetylaspartylglutamic acid	33696410	10593290	16818250	33750200	5781237	7296853	15405460	20797010	8866670	8480155	11823010	25893420	9687841	7471618	5236991	22366750	7358981	13043960	18453600	15984140
N-Acetyl-D-glucosamine	56471.5	94119.09	76871.17	86640.99	74635.19	70964.42	80904.05	73941.56	42293.27	22211.01	47736.42	88783.3	70053.09	62115.49	44251.86	50167.84	68739.88	61922.51	104127.2	77136.43
N-Acetyl-glucosamine 1-phosphate	516350.4	761907.8	595999.2	684167.4	343999.3	524871	521121.1	503943.4	367745.5	234294.1	361931.6	588946	516007.2	412571	377689.2	461839.6	519401.3	466196.8	727423.4	717656.9
N-Acetylglutamic acid	2790654	3664528	2540994	2888729	2766183	2652168	2422085	2088119	2183851	1294638	2254548	2526431	3144633	2632318	2422300	1692548	3297972	2829241	2637912	2569407
N-Acetylglutamine	379445.8	563299.8	2808336	597330.5	360159.3	582153.5	294605.8	389846.9	383797.6	301851.6	352536.4	466588	336804.1	248487	335054.2	477953.4	587022.9	650553.1	643535.9	754451.5
N-Acetyl-L-alanine	1054372	803316.9	899183.4	943670.9	785811.3	787050.1	794766.7	899075.6	538166.1	376891.6	707124.1	873670.8	749403.2	792859.7	616229.4	617849.6	709688.8	626381.9	851823.2	682447.6
N-Acetyl-L-aspartic acid	738130700	868679500	926172200	805504800	731375400	811271800	769795200	812140200	709367100	443845600	745017900	800556600	862640600	777263000	754217600	631955600	901039700	766677100	903628900	851806100
N-Acetyl-L-methionine	2248516	2879769	3198783	3707920	2398666	2301962	4288948	2905224	2289175	1474608	3938390	6458889	2734494	3014378	1742773	2051489	2415806	2015788	4390659	2270344
N-Acetylornithine	219253.4	229325.2	339266.9	297421.1	166655.5	229176.8	284000.7	233656.8	211767.3	116398.3	195204.4	286535.3	256691	172205.3	158917.7	241395.4	210247.1	270748.5	496099	299518.2
N-Acetylputrescine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
N-acetyltryptophan	3054.867	3290.053	17716.66	0	5285.003	3255.186	7139.67	4774.081	0	0	0	0	0	2909.269	0	5772.718	3032.148	2658.915	6224.671	0
NAD	1369698	4509373	1118843	827282.4	2192656	5311659	1709182	2496328	1999858	1052456	1380078	2397223	2390186	1622408	2796875	2018917	3360023	3549303	3575676	5244529
NADH	0	117003.8	0	0	77432.78	68789.53	65168.54	54204.96	38572.79	0	37423.25	86862.87	49557.75	35572.4	110187.8	49958.05	0	78319.98	91150.63	0
NADP	23982.45	91944.42	31290.25	26925.61	64947.97	78629.15	27877.35	57509.48	45034.57	24401.31	17739.16	56060.04	55604.17	32112.31	68678.56	59220.85	80157.02	96362.03	79647.97	189207.9
NADPH	11083.39	87893.87	12555.17	11636.43	62194.02	23756.7	22129.84	36020.77	11304.4	12739.42	24255.09	109335.8	29615.73	29611.46	82808.89	48099.71	23480.29	33621.27	90901.76	47959.06
N-Formyl-L-methionine	189483.6	201159.4	216447.8	213900	116061	170881.6	195548.1	186933.6	134987.2	68911.7	141099.9	214170.2	237194.2	140019.9	121843.9	135577.4	225774.1	161275.4	348301.2	261560.9
Niacinamide	47730920	67396380	71865100	84131460	43304920	50704860	63550840	71184340	59954350	28039840	69898460	70870730	71093530	164254000	49174210	54450230	78124830	62620630	77792360	52409580
Nicotinamide riboside	458359.8	650650.1	845292.1	681207.9	406153.4	694349.4	539641.9	660672.5	388646.5	247156.8	457457.7	763094.9	709937.4	514769.5	377555	482476.8	722989.4	486660.8	791480.4	523874.5
Nicotinamide ribotide	73803.18	128105.3	88953.16	41742.98	61912.28	137430.4	60049.41	128763.1	58326.9	43066.67	48373.48	90737.33	62821.63	75376.7	96312.86	61714.83	95364.07	120660.1	137672.5	120795.3
Nicotinic acid	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
Nicotinic acid mononucleotide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
O-Phosphoethanolamine	34583420	41606410	51640980	42814400	24130770	28185190	43489040	44534020	32386690	19993220	33089500	60892460	39927860	32280520	27380470	43818830	35981640	45220730	68796610	55208720
Ornithine	1115661	746817.1	689837.8	634498.5	573852.9	979402.8	604766.7	2638387	679665.1	2788254	604400	1938466	1396479	1233400	1012279	529145.3	896002.1	540665.1	623919.6	593846.6
Orotic acid	1072474	1026167	1400656	1061230	803392.4	978166.3	1262507	1068027	947612.8	706013.4	1197252	1721035	1401430	1266306	852864.3	1482920	1078149	1855580	2213224	2016359
Oxalacetic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Oxidized glutathione	2286884	869041.5	2532189	2158686	821579.8	1201059	1100567	3439267	980214.4	992176.9	829124.3	2323868	2161828	879694	1167921	1131422	1668332	887246.8	1019391	1260376
Oxoglutaric acid	1436339	2209206	1262868	1042594	2028945	2805993	1073823	2615460	1834599	818149.9	572964.6	1256095	1658734	1215218	1825049	2080370	2342525	3730929	2220145	7875080
Palmitic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Pantothenic acid	9742097	10158860	50389800	35217430	31236010	44841650	11213490	9634926	5368834	4781215	8452639	15633650	8285362	8412372	6605738	13204780	8864319	9403924	13145400	12275310
Phosphocreatine	130563.2	226746.1	155205	143747.6	178251	96417.86	176112.3	145007.6	58306.01	84452.7	194792.3	297149.4	131195.7	222614.4	154411.6	117335.8	82585.7	65640.91	251723.2	61724.82
Phosphoenolpyruvic acid	320717.1	597137.6	425798.4	393280.5	500054.2	1060439	644419.4	695560.8	412468.8	161489.4	387773.2	647034.8	591257.6	277478	658967.5	603581.8	764059.4	701675.1	606080.1	1075375
Phosphorylcholine	261290200	321237200	407390500	408901900	185232200	209723400	333330400	352354700	314056600	165411700	353417100	546516400	426173000	324002600	268116700	371119600	367021000	354247100	570314600	478605100
Phosphoserine	19801.27	23503.84	19205.15	16270.64	16239.47	22020.54	13231.2	25616.33	13975.09	7438.31	12831.92	27010.67	26234.09	22776.25	18396.73	14372.65	18807.05	23906.71	25273.49	24230.26
Propionylcarnitine	6870610	21143190	10193630	11520770	7830933	20386910	14522420	11604010	12918870	3725375	8323777	12179920	14125970	6736278	8764532	10479900	13048820	11844050	17191330	18370660
Purine	17104.43	14693.09	34397.25	20777.97	22691.16	17710.01	16394.84	29811.07	12969.98	7300.414	10739.4	30882.54	21052.65	20450.16	11961.97	14741.38	18719.35	18242.73	26462.59	10594.26
Pyridoxine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Pyroglutamic acid	25580490	15673580	35545680	27857160	24209470	12414630	20547800	27663110	17718190	14997580	21323790	29970740	20527230	26123710	16867620	24069400	18700290	23634070	21318250	29315230
Pyruvic acid	600886.8	1063060	871093.1	988358.7	742737.5	1355389	575778.3	1090106	896058.1	321214.8	339060.8	597761.9	803725.7	464062	506114.1	780043.5	989077.7	1264858	899599.5	2221291
Riboflavin	51992.76	81701.14	72926.13	80964.95	61604.61	75046.73	76272.41	79441.77	33082.65	36911.83	44179.35	85507.58	58276.13	55447.13	46747.41	65850.03	57561.45	69835.52	103885.6	73890.43
S-Adenosylhomocysteine	451196	975005.5	1232981	754040.8	549982.3	710111.9	1143912	1030708	901709.8	408688.7	980269.1	1369449	1140288	775913.5	685980.3	879715.9	780082	1058108	1419034	1262554
S-Adenosylmethionine	4211545	6928645	6107769	5822494	3421369	5789095	4820955	5270360	5682997	3259800	4081003	6575136	5247334	4693611	3953481	3201540	5663035	4873456	7876152	5029666
"Sedoheptulose 1,7-bisphosphate"	18232.03	15227.63	16244.14	19279.63	9771.29	5017.36	11569.24	20366.28	8391.147	7267.867	2730.033	13173.29	15736.46	10350.36	13234.25	15969.28	13148.63	11407.56	20763.2	7048.962
Succinic acid	6536205	32059930	5358759	3982500	25727680	35960550	42979020	12596970	9431439	5946354	39187460	36262210	39185740	20918500	24234160	13934590	23174040	12379370	52574580	8561186
Succinyl-CoA	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Taurine	257646500	300469800	294694500	287060100	233840500	265131800	266772100	284904300	226764000	158184000	245738800	308124900	264606700	248019700	201475300	237899000	244715500	251017900	307953500	293679100
Thiamine	555458.1	633883.3	689595.7	713190.6	468145	610775.8	630128.4	676949.7	593074.9	665149.3	533734.6	872932.3	704764.1	414613.8	468522.1	734239.1	622322.1	595670.6	677078.1	701163.1
Thiamine monophosphate	552171.3	393900.6	635490	511967.9	309155.8	250470.4	438445.4	556107.6	281394.4	201726.8	331459	681592.3	447230.2	467494.9	331219.5	333265.3	296319.1	284751.1	433023.5	384319.8
Thymidine	451125	169884	209451.2	200881.5	129120.2	171828.8	169962.1	151786.7	120071.6	71736.39	146101	217512	175052.2	143387.9	229248.4	126370.8	174568.6	156200.6	296964.8	201452
Thymidine 5'-triphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Thymine	206400.2	123709.5	178128	125270.9	134075.3	134358	107028.8	96813.41	90143.8	77795.95	93761.04	109839.5	106640.4	118745.5	127364.3	94485.63	109571.2	99140.76	159311.7	115273
Uracil	7221977	8411903	10777200	8325459	6802201	8628315	7290023	8461105	4283436	2344903	5386061	7161692	7170190	7551441	5274354	5313991	7576473	6423762	8626486	6238379
Ureidopropionic acid	372032.4	480728.1	568795.9	531142.6	326860.6	576446.6	578892.2	593359.1	454706.8	295347.5	451101.8	515821.9	555099	484679.4	412756.3	348811.7	822174.7	393767.6	556771.2	475841.8
Ureidosuccinic acid	42474.57	29083.2	31157.15	22182.36	42783.93	35196.54	42665.52	36307.88	28594.16	26169.22	35250.16	20895.72	22462.53	42595.35	53646.84	37983.51	35311.34	30802.81	40004.77	45841.91
Uric acid	730991.8	848860	959660.7	602598.2	904906.9	841326.6	959549.1	888266.1	779329.1	376973.2	765957.8	934298	948053.8	973505	690608.9	992319.3	1165710	1107601	1034296	1179128
Uridine	12806720	16459820	15942950	18318150	12489990	14936020	16522740	15618280	12036130	7521207	14311530	24345140	14234970	11511110	10013030	14070540	12305400	14956400	18312390	17975640
Uridine 5'-diphosphate	57800.62	309733.7	189194.3	122785.6	163959.3	185318.4	150790.8	103955.3	54980.82	75008.16	48653.38	97145.45	62991.84	61848.63	69210.9	55200.99	81485.04	67476.59	90967.8	126647.6
Uridine 5'-monophosphate	1012241	1180716	1314331	1084512	646475.8	901522.6	755330.7	847984.2	699722.8	471086.2	663599.9	874986.6	812753.1	789314.9	810360.9	411547.3	827632.8	627715.1	1220161	1073610
Uridine diphosphate glucose	2305996	3181351	2756518	2346946	1841245	2386200	2079926	2911037	2107140	1418393	2018407	3011908	2988363	2538142	2133926	2445448	2927835	2960177	3536601	3750333
Uridine diphosphate glucuronic acid	49409.69	92854.95	70457.35	43615	80161.14	50830.5	56841.32	87277.88	40941.11	30839.6	31585.4	102709.4	76136.31	65511.14	62295.57	82326.88	75998.88	86403.59	137258.6	115317.9
Uridine diphosphate-N-acetylglucosamine	3172531	5243224	4908799	4839442	3551161	4350577	3969053	4446973	2811612	1422605	3156442	4863465	4038016	3337911	2965894	3162275	3816610	3499021	4983804	4973699
Uridine triphosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Urocanic acid	4208012	9612720	3187627	4703235	5037978	7149872	3503296	9472205	6870394	2566389	1542540	1327303	3366070	4724532	2220461	2412403	5197422	4662602	2584740	14617630
Xanthine	16080750	21455630	19575320	18990410	22345790	14092060	26317140	27241800	19207730	14684210	26746910	33110140	26870570	25432930	18690210	23671290	20536710	20792210	20616430	20097830
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	HMDB
1-Methyladenosine	HMDB0003331
1-Methylnicotinamide	HMDB0000699
2DG
2DGP
2-Hydroxycaproic acid	HMDB0001624
2-Hydroxyvaleric acid	HMDB0001863
3-Hydroxymethylglutaric acid	HMDB0000355
3-Indolepropionic acid	HMDB0002302
3-Methylhistidine	HMDB0000479
3-Phosphoglyceric acid	HMDB0000807
4-Acetamidobutanoic acid	HMDB0003681
4-Hydroxyproline	HMDB0000725
4-Pyridoxic acid	HMDB0000017
4-Trimethylammoniobutanoic acid	HMDB0001161
5-Thymidylic acid	HMDB0001227
6-Phosphogluconic acid	HMDB0001316
6-Phosphonoglucono-D-lactone	HMDB0001127
Acetylcholine	HMDB0000895
Acetyl-CoA	HMDB0001206
Acetylcysteine	HMDB0001890
Adenine	HMDB0000034
Adenosine	HMDB0000050
Adenosine monophosphate	HMDB0000045
Adenosine triphosphate	HMDB0000538
ADP	HMDB0001341
ADP-glucose	HMDB0006557
AICAR	HMDB0001517
Allantoin	HMDB0000462
Aminoadipic acid	HMDB0000510
Argininosuccinic acid	HMDB0000052
Ascorbic acid	HMDB0000044
Asymmetric dimethylarginine	HMDB0001539
Betaine	HMDB0000043
Butyrylcarnitine	HMDB0002013
Caprylic acid	HMDB0000482
Carnosine	HMDB0000033
CDP	HMDB0001546
CDP-Ethanolamine	HMDB0001564
Choline	HMDB0000097
cis-Aconitic acid	HMDB0000072
Citicoline	HMDB0001413
Citric acid	HMDB0000094
Citrulline	HMDB0000904
Coenzyme A	HMDB0001423
Creatine	HMDB0000064
Creatinine	HMDB0000562
Cyclic AMP	HMDB0000058
Cytidine	HMDB0000089
Cytidine monophosphate	HMDB0000095
Cytidine triphosphate	HMDB0000082
Cytosine	HMDB0000630
D-2-Hydroxyglutaric acid	HMDB0000606
dCDP	HMDB0001245
dCMP	HMDB0001202
dCTP	HMDB0000998
Deoxyadenosine	HMDB0000101
Deoxyadenosine monophosphate	HMDB0000905
Deoxyadenosine triphosphate	HMDB0001532
Deoxyinosine	HMDB0000071
Deoxyribose 5-phosphate	HMDB0001031
Deoxyuridine	HMDB0000012
D-Erythrose 4-phosphate	HMDB0001321
D-Fructose	HMDB0000660
D-Glucose	HMDB0000122
D-Glucuronic acid	HMDB0000127
D-Glyceraldehyde 3-phosphate	HMDB0001112
D-Ribose	HMDB0000283
D-Ribose 5-phosphate	HMDB0001548
D-Ribulose	HMDB0000621
D-Ribulose 5-phosphate	HMDB0000618
D-Sedoheptulose 7-phosphate	HMDB0001068
FAD	HMDB0001248
Flavin Mononucleotide	HMDB0001520
"Fructose 1,6-bisphosphate"	HMDB0001058
Fructose 6-phosphate	HMDB0000124
Fumaric acid	HMDB0000134
Galactonic acid	HMDB0000565
GDP-glucose	HMDB0003351
Gluconic acid	HMDB0000625
Glucosamine	HMDB0001514
Glucosamine 6-phosphate	HMDB0001254
Glucose 6-phosphate	HMDB0001401
Glutathione	HMDB0000125
Glycerol 3-phosphate	HMDB0000126
Glycerophosphocholine	HMDB0000086
Glycine	HMDB0000123
Guanidoacetic acid	HMDB0000128
Guanine	HMDB0000132
Guanosine	HMDB0000133
Guanosine diphosphate	HMDB0001201
Guanosine monophosphate	HMDB0001397
Guanosine triphosphate	HMDB0001273
Hexanoylcarnitine	HMDB0000705
Hippuric acid	HMDB0000714
Homocysteine	HMDB0000742
Hypotaurine	HMDB0000965
Hypoxanthine	HMDB0000157
IDP	HMDB0003335
Imidazoleacetic acid	HMDB0002024
Indole	HMDB0000738
Indolelactic acid	HMDB0000671
Indoxyl sulfate	HMDB0000682
Inosine	HMDB0000195
Inosinic acid	HMDB0000175
Isovalerylcarnitine	HMDB0000688
Kynurenic acid	HMDB0000715
L-Acetylcarnitine	HMDB0000201
L-Alanine	HMDB0000161
L-Arginine	HMDB0000517
L-Asparagine	HMDB0000168
L-Aspartic acid	HMDB0000191
L-Carnitine	HMDB0000062
L-Cystathionine	HMDB0000099
L-Cysteine	HMDB0000574
L-Cystine	HMDB0000192
L-Dihydroorotic acid	HMDB0003349
L-Glutamic acid	HMDB0000148
L-Glutamine	HMDB0000641
L-Glyceric acid	HMDB0006372
L-Histidine	HMDB0000177
L-Homoserine	HMDB0000719
L-Isoleucine	HMDB0000172
L-Kynurenine	HMDB0000684
L-Lactic acid	HMDB0000190
L-Leucine	HMDB0000687
L-Lysine	HMDB0000182
L-Methionine	HMDB0000696
L-Palmitoylcarnitine	HMDB0000222
L-Phenylalanine	HMDB0000159
L-Pipecolic acid	HMDB0000716
L-Proline	HMDB0000162
L-Serine	HMDB0000187
L-Threonine	HMDB0000167
L-Tryptophan	HMDB0000929
L-Tyrosine	HMDB0000158
L-Valine	HMDB0000883
Malic acid	HMDB0000744
Myoinositol	HMDB0000211
"N6,N6,N6-Trimethyl-L-lysine"	HMDB0001325
N6-Acetyl-L-lysine	HMDB0000206
N-Acetylasparagine	HMDB0006028
N-Acetylaspartylglutamic acid	HMDB0001067
N-Acetyl-D-glucosamine	HMDB0000215
N-Acetyl-glucosamine 1-phosphate	HMDB0001367
N-Acetylglutamic acid	HMDB0001138
N-Acetylglutamine	HMDB0006029
N-Acetyl-L-alanine	HMDB0000766
N-Acetyl-L-aspartic acid	HMDB0000812
N-Acetyl-L-methionine	HMDB0011745
N-Acetylornithine	HMDB0003357
N-Acetylputrescine	HMDB0002064
N-acetyltryptophan	HMDB0013713
NAD	HMDB0000902
NADH	HMDB0001487
NADP	HMDB0000217
NADPH	HMDB0000221
N-Formyl-L-methionine	HMDB0001015
Niacinamide	HMDB0001406
Nicotinamide riboside	HMDB0000855
Nicotinamide ribotide	HMDB0000229
Nicotinic acid	HMDB0001488
Nicotinic acid adenine dinucleotide	HMDB0001179
Nicotinic acid mononucleotide	HMDB0001132
O-Phosphoethanolamine	HMDB0000224
Ornithine	HMDB0000214
Orotic acid	HMDB0000226
Oxalacetic acid	HMDB0000223
Oxidized glutathione	HMDB0003337
Oxoglutaric acid	HMDB0000208
Palmitic acid	HMDB0000220
Pantothenic acid	HMDB0000210
Phosphocreatine	HMDB0001511
Phosphoenolpyruvic acid	HMDB0000263
Phosphorylcholine	HMDB0001565
Phosphoserine	HMDB0000272
Propionylcarnitine	HMDB0000824
Purine	HMDB0001366
Pyridoxine	HMDB0000239
Pyroglutamic acid	HMDB0000267
Pyruvic acid	HMDB0000243
Riboflavin	HMDB0000244
S-Adenosylhomocysteine	HMDB0000939
S-Adenosylmethionine	HMDB0001185
"Sedoheptulose 1,7-bisphosphate"	HMDB0060274
Succinic acid	HMDB0000254
Succinyl-CoA	HMDB0001022
Taurine	HMDB0000251
Thiamine	HMDB0000235
Thiamine monophosphate	HMDB0002666
Thymidine	HMDB0000273
Thymidine 5'-triphosphate	HMDB0001342
Thymine	HMDB0000262
Uracil	HMDB0000300
Ureidopropionic acid	HMDB0000026
Ureidosuccinic acid	HMDB0000828
Uric acid	HMDB0000289
Uridine	HMDB0000296
Uridine 5'-diphosphate	HMDB0000295
Uridine 5'-monophosphate	HMDB0000288
Uridine diphosphate glucose	HMDB0000286
Uridine diphosphate glucuronic acid	HMDB0000935
Uridine diphosphate-N-acetylglucosamine	HMDB0000290
Uridine triphosphate	HMDB0000285
Urocanic acid	HMDB0000301
Xanthine	HMDB0000292
METABOLITES_END
#END