#METABOLOMICS WORKBENCH amroilaiwy_20160817_185648_mwtab.txt DATATRACK_ID:704
VERSION             	1
CREATED_ON             	November 17, 2016, 3:33 pm
#PROJECT
PR:PROJECT_TITLE                 	The alpha-1A adrenergic receptor agonist A61603 reduces cardiac polyunsaturated
PR:PROJECT_TITLE                 	fatty acid
PR:PROJECT_TYPE                  	GC-MS non targeted qualitative analysis
PR:PROJECT_SUMMARY               	Introduction Alpha-1-adrenergic receptors (α1-ARs) are G-protein coupled
PR:PROJECT_SUMMARY               	receptors (GPCRs) with three highly homologous subtypes (α1A, α1B, and α1D).
PR:PROJECT_SUMMARY               	Of these three subtypes, only the α1A and α1B are expressed in the heart.
PR:PROJECT_SUMMARY               	Multiple pre-clinical models of heart injury demonstrate cardioprotective roles
PR:PROJECT_SUMMARY               	for the α1A. Non-selective α1-AR activation promotes glycolysis in the heart,
PR:PROJECT_SUMMARY               	but the functional α1-AR subtype and broader metabolic effects have not been
PR:PROJECT_SUMMARY               	studied. Objectives Given the high metabolic demands of the heart and previous
PR:PROJECT_SUMMARY               	evidence indicating benefit from α1A activation, we chose to investigate the
PR:PROJECT_SUMMARY               	effects of α1A activation on the cardiac metabolome in vivo. Methods Mice were
PR:PROJECT_SUMMARY               	treated for 1 week with a low, subpressor dose of A61603, a highly selective and
PR:PROJECT_SUMMARY               	potent α1A agonist. Cardiac tissue and serum were analyzed using a non-targeted
PR:PROJECT_SUMMARY               	metabolomics approach. Results We identified previously unrecognized metabolic
PR:PROJECT_SUMMARY               	responses to α1A activation,most notably broad reduction in the abundance of
PR:PROJECT_SUMMARY               	polyunsaturated fatty acids(PUFAs) and endocannabinoids (ECs). Conclusion Given
PR:PROJECT_SUMMARY               	the well characterized roles of PUFAs and ECs in inflammatory pathways, these
PR:PROJECT_SUMMARY               	findings suggest a possible role for cardiac α1A-ARs in the regulation of
PR:PROJECT_SUMMARY               	inflammation and may offer novel insight into the mechanisms underlying the
PR:PROJECT_SUMMARY               	cardioprotective benefit of selective pharmacologic α1A activation.
PR:INSTITUTE                     	University of North Carolina
PR:DEPARTMENT                    	McAllister heart Institute, Department of Internal medicine
PR:LABORATORY                    	Multiple Centers
PR:LAST_NAME                     	Ilaiwy, Willis
PR:FIRST_NAME                    	Amro, Monte
PR:ADDRESS                       	111 Mason Farm road, Chapel Hill, North Carolina, 27599-7126, USA
PR:EMAIL                         	amroilaiwy@gmail.com, monte_willis@med.unc.edu
PR:PHONE                         	210-596-0171
PR:FUNDING_SOURCE                	NIH, Fondation Leducq
#STUDY
ST:STUDY_TITLE                   	The alpha-1A adrenergic receptor agonist A61603 reduces cardiac polyunsaturated
ST:STUDY_TITLE                   	fatty acid-Heart raw data
ST:STUDY_TYPE                    	GC-MS non-targeted metabolomic profiling
ST:STUDY_SUMMARY                 	Studies of skeletal muscle disuse either in patients on bed rest or
ST:STUDY_SUMMARY                 	experimentally in animals(immobilization) have demonstrated that decreased
ST:STUDY_SUMMARY                 	protein synthesis is common, with transient parallel increases in protein
ST:STUDY_SUMMARY                 	degradation. Muscle disuse atrophy involves a process of transition from slow to
ST:STUDY_SUMMARY                 	fast myosin fiber types 6 . A shift toward glycolysis, decreased capacity for
ST:STUDY_SUMMARY                 	fat oxidation, and substrate accumulation in atrophied muscles have been
ST:STUDY_SUMMARY                 	reported as has accommodation of the liver with an increased gluconeogenic
ST:STUDY_SUMMARY                 	capacity. Recent studies have modeled skeletal muscle disuse by using cyclic
ST:STUDY_SUMMARY                 	stretch of differentiated myotubes (C2C12), which mimics the loading pattern of
ST:STUDY_SUMMARY                 	mature skeletal muscle, followed by cessation of stretch.We utilized this model
ST:STUDY_SUMMARY                 	to determine the metabolic changes using non-targeted metabolomics analysis of
ST:STUDY_SUMMARY                 	the media. We identified increases in amino acids resulting from protein
ST:STUDY_SUMMARY                 	degradation (largely sarcomere) that occurs with muscle atrophy that are
ST:STUDY_SUMMARY                 	involved in feeding the Kreb’s cycle through anaplerosis. Specifically, we
ST:STUDY_SUMMARY                 	identified increased alanine/proline metabolism (significantly elevated proline,
ST:STUDY_SUMMARY                 	alanine, glutamine, and asparagine) and increased -ketoglutaric acid, the
ST:STUDY_SUMMARY                 	proposed Kreb’s cycle intermediate being fed by the alanine/proline metabolic
ST:STUDY_SUMMARY                 	anaplerotic mechanism. Additionally, several unique pathways not clearly
ST:STUDY_SUMMARY                 	delineated in previous studies of muscle unloading were seen, including: 1)
ST:STUDY_SUMMARY                 	elevated ethanolamine and elevated keto-acids (e.g. 2-ketoleucine and
ST:STUDY_SUMMARY                 	2-keovaline) represent intermediates in the Ehlrich amino acid degradation
ST:STUDY_SUMMARY                 	pathway, which feeds into a metabolic pathway supplying acetyl-CoA and
ST:STUDY_SUMMARY                 	2-hydroxybutyrate (also significantly increased); and 2) elevated guanine, an
ST:STUDY_SUMMARY                 	intermediate of purine metabolism, was seen at 12 hours unloading. Given the
ST:STUDY_SUMMARY                 	interest in targeting different aspects of the ubiquitin proteasome system to
ST:STUDY_SUMMARY                 	inhibit protein degradation, this C2C12 system may allow the identification of
ST:STUDY_SUMMARY                 	direct and indirect alterations in metabolism due to anaplerosis or through
ST:STUDY_SUMMARY                 	other yet to be identified mechanisms using a non-targeted metabolomics
ST:STUDY_SUMMARY                 	approach.
ST:INSTITUTE                     	University of North Carolina
ST:DEPARTMENT                    	McAllister Heart Institute
ST:LABORATORY                    	Mutliple Centers
ST:LAST_NAME                     	Ilaiwy, WIllis
ST:FIRST_NAME                    	Amro, Monte
ST:ADDRESS                       	111 Mason Farm road, Chapel Hill, North Carolina, 27599-7126, USA
ST:EMAIL                         	amroilaiwy@gmail.com, monte_willis@med.unc.edu
ST:PHONE                         	919-3607599
#SUBJECT
SU:SUBJECT_TYPE                  	Animal
SU:SUBJECT_SPECIES               	Mus musculus
SU:TAXONOMY_ID                   	10090
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01005	Treatment:Vehicle	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01006	Treatment:Vehicle	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01009	Treatment:Vehicle	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01010	Treatment:Vehicle	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01013	Treatment:Vehicle	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01014	Treatment:Vehicle	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01017	Treatment:Vehicle	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01018	Treatment:Vehicle	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01003	Treatment:A61603	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01004	Treatment:A61603	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01007	Treatment:A61603	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01008	Treatment:A61603	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01011	Treatment:A61603	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01012	Treatment:A61603	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01015	Treatment:A61603	
SUBJECT_SAMPLE_FACTORS           	-	UCSF-01016	Treatment:A61603	
#COLLECTION
CO:COLLECTION_SUMMARY            	Mice were sacrificed under deep isoflurane anesthesia, blood was collected by
CO:COLLECTION_SUMMARY            	cardiac puncture, clotted, and 100–200 μL serum was snap frozen in liquid
CO:COLLECTION_SUMMARY            	nitrogen. The heart was dissected, the atria and great vessels were excised,and
CO:COLLECTION_SUMMARY            	the ventricles were allowed to beat in cold PBS to clear blood.
#TREATMENT
TR:TREATMENT_SUMMARY             	N/A
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	sample extract reconstituted in solvents containing a series of standards at
SP:SAMPLEPREP_SUMMARY            	fixed concentrations to ensure injection and chromatographic consistency. One
SP:SAMPLEPREP_SUMMARY            	aliquot was analyzed using acidic positive ion conditions, chromatographically
SP:SAMPLEPREP_SUMMARY            	optimized for more hydrophilic compounds. The extract was gradient eluted from a
SP:SAMPLEPREP_SUMMARY            	C18 column (Waters UPLC BEH C18-2.1 × 100 mm, 1.7 μm) using water and
SP:SAMPLEPREP_SUMMARY            	methanol, containing 0.05 % perfluoropentanoic acid (PFPA) and 0.1 % formic acid
SP:SAMPLEPREP_SUMMARY            	(FA). Another aliquot was also analyzed using acidic positive ion
SP:SAMPLEPREP_SUMMARY            	conditions,however it was chromatographically optimized for more hydrophobic
SP:SAMPLEPREP_SUMMARY            	compounds. In this method, the extract was gradient eluted from the same C18
SP:SAMPLEPREP_SUMMARY            	column using methanol, acetonitrile, water, 0.05 % PFPA and 0.01 % FA and was
SP:SAMPLEPREP_SUMMARY            	operated at an overall higher organic content. Another aliquot was analyzed
SP:SAMPLEPREP_SUMMARY            	using basic negative ion optimized conditions using a separate dedicated C18
SP:SAMPLEPREP_SUMMARY            	column. The basic extracts were gradient eluted from the column using methanol
SP:SAMPLEPREP_SUMMARY            	and water
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	GC
CH:INSTRUMENT_NAME               	Waters Acquity
CH:COLUMN_NAME                   	Waters Acquity BEH C18 (100 x 2mm, 1.7um)
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:MS_COMMENTS                   	-
MS:INSTRUMENT_NAME               	Agilent 5975
MS:INSTRUMENT_TYPE               	Single quadrupole
MS:MS_TYPE                       	EI
MS:ION_MODE                      	POSITIVE
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS         	Peak values (scaled)
MS_METABOLITE_DATA_START
Samples	UCSF-01005	UCSF-01006	UCSF-01009	UCSF-01010	UCSF-01013	UCSF-01014	UCSF-01017	UCSF-01018	UCSF-01003	UCSF-01004	UCSF-01007	UCSF-01008	UCSF-01011	UCSF-01012	UCSF-01015	UCSF-01016
Factors	Treatment:Vehicle	Treatment:Vehicle	Treatment:Vehicle	Treatment:Vehicle	Treatment:Vehicle	Treatment:Vehicle	Treatment:Vehicle	Treatment:Vehicle	Treatment:A61603	Treatment:A61603	Treatment:A61603	Treatment:A61603	Treatment:A61603	Treatment:A61603	Treatment:A61603	Treatment:A61603
1-2-Dilinoleoyl-Gpc (18:2/18:2)	178159184	258327312	145162256	206920000	271013696	201033616	210164752	161643472	231678352	216464976	216868832	140950672	227644832	219655392	226917456	200272960
1-2-Dioleoyl-Gpc (18:1/18:1)	146796480	124697144	84864032	130246616	90806208	166122736	90505120	73310624	81587856	128162352	157052816	103717112	99252976	107909496	138986640	146327280
1-2-Dioleoyl-Gpe (18:1/18:1)	6452171	5881873	2515734	5746239	2862262	8018837	4233187	1277189	1732825	6703574	7697228	1902055	2050626	1977769	5857755	5349081
1-2-Dipalmitoyl-Gpc (16:0/16:0)	508021120	456127712	517444416	461604768	543978176	554013440	522853632	534365504	478549376	523606112	527711328	528641056	612823168	590694144	512046112	451462912
1-2-Distearoyl-Gpc (18:0/18:0)	4537015	5048184	4099379	4701831	3919808	4909416	3795313	3885706	3164026	4693413	4810416	3883833	4233406	4093575	3998793	4814763
1-5-Anhydroglucitol (1-5-Ag)	5610405	4985602	3612214	4717229	4299166	5025253	5887883	4721445	4835121	4647448	4843369	4870244	4090761	4512473	4652964	4817654
1-(1-Enyl-Oleoyl)-Gpe (P-18:1)	4685639	4629060	4810049	5363719	4720604	6944399	5658407	4912587	3020913	4983088	5997561	4637755	5895055	6174417	5128198	5303437
1-(1-Enyl-Palmitoyl)-2-Arachidonoyl-Gpc (P-16:0/20:4)	64091272	59287416	62407364	61208444	54731576	78619344	55137056	60957012	46943720	72341920	65099048	54024504	59394948	68379064	70431592	65473368
1-(1-Enyl-Palmitoyl)-2-Arachidonoyl-Gpe (P-16:0/20:4)	61185368	67044348	71278768	64657400	70973760	76779736	69742880	63940592	51767240	69980672	74114560	59333676	67531640	75804848	73936552	65461208
1-(1-Enyl-Palmitoyl)-2-Linoleoyl-Gpc (P-16:0/18:2)	36317812	38992724	21674370	36568692	29098470	39878232	29823308	23784084	22904898	38937732	40731072	22627292	29828146	30686554	39898048	33346120
1-(1-Enyl-Palmitoyl)-2-Linoleoyl-Gpe (P-16:0/18:2)	15202064	16810798	13934128	14760848	16483675	18647540	16997784	14160726	12708699	16221395	17579160	12509770	16126780	17478864	18352212	15311228
1-(1-Enyl-Palmitoyl)-2-Oleoyl-Gpc (P-16:0/18:1)	29198140	24636424	22797672	27858090	22734096	30761324	24308566	23163992	16533761	30722524	30697148	24315924	23980668	29503600	27715292	23582436
1-(1-Enyl-Palmitoyl)-2-Oleoyl-Gpe (P-16:0/18:1)	13394279	12908908	11474553	12751961	12362257	14540799	12689681	10346826	8811087	12733424	14638795	10928369	12252346	13054553	13035308	11004570
1-(1-Enyl-Palmitoyl)-2-Palmitoyl-Gpc (P-16:0/16:0)	13128048	11990881	10206794	12466367	10487779	14993845	12053800	10761495	7904546	13253441	14842038	9724787	12276598	13353909	13108196	11422579
1-(1-Enyl-Palmitoyl)-Gpc (P-16:0)	10695000	9548931	9760920	11685175	9687025	12507059	11263913	11425049	7383100	10807610	12015823	10943901	13157863	12804187	9902127	11076135
1-(1-Enyl-Palmitoyl)-Gpe (P-16:0)	13897145	13596471	14772868	14403991	14324672	17016000	15284964	13762869	9548767	13898815	16454330	13864123	15026218	15923355	13921779	13972447
1-(1-Enyl-Stearoyl)-2-Arachidonoyl-Gpe (P-18:0/20:4)	37433968	39857944	46842436	39386352	39970888	47091600	47115132	42917672	30690480	40469092	40503224	37839720	43032844	49145640	43830752	39027016
1-(1-Enyl-Stearoyl)-2-Linoleoyl-Gpe (P-18:0/18:2)	17002932	20961982	20065800	20526676	21149804	22758562	23164460	20909276	15305881	21168174	22306940	17229732	18252564	24473204	21966024	19207666
1-(1-Enyl-Stearoyl)-2-Oleoyl-Gpe (P-18:0/18:1)	3051069	3159914	2592808	3514807	2772316	3704988	3113267	2545021	2249745	3285996	3355094	2575920	3254930	3658126	3327532	3070119
1-(1-Enyl-Stearoyl)-Gpe (P-18:0)	3769633	6531282	10687619	7867397	7360347	1550382	6890699	9750433	745692	2909961	4062516	1260925	2983058	3002996	5110394	4997572
1-Arachidonoyl-Gpc (20:4)	46464616	179474544	48290620	72820024	26064970	64731604	48074400	53285560	62254400	43395400	53087216	81709792	20501188	37278076	34349040	177203936
1-Arachidonoyl-Gpe (20:4)	30294520	38434768	20935884	33276624	18830648	24715810	29417354	25816834	25559016	34084472	20454434	29039700	19598690	35584416	19851760	29120294
1-Arachidonoyl-Gpi (20:4)	8433493	8934471	48805248	43041240	38539412	7217586	14921710	55008408	10890835	11382800	31942036	9317678	7754353	15629326	10869621	11929702
1-Arachidonylglycerol (20:4)	1369169	1201045	4994318	5694269	3658296	1287505	2459100	6750445	1688225	1595712	5484015	1761134	1017873	2374577	2192398	1706401
1-Dihomo-Linolenylglycerol (20:3)	1240808	908650	2391365	3798761	2372006	955434	1210923	5811406	1361418	1367084	3335700	1394615	1207593	2264071	1276255	1091394
1-Dihomo-Linoleoylglycerol (20:2)	643503	363595	2443667	2832995	1854031	640576	983153	5041451	890330	814686	1988282	980786	754298	1286564	894065	806804
1-Docosahexaenoylglycerol (22:6)	2763393	2451452	13062536	12746211	6990885	2833556	6719415	21374416	3690356	4565109	11870577	5927433	3295517	5670412	4831481	4962918
1-Lignoceroyl-Gpc (24:0)	837903	1556980	874347	809566	873340	1010089	854550	830287	768473	741813	1003721	930069	790393	762772	906655	1628253
1-Linolenoyl-Gpc (18:3)	1950835	6107068	1603041	2632108	1664801	1932673	1311508	1495997	2653709	2153628	1743085	2513317	1756377	1677504	1503778	5887653
1-Linoleoyl-2-Arachidonoyl-Gpc (18:2/20:4)	185464864	215151888	194667504	182252352	193809808	213555808	229840528	152498640	162977712	200435184	197836320	153798144	204551040	252169792	202965792	193175808
1-Linoleoyl-Gpc (18:2)	130752272	417663040	98615368	141939712	88904456	137601488	95735880	101149144	141737184	118382184	103583248	166221776	104721056	105960144	98052480	413256000
1-Linoleoyl-Gpe (18:2)	14173005	20147544	13501614	16337502	15471317	15666355	16257972	12065316	13215548	13996988	16171611	13736415	14614609	16298574	14663309	17024666
1-Linoleoyl-Gpi (18:2)	1305071	1584222	7025792	6724976	7738746	1064466	2656500	6366655	1514590	2056886	5784361	1426379	1476802	2182391	1956486	2150336
1-Linoleoylglycerol (18:2)	18775270	10787557	57612512	88593232	50848136	14395129	43941656	127103888	39125680	27408460	80975056	27581210	25513168	39462828	36112996	27978720
1-Methylguanidine	29482260	42579992	26984592	45515324	49691588	39610712	24809908	36473088	38303644	52984364	58276844	26577070	50085368	27094760	22053808	31505084
1-Methylhistidine	80960880	105712152	79666336	85460504	90660152	101457248	125889696	99423688	71763512	72469760	101832080	87293152	72701896	82481696	112671896	109258440
1-Methylimidazoleacetate	1080913	1577422	917141	907499	458837	1390505	1061525	1300223	929765	1056547	589459	639576	405842	945657	1257152	1441644
1-Methylnicotinamide	2153793	2580659	2453263	2009098	1943702	1806703	2399070	1754555	2658760	3290693	2842341	2831058	1943456	1553529	2467447	2779693
1-Myristoylglycerol (14:0)	1662121	768732	3751748	3462705	3506433	1686173	1725913	3787427	2258174	1462614	3404528	1879819	1428948	2094936	3333157	1388545
1-Oleoyl-2-Linoleoyl-Glycerol (18:1/18:2)	14341910	9956480	11586951	16502873	12915524	13344757	33312132	19672308	23905530	20804030	18125660	22255700	18387598	17828620	29322660	19573838
1-Oleoyl-2-Linoleoyl-Gpc (18:1/18:2)	370169760	396521952	362347840	357163872	498495872	399828160	494684832	356966336	350925952	368132288	432906272	294887360	476604096	514219616	419717760	372231520
1-Oleoyl-2-Linoleoyl-Gpe (18:1/18:2)	38111596	50237728	30638364	43969040	52962608	49704376	44541640	27816546	39487732	40411972	54497796	28768708	38743360	45885456	52732564	37021720
1-Oleoyl-3-Linoleoyl-Glycerol (18:1/18:2)	98420096	60076048	51424448	102664144	65639804	80904016	118575360	82278808	18513988	145686464	126550280	82520384	99488496	76345200	150466016	115443088
1-Oleoyl-Gpc (18:1)	102341224	223367280	76083216	112272816	67274680	111363576	82709640	72249520	76255856	84335088	97498896	113365616	87135392	92320168	88383392	238595968
1-Oleoyl-Gpe (18:1)	29068430	28885340	26831484	32119276	30355968	35321776	33021230	24488232	21155996	26808180	36555136	28191254	33993712	36780916	31392698	28601842
1-Oleoyl-Gpg (18:1)	1166815	1132553	4962181	5610719	3156888	1485160	2784446	3777410	1349617	1578661	4983096	1216492	1274593	2131200	1927295	1658849
1-Oleoyl-Gpi (18:1)	543543	452523	2996189	3739162	2396061	544636	663622	1499850	308283	472675	2090375	412918	132139	320164	477322	550533
1-Oleoylglycerol (18:1)	31693060	16818436	77765232	124962888	64070320	18352944	77821664	173354080	37808716	40092344	85380992	36604336	31127136	45225920	44803904	40895592
1-Palmitoleoyl-2-Linoleoyl-Gpc (16:1/18:2)	57377264	85535624	38706000	57158064	60476284	63408056	54520112	41044124	59682508	63111892	65847148	48977164	60507708	50345288	63409652	84299096
1-Palmitoleoyl-Gpc (16:1)	11708970	28786644	7860838	11837034	6934454	11389055	8346528	7905050	10003426	10322383	10213572	12563535	9644408	8283296	8596353	32597324
1-Palmitoleoylglycerol (16:1)	1479484	502430	2690711	5036725	2443417	1124635	1748456	3987006	1499930	1505281	5435242	1728278	1178538	1980396	1887874	1677672
1-Palmitoyl-2-Arachidonoyl-Gpc (16:0/20:4)	1016797824	1166855808	1268312832	1005467200	1176807040	1082054784	1186417536	1077695488	1079223040	1074990720	1000722048	1048446720	1197607168	1257180032	983814976	1103563776
1-Palmitoyl-2-Arachidonoyl-Gpe (16:0/20:4)	42895540	46362260	42538200	43042564	46793080	49381944	46172396	33298842	36115072	44712336	49146712	35594088	41659016	48500120	47596252	44729280
1-Palmitoyl-2-Linolenoyl-Gpg (16:0/18:3)	60209	46200	N	51271	N	85991	91245	N	74884	N	N	37909	63712	93071	N	51316
1-Palmitoyl-2-Linoleoyl-Glycerol (16:0/18:2)	5115550	4312381	5938197	6300456	7961937	4819677	9390185	8333807	7910333	6625949	7027152	7706676	8784384	5889000	11690772	6891350
1-Palmitoyl-2-Linoleoyl-Gpc (16:0/18:2)	1010726912	1412263424	1033812736	1117621120	1431402240	1088705664	1250926208	1003632256	1405760896	1151426688	1146268544	1126957312	1266248320	1247288064	1123023232	1286012160
1-Palmitoyl-2-Linoleoyl-Gpe (16:0/18:2)	43266004	58699696	42120960	50917968	66923820	51513260	52045708	34703340	48503736	51432736	57930704	37401260	47673088	49086588	54659768	42491712
1-Palmitoyl-2-Linoleoyl-Gpg (16:0/18:2)	4974559	4749171	4076574	5545161	6159417	4594236	5893606	4379252	5573137	5618155	5909648	4244597	4948848	4467323	6547441	5271860
1-Palmitoyl-2-Oleoyl-Gpc (16:0/18:1)	1292588032	1339528960	1182069888	1205003776	1273415424	1411650048	1310886272	1042340608	1185163520	1308015232	1425127808	1208624896	1350613504	1375272320	1313790976	1291002240
1-Palmitoyl-2-Oleoyl-Gpe (16:0/18:1)	20532094	20248460	16153151	19919602	19377358	23298406	19951328	13565052	14070683	19672574	22830792	17269468	17830704	19025034	21477400	17466154
1-Palmitoyl-2-Oleoyl-Gpg (16:0/18:1)	5905860	5381308	5323058	5902842	5059421	6242138	4966001	7322914	5490536	4606001	6981538	6662027	7052451	5172704	4512984	5992301
1-Palmitoyl-2-Palmitoleoyl-Gpc (16:0/16:1)	78147232	73769440	57946652	70074176	63692676	83168840	72725696	54457804	62361584	73424072	81946632	64530124	70163584	69999368	69749744	73054032
1-Palmitoyl-2-Stearoyl-Gpc (16:0/18:0)	78173376	78053408	73388376	73192344	72647600	96131776	77580304	68953384	57829648	78675896	87922656	71538064	86857112	93125432	77530224	78884528
1-Palmitoyl-Gpc (16:0)	496304480	861370816	481267040	566940352	422507296	510062176	420922720	450172544	415244640	476658208	502507680	568928320	513371936	471491104	431725568	876001344
1-Palmitoyl-Gpe (16:0)	33115968	37860744	38245000	37366748	37558504	38485564	36533164	32435680	26741754	34688900	42060252	35307808	37433672	36765168	31917190	37537604
1-Palmitoyl-Gpg (16:0)	4357279	5810390	27280092	23072548	23491660	5976919	9004137	20391120	4906646	5558209	20981266	4960941	5664301	9086009	6542189	6599140
1-Palmitoyl-Gpi (16:0)	611031	465014	4804367	3436706	3505200	601599	822774	2479092	491463	819330	2353493	272221	395503	410470	375428	717180
1-Palmitoylglycerol (16:0)	18365778	16201034	57714104	95150152	45882840	16263621	38704688	92869456	30923140	27054332	71800824	21725712	26843150	36232088	33658512	26568456
1-Stearoyl-2-Arachidonoyl-Gpc (18:0/20:4)	1111289856	1214432256	1431532288	1057377344	1206544768	1224378368	1270215296	1133827200	1068423360	1152752512	1146739072	1078982784	1256339328	1402828928	1112491136	1196768000
1-Stearoyl-2-Arachidonoyl-Gpe (18:0/20:4)	406355424	437607584	471514720	403189632	495158048	483858528	470026400	399661152	359685568	433270624	447563360	385087680	445730368	518742656	427363552	391382336
1-Stearoyl-2-Arachidonoyl-Gpi (18:0/20:4)	11307252	9962391	9834890	9435797	10489980	10116636	10047167	10400705	10761427	9928845	10428158	7801379	8492023	10548001	10541765	10764442
1-Stearoyl-2-Arachidonoyl-Gps (18:0/20:4)	37029392	38183500	46826984	36945824	40912132	45531920	42709776	41306504	30133424	39115984	43362712	37313892	41479092	46703504	39656144	39350588
1-Stearoyl-2-Linoleoyl-Gpc (18:0/18:2)	687315584	1018807424	661396800	699673408	892679680	715240000	818842752	638614272	818657728	723029120	754548224	654301120	760918592	820917056	760176064	791730624
1-Stearoyl-2-Linoleoyl-Gpe (18:0/18:2)	108161944	135661200	106772672	120991432	157989312	125679560	128993368	87789520	109796544	113868880	141577840	88264736	112076696	121229968	124491304	104915088
1-Stearoyl-2-Oleoyl-Gpc (18:0/18:1)	468430368	451719104	428075232	428840128	433490400	500075072	457921312	344384352	380290944	458208288	505395360	400079488	454143040	491565312	433749024	430825344
1-Stearoyl-2-Oleoyl-Gpe (18:0/18:1)	18657240	17018242	17603686	17547428	17495084	21003312	16994252	14471188	12415219	17348808	20062800	15577453	16729687	18504896	17591156	16142042
1-Stearoyl-Gpc (18:0)	309758496	478724704	315379392	326422336	265398192	309213760	294519264	312969760	245473632	302912352	311342624	344217056	320026240	327616544	265909632	456107456
1-Stearoyl-Gpe (18:0)	81629520	80435424	95072656	88628568	96379368	94873144	95921096	83801440	65165576	84704504	101516544	83734544	95850776	102394160	85761848	83412768
1-Stearoyl-Gpg (18:0)	1354935	1629115	8815650	6365773	6677272	1767868	3137544	7407537	1475607	1577412	6393909	1977459	1929772	3676734	1877690	1917014
1-Stearoyl-Gpi (18:0)	7254059	7162196	29843534	39073972	24517424	7356198	10504550	25013380	7354146	8948631	25645552	7249113	6947264	7975571	6608321	7684402
1-Stearoyl-Gps (18:0)	4166423	4386893	16612214	16723023	14698232	4253910	6553601	12713569	4104809	4835597	12546942	4215933	3634175	4887344	4284465	5498679
10-Heptadecenoate (17:1N7)	32750476	25111100	98396240	113769848	87298872	31656704	50127380	109832800	47554460	40071280	106986424	41132640	45531780	65764536	41269440	36252420
10-Nonadecenoate (19:1N9)	27252702	21371480	103967320	126739024	81489864	28541964	36537032	140388224	36905848	31643844	85930488	30781292	36409036	57276776	32506344	31350784
12-13-Dihome	1247579	887592	1245294	1708252	1683759	1212355	1196442	1301651	1709096	1436805	1543717	1337320	1953141	1390281	1315129	1372945
12-Hete	62474820	76408472	75672632	73613800	85738464	71457912	48149872	110752712	59234772	31219116	102416512	50483144	87180216	144035968	27020710	31943108
13-Hode + 9-Hode	40965744	29842658	38360520	63100088	51557988	37475944	46974792	65159072	99684096	56134212	52271984	54776732	78499936	67587016	43617688	42120116
14-Hdohe/17-Hdohe	15639008	15699006	25035186	20936548	22189002	18152104	16972004	41943008	18139888	13055917	30025278	22889448	26937034	33191104	11175973	14227732
15-Methylpalmitate	16230558	14280962	46840216	40669804	40222872	17075194	18726706	28940242	12457371	16009036	42855780	11815876	17341438	21105470	19838620	18989640
17-Methylstearate	4543369	4402079	15500412	18130940	16007355	5010702	5858941	19435508	4330091	5416073	12917505	3902227	4482968	6133133	6122860	5415884
2^-Deoxyadenosine 5^-Monophosphate	257217	285883	296654	273819	184375	250090	215368	235576	306442	277600	168842	325103	277452	286225	205960	233368
2^-Deoxycytidine	7187377	10035744	8415160	8147251	9779835	9068915	8529923	8120997	9995988	9275383	8368173	7161965	6983377	7751069	8264930	8939164
2^-Deoxyguanosine	70664	87662	88456	84069	98097	96349	51310	75002	125822	101838	91407	120440	98865	95086	65709	74273
2^-Deoxyinosine	88860	121541	109542	133647	144430	111078	96061	90638	137695	134990	100910	90999	144444	116977	88297	93383
2^-Deoxyuridine	507575	627644	591688	522124	674295	518408	527934	479734	625090	639067	519161	495175	531866	474863	508172	537160
2-Aminoadipate	33327670	48483060	17887136	34783120	31247828	32654576	26495772	27254720	32683098	33753088	30570520	24590334	23700824	23094746	35177368	36630564
2-Aminoheptanoate	2397896	2526016	2735859	3068021	2364592	2581033	2459055	2107227	2802883	2828155	2857449	2621287	2960264	2903310	2568738	2420972
2-Aminooctanoate	350609	459328	360249	563039	379881	292133	243246	397762	547425	251008	254101	434552	141197	300359	413341	419743
2-Aminophenol Sulfate	81750	42807	65943	71560	115252	116772	23413	26616	116323	61981	54772	27229	124067	68693	60489	102179
2-Arachidonoylglycerol (20:4)	1203552	1096607	4995717	3940100	3619526	878175	1853866	4924420	1579127	1166046	4523381	1168672	701835	1149597	1415417	879858
2-Docosahexaenoylglycerol (22:6)	1117213	N	5268199	6680693	3678135	1495753	N	11977833	1973938	2108203	5563687	3014836	1586295	2285805	N	1220734
2-Hydroxy-3-Methylvalerate	48922	67922	65082	53890	84895	137288	115500	94194	64385	89244	84869	N	75121	116958	74864	42524
2-Hydroxyadipate	271098	460775	414314	388357	684756	522097	591831	347621	458194	620146	469325	283273	493576	498939	330760	318169
2-Hydroxybutyrate/2-Hydroxyisobutyrate	1156866	1323464	1273843	1276055	1561597	1586276	1485393	1776934	1440765	1334369	1599530	1194386	1669224	1479376	1470699	1495795
2-Hydroxydecanoate	223770	251617	280414	177069	314684	453773	231519	226564	266183	153036	175577	196689	338452	522543	364931	293835
2-Hydroxyglutarate	17591846	2066331	2412964	13217359	4027900	21800070	1658608	7586911	19586336	9857942	21313448	8300683	20061218	26604552	451553	5914047
2-Hydroxyoctanoate	71220	159024	87885	69201	115743	66083	N	51997	N	38217	N	41983	214395	92587	78190	53825
2-Hydroxystearate	2808398	3217166	12979584	9550783	7703226	2993472	4374349	10120740	2551808	3313808	8332369	2434497	2913617	5187557	3729530	3529794
2-Linoleoylglycerol (18:2)	17621032	11036316	57812520	91556712	54615444	13926276	35729516	115516272	38532584	27702470	84236416	24649540	20970060	26383118	30467332	22129380
2-Methylcitrate/Homocitrate	491447	575443	685588	487684	585986	660735	439055	440604	416210	478163	521872	378693	506907	551669	519815	447347
2-Methylmalonyl Carnitine	49925556	47346568	54482596	53358064	55394688	54587768	51321496	52159696	49973344	54713668	50860760	48659252	49034184	49662800	47444612	52241824
2-Oleoylglycerol (18:1)	36568100	20007972	72092240	142071568	53973120	23289264	44763752	144397680	39728072	41304104	112532584	29435050	31108140	41044176	40029740	33584004
2-Palmitoleoyl-Gpc (16:1)	721480	1530587	396035	510987	402133	739051	350449	350505	506931	388741	489484	739092	549091	393477	528988	1641739
2-Palmitoleoylglycerol (16:1)	1310387	459183	2043274	4263228	2096094	973125	1179471	3329072	1246262	1540480	4418006	1569347	1245741	1633439	1089206	1105159
2-Palmitoyl-Gpc (16:0)	31940886	56039960	20007104	33476966	25544188	26824952	23133436	19178888	22943678	25805348	27091234	30080998	24059448	25320372	21482710	49818008
2-Palmitoylglycerol (16:0)	16361877	10518412	48964352	55100344	37284928	13711805	27588166	66366936	32436438	18136688	55297220	22848162	23498928	31665700	16138838	15374370
2-Phosphoglycerate	9095012	9774394	11785965	8416482	15493901	7807225	8434336	7111172	12905710	11346710	11203817	8761156	9446409	10896118	10312424	5768388
2-Piperidinone	1703372	2106022	2866371	2039810	1804355	2004347	2250507	2575979	2050476	1957175	1666354	2730839	1706194	1732443	1526880	2456110
3^-Dephosphocoenzyme A	112893	118499	90922	71499	110987	147255	130905	55248	N	99706	91505	68899	104917	61731	180700	120074
3-(3-Hydroxyphenyl)Propionate Sulfate	231960	241732	235163	310269	242548	366565	324173	245540	387646	641910	395409	253486	426822	234575	432035	229958
3-(4-Hydroxyphenyl)Lactate	1903750	2316858	3490275	2824203	2195216	2652596	1841557	1302916	2113777	2117044	3371193	1486846	3449068	2179455	2157687	2160926
3-(4-Hydroxyphenyl)Propionate	N	43520	79648	73728	89705	38239	46795	37283	54962	81228	47155	61404	69603	52170	52445	39683
3-Aminoisobutyrate	1654220	1433287	970604	905208	2031962	1143049	760659	850215	N	1357435	1254392	979413	1195054	1072410	1749181	1560136
3-Hydroxy-3-Methylglutarate	2481484	2712638	3590802	2974348	4115565	2737698	2529952	3056152	2873214	3452412	2952892	2309436	2903622	2367310	2663391	2441015
3-Hydroxybutyrate (Bhba)	5008681	3950630	1720679	1376745	1699540	4227172	9388648	6809706	2260972	1521333	1908558	2742080	3352938	3680534	5159242	3472609
3-Hydroxybutyryl Coa	27146	21099	N	N	N	30544	81715	39468	N	N	N	20592	26891	19394	35445	N
3-Hydroxybutyrylcarnitine (1)	284824544	203373728	132703560	83593160	104376928	216995008	490427072	348971328	162879472	96341680	121732448	183687184	223477808	206332352	262547504	181582352
3-Hydroxybutyrylcarnitine (2)	78097664	61112344	22313516	26404356	26156052	101004528	170261344	64320416	69686584	38722784	27462744	48015632	35951768	63232276	79529296	53958312
3-Hydroxydecanoate	4748601	4710019	1653610	2252836	2202412	6756406	7762819	4559913	4507359	3087861	1866288	3398929	2604431	3879244	4428418	3535149
3-Hydroxyisobutyrate	684021	738055	977302	747634	941573	974976	944365	1140144	539531	882931	1150837	485600	1001448	854075	1088873	934181
3-Hydroxylaurate	10774054	10037247	3316622	5024496	4996218	17269280	18037128	10018919	12178596	7030866	4396657	8421487	5560505	9937857	8923874	6630318
3-Hydroxymyristate	28698684	22536798	19445814	25830872	24034296	44453484	34600044	37611900	35424572	17570314	24791836	21206488	18835520	32950040	16821612	14756108
3-Hydroxyoctanoate	1116427	1136344	445054	547952	527105	1614608	1839771	1287519	1104439	722275	424242	946484	603293	1021659	943741	819336
3-Hydroxypalmitate	23242366	22506820	65518596	58134908	57003080	26340140	32888224	60182184	28037320	21754680	48940592	20749272	18412140	34894136	9738075	10538581
3-Hydroxystearate	3955642	4693338	11397087	8621255	8934767	4224881	5216278	5215021	4722478	3228055	7910544	3935794	4038410	3394959	3441402	3685384
3-Indoxyl Sulfate	352811	221924	443547	448837	654831	992437	354610	551422	320305	177734	409468	191524	813988	866183	828660	252523
3-Methylhistidine	26168452	33774372	25526792	26966972	21417868	33962972	37327492	37231272	20840266	22457002	23567144	21984258	23518692	33960328	34484760	28993344
3-Phosphoglycerate	74445160	78002560	83504488	76510904	97352448	77480824	71059704	69057064	92221024	91679080	85698048	78602136	78755904	85515296	78313544	67131752
3-Ureidopropionate	3580662	8772183	3787545	9217918	7166380	4662280	2387041	4312353	5455281	5517534	3810474	2230071	2784724	2139883	2937754	4844535
4-Cholesten-3-One	3290148	3011369	3392257	2859582	2746851	2855956	2978252	3326828	3621420	3729528	3672814	3313410	4280473	3425437	2582281	2956836
4-Guanidinobutanoate	18210176	18962836	24722442	20945084	17113748	18542634	18893020	17031130	24947980	23078994	19486988	24565232	23582196	20430032	19108554	21497316
4-Hydroxy-2-Nonenal	2436777	2680865	3972427	2327489	2162540	2142782	3002450	2744117	2763432	2208485	2867883	2680139	2345643	2222621	2727582	2717444
4-Hydroxy-Nonenal-Glutathione	3446932	3790261	3509318	3238969	3946878	4015112	4358572	3251887	4066263	3918320	3587813	3611682	4187577	4180137	3677003	3718535
4-Hydroxybutyrate (Ghb)	2887512	2549271	2270806	2156838	2078550	2987820	3129467	1957456	2499287	2223467	1638851	2467782	2753546	3110710	3125611	2912836
4-Hydroxyglutamate	5813009	8890461	8893442	7967832	9406357	8660275	9146107	8606579	8868777	9586449	10764671	9460915	11206361	9844037	7709377	6573516
4-Hydroxyphenylpyruvate	47161	47908	126018	79025	59539	58814	57548	55839	57688	56251	62197	56281	64203	52145	46530	63163
4-Imidazoleacetate	7798944	7342726	13972061	8320670	7518443	8675026	9687785	8320309	10128785	8839328	10302616	11018933	9513219	9336736	10352756	10455038
4-Vinylphenol Sulfate	122056	118470	132883	418799	116592	235334	126166	N	186543	216909	N	144481	N	140858	91614	N
5-(2-Hydroxyethyl)-4-Methylthiazole	198058	221681	299267	313637	319341	205002	132203	177738	286879	299419	246645	258131	296969	238331	109164	207994
5-Aminovalerate	12099557	23331186	27768636	28826246	18798424	28907834	14573628	N	22164116	24028286	17667388	14024676	22618168	21838086	13238869	19522148
5-Dodecenoate (12:1N7)	1195798	1219924	500195	751447	930557	1268341	1615985	1664192	1290091	1071825	572547	1165435	937546	1238084	1036046	1129214
5-Hydroxylysine	2402960	3559695	2875616	3142863	3814165	2842203	3008818	2530297	2504864	2282228	2577327	2139265	1689356	2946857	2541589	2922118
5-Methyl-2^-Deoxycytidine	440500	670175	659185	613724	518673	571725	504938	644284	876873	759139	471589	519721	500062	493748	525138	685025
5-Methylcytidine	1693470	1251007	1718143	1144683	1556339	1001472	2040455	1795915	2129061	1759995	1886929	2301873	1932609	2238146	1475782	1126242
5-Methylthioadenosine (Mta)	66134824	75362064	77969984	83088320	100524816	83864056	79850992	64838636	81446992	80063120	76342400	70113920	81818296	72344392	83230216	76060856
5-Oxoproline	16681244	18665864	18818528	21164782	18321772	20510060	22770460	21631050	16366447	16389833	20043760	19491732	16694900	26182672	20351678	22242594
6-Phosphogluconate	733343	695935	693875	779443	724412	713672	930588	617181	891931	753361	702149	798418	966527	1019663	965392	913310
7-Hydroxycholesterol (Alpha Or Beta)	5293463	24470008	5842661	4224564	5007334	5390332	5806730	4345344	5421236	6006026	5050084	4585268	6539388	6226517	4627353	4985174
7-Methylguanine	938191	1037635	934295	1016973	1085101	901986	1082790	1125495	1040249	900133	1007476	1211356	591332	786315	1178046	1161522
8-Hydroxyoctanoate	147532	96220	119227	122133	161683	135850	126162	168722	242764	125537	172672	153895	235806	186283	126973	153214
9-10-Dihome	462018	394199	398187	590330	432423	474802	482273	539293	874633	639597	489318	655376	834320	479936	652646	555904
Acetyl Coa	63438	77666	79980	83552	117789	77067	77420	62084	53772	89417	135517	55012	102115	81879	103424	82483
Acetylcarnitine	787913280	906165248	1490120576	1164551680	1757151360	1114051072	860796864	946673920	1256197632	1179202432	1992034176	884053504	1260052864	1232949504	1218994176	1073402304
Acetylcholine	4908138	5261840	5156111	5474139	3661094	4297428	5577389	6734325	4199358	5554728	4606981	4875786	4969864	4926280	4547844	6709060
Acetylphosphate	14725048	14917049	14769067	24520620	27127008	16572126	12477410	12899740	24751628	28628584	15404629	16332881	17264526	13637984	16244288	22842258
Adenine	347807648	364888416	254104048	399798336	298504704	402859104	320537056	353147040	336879232	381795328	377565280	374754528	407764512	427146688	310925696	234947248
Adenosine	3537609216	3807867136	1310622720	4659869696	1905678848	4678989824	3206873600	4487663616	3150742272	3779681792	3158625280	3927763200	4086857984	4827265024	2855218944	2588347392
Adenosine 2^-Monophosphate (2^-Amp)	1013223	834490	1353728	1335705	1026346	1049723	459144	502694	1312413	1207496	778439	1087473	1099279	1111138	383906	614457
Adenosine 3^-5^-Cyclic Monophosphate (Camp)	127239	160601	98663	107424	106916	136753	138772	104558	127409	155074	122962	117253	125956	128578	149644	148024
Adenosine 3^-5^-Diphosphate	4551660	4970593	4714229	3757960	3986341	5257984	3705487	3937974	3539378	4190269	4099434	3923653	4603935	4951468	4228028	3509394
Adenosine 3^-Monophosphate (3^-Amp)	1198952	1448415	1358358	1109084	1117578	1462753	1545782	1024384	1097328	1233558	1026980	1126325	1261560	1056118	1448230	1379722
Adenosine 5^-Diphosphate (Adp)	9531336	12286829	1648590	790012	5027574	10892040	11710068	10258822	11510747	12493021	5718272	10179977	11182378	9906573	12766594	12843110
Adenosine 5^-Diphosphoribose (Adp-Ribose)	275407	300271	188005	N	N	493371	404531	231445	179236	287846	414539	280550	254773	210938	389544	201876
Adenosine 5^-Monophosphate (Amp)	1358271360	1698609664	1487296384	1373227136	1773511168	1944771072	1852851840	1616671360	1268906368	1323820416	1530367360	1266492928	1453279360	1386889856	2027062272	2040829824
Adenosine 5^-Triphosphate (Atp)	2026	1891	1422	2167	2346	2267	2623	2918	2476	2392	2163	2310	2432	2347	2249	2415
Adenylosuccinate	6439360	7365090	3938700	1852273	8131762	8136633	6406470	3302978	3132676	4435854	6590413	5121846	3705869	4869973	9332468	6524800
Adrenate (22:4N6)	294361536	291576640	1330215296	1111936640	823573568	357954752	306612288	1122024576	281097024	342708640	792175488	320960992	366122464	559341504	271864160	301946080
Aica Ribonucleotide	1593562	1789465	1690181	2180476	2104793	1480147	1798537	1966724	1756398	2354102	1367876	1535142	1045348	1320172	1186912	1527910
Alanine	1691586816	1644513664	1715639552	1800366848	1608117120	1476377344	1738949504	1271587584	1751485056	1601183232	1706041216	1657254528	1598109952	1562506880	1755060992	1355588352
Alanylleucine	537978	639347	225105	N	556476	728778	N	94369	273275	524260	1038293	273491	432557	556703	815619	337525
Allantoin	7897199	10653499	7489718	10209051	11644013	10677885	12661322	10686445	8455168	8015659	8575406	7830164	8772449	9844307	8793947	8397272
Alpha-Hydroxyisocaproate	19927	41509	53698	59425	72617	66652	64055	72620	39417	96796	86850	N	56353	106964	85846	135387
Alpha-Hydroxyisovalerate	437279	481611	358891	488307	602067	497914	516888	542922	408077	448537	444244	423882	470431	520615	357253	423101
Alpha-Ketoglutarate	23015714	22388520	18046570	16339311	23773852	21068556	17432648	17672874	24538688	25522088	19935856	18281200	23380126	24444440	18518444	19876808
Alpha-Tocopherol	1209012	19316892	2309420	1135873	847115	1046714	4791534	1731852	1138172	728119	611747	3368129	553747	347011	12706090	18775082
Anserine	56956012	70425192	71924752	72200088	72842216	74297488	78766672	36050880	66746852	73650728	67968112	55707292	57637264	70526232	85779544	70041096
Arabitol/Xylitol	1726704	2191205	2023457	2758345	3144310	1298995	2048049	2875312	2513413	2663875	2368146	2590320	2528578	1329970	5169368	2895023
Arabonate/Xylonate	11584517	12303805	8452724	11420880	14712910	12218547	13455380	10011446	12490435	15875817	11746207	9285887	10979643	13124404	15399545	13140798
Arachidate (20:0)	56837624	54055088	162669600	192664720	205423232	55295852	61775696	216514208	74867712	59802020	153798320	66018416	72750112	102776480	67516048	57148972
Arachidonate (20:4N6)	626348736	659661632	1988490752	1676789632	1660163328	787135616	916277568	1665899520	689822720	742122624	1539716224	780599424	817949568	1276088192	780906496	723221376
Arachidonoyl Ethanolamide	160666	85970	188371	156484	146757	198008	211131	88985	N	174952	123778	136377	124138	109173	162351	N
Arginine	1177944064	1175080192	1320288384	1230889216	1158911872	1247855872	1247308544	1211474304	1330867584	1241295872	1288959744	1326032512	1269907200	1353232128	1254368000	1281080704
Argininosuccinate	20550232	19451420	22546400	20541618	17415484	22636516	25024272	22775332	26674264	22465976	21328376	25360452	18548428	23537412	20408062	22220468
Asparagine	443697248	573222080	657019776	574377280	566681600	530274976	497345472	431062112	579558144	532710944	520095264	525601856	465726080	530707776	447852032	477606880
Aspartate	2329031680	2318375424	1960779264	2879962368	2459124224	2218180864	1615474816	2109126144	1745538048	1961968512	1906845568	1932281216	1660257408	1415462400	1502219136	1672989184
Azelate (Nonanedioate)	297905	256827	264549	337857	310271	283742	358045	306965	450633	315831	281606	331908	864748	308822	300733	224980
Behenoyl Sphingomyelin (D18:1/22:0)	170841504	182046912	179067280	170879168	187467984	200352496	172987632	156729232	140696272	196090368	199947920	160328256	195183856	191698000	174444032	181298080
Beta-Alanine	53010672	61580804	70364160	75266192	77042432	50537496	49587956	49421680	83428744	75229456	61607648	64925560	53610712	56006692	52777768	54738000
Beta-Hydroxyisovalerate	325598	317899	343242	362082	368214	354072	363740	312067	196982	250132	362844	335027	302852	402226	316895	404508
Beta-Hydroxyisovaleroylcarnitine	74483784	78288824	94747520	81879712	109208312	81442160	83808056	84511632	105335544	93826128	89435840	79363984	88698592	79860128	87117936	91131808
Beta-Muricholate	N	22266	1289295	N	68008	442536	107193	223680	N	43539	343984	N	234996	351364	254730	268926
Beta-Sitosterol	403126	648403	492922	342700	649111	480048	393767	197419	279751	340529	298296	434684	392838	355541	382871	590239
Betaine	587072384	627122496	1061126976	608126848	671708032	669212800	533136640	742326464	699263424	643088320	864346688	619415232	803930304	642499328	838030912	859657792
Betaine Aldehyde	4340599	3832337	5070921	4081682	5331032	4403495	5411104	5731459	5091419	4626028	4553334	5218793	5326677	4904728	4103794	4482878
C-Glycosyltryptophan	5307216	5621003	6249484	6039193	6558579	5985321	5528662	5307465	7093591	7131920	6381316	6022885	6628830	5218861	6360154	6207635
Campesterol	2995074	3308846	2735625	3014748	3421913	3040476	3049119	2283221	2330996	2954217	2811159	2827865	3435107	3183593	2484705	3570242
Caproate (6:0)	728794	712939	775825	N	N	630415	872819	727314	739307	612390	790746	1336455	842557	789524	865878	676831
Caprylate (8:0)	N	575951	490147	356548	N	325023	622025	576879	N	615709	N	N	N	N	396232	687022
Carnitine	3807066880	3560890880	4061447680	3819027200	4337199616	3794170368	4420890624	4059682048	4202920704	3949907712	3907935744	4071656704	4164849664	4269289984	3989455104	3845713664
Carnosine	3792931	5069847	5508959	4684801	3831117	4172476	4596385	2400600	4304573	5402175	3543021	4572376	3346065	4512285	5174529	4505735
Catechol Sulfate	141354	100408	84619	199925	258279	263014	29222	20376	238430	143764	83224	40860	219061	182574	103118	128049
Cholate	N	N	2913654	N	N	227371	N	56961	N	N	164204	N	107104	125474	71011	100880
Cholesterol	150066816	175432912	160966208	144854432	144453664	142671744	156742416	144926416	101771720	150979840	132847376	129514664	157024912	153262672	161059808	165155536
Choline	1241058560	1163025024	1473298560	1200611200	1317599488	1236134144	1326801408	1453490816	1391389952	1300208512	1260152320	1348850688	1297454208	1292048256	1161365376	1273835264
Choline Phosphate	567302016	591254784	713528448	636369664	669878656	595105856	650033728	664322176	675876032	640327872	539137728	590406720	535736480	599864576	522760032	633351040
Citrate	23962760	25821262	25123008	25427936	25684000	23783952	27744608	21998708	20289266	24396176	29287458	22682468	24697744	20785876	18882032	18663880
Citrulline	710124736	746214144	941414272	767432704	847184896	834274432	822212800	786090048	829786176	793116800	829366592	821796864	754897408	784414592	871948096	807857600
Coenzyme A	235992	322254	226413	192412	239422	314013	341523	182720	138169	285475	244078	225910	240082	215391	505441	313606
Corticosterone	98190	147892	173326	220428	172632	255593	108376	248384	97261	30884	214963	48095	216036	157306	70591	162700
Creatine	13128406016	12812792832	12959897600	12861927424	14124668928	12863394816	13991411712	14359101440	14421879808	13418047488	12658611200	13317942272	13174919168	13460034560	12965487616	13579738112
Creatinine	2821040896	3440185600	2897663488	3988951296	4306712064	3633260032	2778093568	3567628800	3540086528	4192460544	4172262656	2746392576	3973365504	2894260992	2455783680	2995010560
Cystathionine	3077277	5087053	2557600	3595684	7002112	3794499	4506247	2616240	3692574	3699913	4595660	3102053	2933190	2942803	4326261	4853429
Cysteine-Glutathione Disulfide	8381246	19156784	16108066	16117297	13933756	13690080	12436460	13347178	18131564	13199791	13874015	12393236	15672018	13860197	9934726	13066717
Cytidine	364095840	413559040	404842272	458698656	462446144	364518912	358327744	443059040	556782528	557407680	386230112	452421216	385119104	401439360	373057632	422815808
Cytidine 5^-Diphosphocholine	511449	457808	471692	555720	553330	511694	357087	468743	456050	447746	601646	446199	665134	607920	476691	435800
Cytidine 5^-Monophosphate (5^-Cmp)	38973000	37955224	42872160	40155128	45627528	38232796	42750952	43972584	43610376	41202300	40888876	39312296	37607872	39842436	45479996	51637336
Cytidine 5^-Monophospho-N-Acetylneuraminic Acid	220510	259016	342211	281609	241645	248354	323332	317239	183122	119297	187121	213157	260751	210788	334728	270429
Cytidine-5^-Diphosphoethanolamine	1149117	1081134	951974	1012182	909840	968806	1248788	1069407	1085913	966815	1088153	1005508	887194	1181715	1197905	1157861
Cytosine	2810150	2091013	2964417	1343686	1505947	1809007	2653691	2234148	2641056	1914244	1631901	2967234	2153552	3016973	2838443	2907231
Decanoylcarnitine	248983	439106	107500	558908	N	418953	403460	257897	215402	208288	N	259234	145710	244642	168332	285273
Dehydroascorbate	14634156	13955066	12538997	13456122	14201622	14030769	12736007	11020851	12540773	15799884	14275711	12621233	12523019	11545123	17991160	13666848
Deoxycarnitine	369170016	343707744	524473344	339330048	381923648	340397312	386313728	393207392	343048864	338928192	324149088	346125984	356972992	391864192	418013312	400122432
Dihomo-Linoleate (20:2N6)	150088992	120765664	556262464	696551104	495434912	159364320	168937600	754880576	197123744	185982592	505783328	185766496	196447904	297336544	169972240	160067584
Dihomo-Linolenate (20:3N3 Or N6)	316610656	265695952	638109376	994011648	754891200	293171744	335963968	1104800384	408846368	434914624	674339328	414762368	355357504	587907776	312952672	297710048
Dihydroxyacetone Phosphate (Dhap)	1717321	2605171	3542046	3246141	4067246	2022992	1941567	2171974	4449462	3345132	1333053	2734103	1615320	1318151	1009363	638954
Dimethylarginine (Sdma + Adma)	51958180	57262272	76609472	61553252	61511184	62036824	74239088	73762880	65598540	63211488	60226300	63835124	52629784	58927028	58347076	67332672
Dimethylglycine	7864228	12138187	18248776	9962420	11290696	11244048	8819718	12251640	13381867	9832183	13666883	8904347	10352981	9318764	9829217	13225293
Docosadienoate (22:2N6)	7888557	8359813	28111218	38370464	30673364	10492951	9609210	35255280	10327374	10483244	25841208	11173398	8532364	14030726	10284687	8505078
Docosahexaenoate (Dha; 22:6N3)	602499328	585455040	1958527360	1626668672	1418033920	657333056	892285440	2076916608	597062080	765101376	1553492736	1005132224	758580992	1208898304	652022528	740197696
Docosapentaenoate (N3 Dpa; 22:5N3)	284447232	229020336	647856960	1194429952	835812160	259493312	305385664	1241528192	294277664	327566816	669827840	366396128	294445440	556883072	217625664	236616928
Docosapentaenoate (N6 Dpa; 22:5N6)	108537256	126803128	1028181504	320344096	266296544	138121216	140928816	373359776	97092552	149142768	365141408	152184624	146283552	252504496	126320576	139767280
Docosatrienoate (22:3N3)	8494182	8944122	27139060	38392088	31401764	9205375	8989666	37632584	13345664	12614180	23851408	13460280	12314162	17110916	10131888	7655773
Dopamine Sulfate (2)	36320	36147	53691	53769	46860	49833	38660	41076	53343	50133	43529	74543	52310	40872	28026	31456
Eicosapentaenoate (Epa; 20:5N3)	29710728	19968086	51306944	118162928	74658800	25317784	53385248	168043808	38842748	40082436	86504432	46565068	30231456	56226396	36130272	30705908
Eicosenoate (20:1)	292723776	235461984	1206144896	1502338048	1176279808	358480000	360179360	1652037760	445468672	387165056	848254272	376400576	398476160	635348224	391892608	346195040
Ergothioneine	13678734	12876496	12095790	6851197	10177392	9885618	20498164	9222568	10027578	11847627	13489726	8438781	12695574	15941842	29055364	13430191
Erucate (22:1N9)	51379032	53927296	170732384	267389008	187425792	59454428	56681756	240826720	59008116	65526432	149119248	49258212	71390608	96454072	65441200	60284376
Erythronate	19187200	18875550	19046440	25888248	22764004	24479356	17625274	18910622	24637706	24720272	22100036	20136054	23717552	24266724	20658300	20553154
Ethylmalonate	3456857	3326944	1996363	1906701	1903886	3743016	4719736	4283996	3426047	3373813	1490913	3401113	2058673	3568774	3388061	3824767
Flavin Adenine Dinucleotide (Fad)	7401284	8089268	7720351	7253197	8007227	8781862	8865746	7863519	6936405	7661155	7325629	8541827	8334539	8774770	9185499	8818128
Flavin Mononucleotide (Fmn)	235236	301836	283170	244770	267276	348438	344434	282694	233793	263634	266822	286063	255391	255287	330956	307959
Fructose	956381	616586	1226678	2960108	2508715	1148173	996322	1202767	2452965	2268783	797145	1479243	2307383	1434768	400387	1219065
Fructose-6-Phosphate	5702945	5322284	12226735	62821024	53985088	10239449	12621023	22795184	40725640	27261632	5680880	18702440	28509164	12479833	8235187	37349584
Fumarate	118926168	107151512	112251744	111634088	100849736	119761968	136579296	123288568	115769760	107445368	104302648	112669840	112893312	120339064	126308304	106371960
Galactitol (Dulcitol)	867542	779231	935951	807094	859317	758784	810711	978961	794430	728422	851176	655203	756389	738097	762574	635048
Galactonate	11187832	10293868	12474529	13436768	12021251	10635038	10542374	10414917	13939168	12182245	9276465	11325308	13339293	9678670	13271867	12327671
Gamma-Aminobutyrate (Gaba)	391528224	339185376	335073408	365021440	315920640	354936224	263542528	314122080	427502912	367610400	315823776	401520640	371104160	377236800	279961216	298597920
Gamma-Glutamyl-Epsilon-Lysine	2742931	4795229	2743423	2645848	4179213	3920335	3858487	3088448	3150949	2746734	3830858	2590532	2744893	2724834	3557009	3721357
Gamma-Glutamylglutamine	3751967	11189237	959413	936365	875358	2021723	1097357	2304226	2625249	1629302	1008931	2213606	1438718	1288701	5694918	5462230
Gamma-Glutamylhistidine	707202	1609297	1066307	646908	705531	721185	715005	526908	770204	916336	988356	837100	756998	457290	1199362	1167324
Gamma-Glutamylisoleucine	451843	1098082	400338	304476	456174	411690	488094	480444	342697	458785	603569	337410	526048	314547	755481	653464
Gamma-Glutamylleucine	3710061	6203822	3039867	3232691	3459602	3137258	2846026	3383744	3236779	3502497	4465930	2961774	4127190	3080599	4038878	4285536
Gamma-Glutamylphenylalanine	751632	1661866	834001	610839	466639	675934	341915	630900	558115	582090	925288	507940	851280	469552	992476	916148
Gamma-Glutamylthreonine	1026086	1618957	1021124	925652	1437828	1042605	1302130	1023598	1200298	1060691	1388611	1349429	1405429	1120407	1255564	1201089
Gamma-Glutamylvaline	3131566	5743872	2460935	2431843	3465905	2972921	2707427	3021396	2689878	2933211	3612520	2469330	3251141	2593333	3676954	3880996
Gluconate	1676030	1194031	1405728	1823773	1589734	1485157	1453770	1193954	2332510	2059399	1153699	1919971	1757891	1284150	1607595	1553963
Glucosamine-6-Phosphate	7002574	7873392	13410542	51003648	63863436	14033750	14818241	22041454	57410808	38670848	7443944	24559198	34872820	17361060	11460442	38045804
Glucose	88997072	57212516	97161936	129872488	122267536	94839216	99511688	101360080	103010256	94109672	56234160	98505776	100481392	68072776	98679344	98038152
Glucose 6-Phosphate	6253497	7268239	11623518	42751616	55197568	10812348	13192710	20968652	43512148	33225892	5971153	20443508	26112756	13261801	9946796	32783330
Glucuronate	329945	175182	178624	365511	351505	379219	142203	270085	669702	430875	386266	306438	470087	405898	102708	251098
Glutamate	8033048064	8424397312	8460972032	9033657344	10289395712	9700586496	8096534528	9473050624	9160181760	9301008384	8761645056	8672854016	9711029248	8895362048	8088064512	9450561536
Glutamate- Gamma-Methyl Ester	32559788	34695572	41272552	33576712	27404858	36138140	33806748	30176518	29707312	31574046	44512792	31610296	28268432	31267396	32139478	30134980
Glutamine	7858759680	8527996928	9409219584	8330080256	8869105664	8311501824	8614663168	8049025536	8803189760	8478594048	8558331392	8019758592	8224182784	8525798400	8365633024	8865218560
Glutarate (Pentanedioate)	3222353	3563453	3266518	3754927	4159836	4280991	3274805	2869684	3165424	3173153	3184309	3134268	3573517	4081293	2921360	3342041
Glutarylcarnitine (C5)	4231902	3638944	4161230	3603119	3347897	3986743	2693810	2073083	5820733	3854478	4506417	4075831	5216508	4328343	2110773	2183641
Glutathione- Oxidized (Gssg)	674162432	656934272	698153280	706273344	720239488	727824128	744135360	753759296	758443584	757564608	730254272	657338944	699002304	752486272	790679936	745218304
Glutathione- Reduced (Gsh)	1398742	1935740	1312853	1000101	1583369	1839103	2283080	1261905	788077	1393986	1151535	1019888	1150345	1377285	3503595	2038191
Glycerate	50221984	51719032	57219872	57338208	58930680	54281736	53297344	56391940	55314408	54961840	54575760	54869248	57372092	56537040	61726984	54386344
Glycerol	2389564	1630829	2191739	3002420	2170550	2250894	2967318	2525976	3431480	3365792	2511323	3181080	3342202	2636919	2390380	2586372
Glycerol 3-Phosphate	9502818	6395846	8368569	7525518	7887467	8395591	15909663	21128764	12432351	12768884	6706996	10699270	9157397	8456087	16944170	15722599
Glycerophosphoethanolamine	2086766	2131773	2195458	2231558	2560615	2762667	2642667	2765510	2426462	2476407	2880021	2554183	2890179	2434817	2425383	2608646
Glycerophosphoglycerol	9260344	10033108	11463505	10275668	11847284	12027883	13197723	13685439	9698190	10735884	11631561	12531657	14447216	11531933	12287577	12856060
Glycerophosphoinositol	1600602	1981452	2035005	1733459	2064722	1849869	1364209	1653260	1422250	1744404	1861114	1590593	1836600	1508282	1449625	1519817
Glycerophosphorylcholine (Gpc)	581436032	646201408	539555520	525319264	555727296	637842688	567972224	683000128	520699328	553575040	577653824	608586496	592958784	574959616	623468480	643807296
Glycine	172799904	213568080	238576592	197720880	199561840	190420224	194598640	187754112	208443568	201875136	212844720	187843392	191375648	192924816	205026848	199059680
Glycosyl-N-Palmitoyl-Sphingosine	928534	2106463	1819480	1498887	1117001	1383022	908818	1080457	1232164	1129722	1295461	1256149	1179489	1202970	417548	1655990
Glycosyl-N-Stearoyl-Sphingosine	110254	342571	242811	180529	268381	244023	273922	162553	N	224957	262876	N	286500	N	243422	251818
Glycylisoleucine	N	N	N	251562	N	357183	140478	192565	158630	221804	247530	N	175406	328667	202949	405614
Glycylleucine	2253909	1962751	2212368	1983706	2704184	2583871	2262855	1912160	1900444	2599449	3019315	1940539	2434555	2404605	3144474	2368284
Glycylvaline	1826332	1825014	2116559	1904090	2395280	2110040	2011290	1989952	1848635	2300210	2452207	1899201	2464839	2158944	2749010	2371861
Guanidinoacetate	129482	110090	201278	130302	99412	145667	113852	104601	159933	152850	120606	141992	132049	160698	116588	118121
Guanidinosuccinate	574463	1107367	N	290864	195413	340203	227736	155212	360329	246351	102494	500678	133551	178238	371472	266031
Guanine	5931631	4319462	6367884	4928020	4350683	4361900	6267988	6766283	6728307	4158799	4364300	6827409	5466150	7300722	5546021	5105592
Guanosine	24937412	32567896	5216164	49637004	6245094	36228740	3831047	9032332	5334191	26500548	21232696	7820716	7017284	6289351	21295962	31718752
Guanosine 5^- Monophosphate (5^-Gmp)	105548288	112508616	124755992	103418008	145243792	124512000	133036464	124401056	115463776	114501696	120121576	107655136	107463752	113878376	131955288	139602496
Gulonic Acid	8593840	7888912	6531471	7667885	5964748	7091017	8181357	6870259	9839139	10592114	7702746	6982928	8205882	6416271	11542682	8145497
Hexanoylglycine	240423	283279	140631	141385	154730	659567	360430	647065	294829	333242	122536	209742	87547	150744	180068	382574
Hippurate	24750	N	N	31062	31689	28247	N	N	N	33693	N	N	25975	N	18009	21122
Histamine	186545	215980	N	251136	847591	261092	311503	536326	813687	492205	1023042	N	463662	526014	1830517	1120113
Histidine	17633752	17707172	31272282	19902168	19329384	19547786	20157692	16905832	21521336	19912192	25269568	22842132	25052784	21239364	21389618	21740054
Homoarginine	8347823	9286734	10597485	10149434	9001271	9764552	8327212	12632567	10607806	10314425	7904435	9902193	10477789	7889505	9388502	9083143
Homoserine	540993	750275	529520	1553631	2084888	1298799	610716	675588	540261	662808	568635	654982	623437	593854	919831	818082
Homostachydrine	671804	1133387	1016905	970626	1368740	1665727	1002530	1178888	947099	1091226	1342016	1486098	1455477	1299496	1563788	1705934
Hypotaurine	4217931	3514307	8173279	3613452	3710989	3897526	4695436	3853545	3529286	3031843	3669353	3324741	4131089	4325241	4659939	4433388
Hypoxanthine	79702544	77091592	80850576	84418424	65136860	70020632	67098532	74064272	78123792	76688848	84268840	83207360	81406624	84693216	63745160	66678920
Imidazole Lactate	4120743	5244727	4177037	5160554	4238863	5712862	5234321	3243314	4012853	4669072	4678726	5628295	4156922	5175123	6611443	6780075
Imidazole Propionate	197468	276863	N	289973	419502	854938	N	481500	311207	264923	406061	294208	251575	498825	346763	284669
Indolelactate	465054	1132194	361272	409717	518849	380619	331831	279951	405697	409425	163133	229511	450109	221610	1013279	841534
Indolepropionate	25175	39536	68708	47589	47166	48389	43680	N	69001	62456	53672	31328	80470	61124	88717	294865
Inosine	335433184	327946272	329590848	379167840	333848704	322277408	305812800	341924384	388069536	364332960	330240160	368729152	362852352	375708128	283346688	307173888
Inosine 5^-Monophosphate (Imp)	39683716	39500680	47158696	34295336	45030128	41103384	45964076	41611748	40315748	40956752	35029336	38670092	37142584	38634336	48719180	51833936
Inositol 1-Phosphate (I1P)	320192	337169	343640	440607	337566	458980	421129	622528	435865	390119	362164	414318	528996	458510	386093	506065
Isobar: Fructose 1-6-Diphosphate- Glucose 1-6-Diphosphate- Myo-Inositol 1-4 Or 1-3-Diphosphate	5280725	4590030	6327262	5318472	6685352	4686195	4470791	4081858	8095677	8280161	5874770	5882825	7333727	5625810	5450134	5906190
Isobutyrylcarnitine	6602739	7558858	6001028	2827186	2387719	5884159	10733169	7742251	5318141	5234396	2847402	5255801	3222295	5572772	9442364	6454115
Isocitrate	1898307	1513793	2238308	1613159	1695472	1809613	1981483	2046895	1817598	2017606	2125401	1958977	1955157	2205772	1519620	1318729
Isoleucine	1195979904	1357636864	1136179456	1088487936	1075281408	1091984384	1293773952	1246182784	1320026368	1293422336	1201857536	1278637312	1165051776	1223951616	1172136192	1136759296
Isoleucylglycine	5273731	5850649	6840608	5692492	7990479	6154535	6207570	5519525	5998017	6486192	9032552	5364600	7942066	6405280	7428226	6022737
Isovalerylglycine	154296	187000	80429	248189	279963	272954	152830	174917	220912	192710	316025	164034	207384	207981	269343	201864
Kynurenine	3497718	4581788	4605340	3314182	4470239	3852549	5067210	5435252	3908439	3920325	4778422	3245269	3618269	3400804	4182898	4550091
Lactate	160303840	169285120	157724160	175090736	206264400	165055632	164173536	139248336	187957056	218422976	261332800	174094464	236542448	194441408	163601216	142035808
Laurylcarnitine	464103	597618	275792	481926	209397	455642	466987	406830	418878	389006	193476	414033	312804	388838	332224	666025
Leucine	1059571392	1079121408	1114760832	1128202496	1122032000	926275968	1061363392	1037413760	1360293504	1212256384	1209641856	1175664384	1405720448	1179220096	1113484800	987208320
Leucylalanine	818120	716463	655803	484253	979385	862919	665576	533161	1018372	723503	1185935	690977	1069005	868217	1120596	906803
Leucylglutamine	209514	300282	156885	205290	242871	401494	185521	137097	178547	222490	387616	189234	267176	285459	273910	253076
Leucylglycine	2400546	2559658	2283489	1535126	3349047	2724369	1973658	1428438	1965032	2345232	3837591	1861854	2342012	2325919	3112397	2329637
Linoleamide (18:2N6)	2079427	651993	938815	12642810	1198391	605493	5133024	28543866	1389775	2158153	1657813	483156	2424539	1903010	1933800	6012844
Linoleate (18:2N6)	2777083392	2375841536	6260062720	7219940864	6592588288	2626740992	4319780352	7839259648	4352093696	3566754304	5959056384	3611042816	3669906432	4854232064	3640896768	3232073984
Linolenate [Alpha Or Gamma; (18:3N3 Or 6)]	138819616	79613024	420883040	642951616	519501824	120077120	181359632	563834496	266552848	173744272	477463456	172319360	220383344	271884832	175774048	138519888
Linoleoylcarnitine	1137480	2808665	1089466	1452797	988030	1235849	916107	1015691	1352120	1123017	815459	1194447	841324	784038	808655	3030082
Lysine	1285001600	1521997568	1441573632	1401888256	1391099008	1413418368	1558022144	1325203200	1354875648	1458379136	1538966144	1484339968	1395165568	1491979648	1453347968	1513134592
Malate	730376064	653212864	667942656	616403200	637834752	720040832	784563456	710453376	712567808	678053376	647442368	716694272	680714176	698754880	717753664	663291136
Maleate	2025901	1118513	1067408	1771482	1012063	1402240	1617965	1407607	1089668	1495263	1579488	1006772	1289365	1580780	1231681	1270375
Malonyl Coa	97811	105400	83364	91143	98082	103102	113789	74158	115174	115293	110675	106404	110767	95664	100459	110008
Malonylcarnitine	111500064	98605232	107034728	111685184	125538560	113738128	116236496	115724056	117019584	120237648	117411240	110925696	109764512	116634696	119243864	119272816
Maltose	1426124	1502719	1705723	3160597	3504064	1332773	1901058	1706053	3634969	2228158	1356787	1806080	2326625	1610019	1496583	2455334
Maltotetraose	395686	487476	611121	1701591	1947555	412380	487291	742184	2846959	1433303	274849	710661	977677	479176	534757	1465416
Maltotriose	3372694	1796914	4354159	10683589	11553118	3173515	4093294	4366015	15124098	9240606	2688396	5328896	7217946	3612007	3748109	7990235
Mannitol/Sorbitol	3695134	3529196	4088716	6136951	5989614	3775099	4083909	3573687	3411225	4356339	6711491	3157715	4152659	3473049	3454526	3243670
Mannose	823601	550692	749847	2006339	2061985	1039743	1056494	1218372	1967016	1483618	646233	1042900	1325520	910204	650067	1052033
Mannose-6-Phosphate	2458727	2485510	4030863	14733304	18512776	3879421	4546650	6496569	17520024	11083664	2182817	7689263	10293227	4784034	3762499	10498689
Margarate (17:0)	63337620	54068388	239428240	223945152	211172784	62082716	82684520	236786816	82779272	63892080	222824400	76460000	82459144	125863376	72829992	70997144
Mead Acid (20:3N9)	43312792	39110904	154692512	158267136	95669144	43789568	55340556	111258768	48719892	54675140	113982736	47312836	45764124	59628516	52661192	45305336
Methionine	236999968	325732544	348728064	244153728	244996464	231881072	215486512	145310128	268988960	231637024	277932288	228819424	286303520	260709504	331350624	228469808
Methionine Sulfone	240649	290991	249226	178648	179962	219822	229819	262876	234919	253155	297088	320460	198852	189319	225324	201583
Methionine Sulfoxide	226411984	265119328	377731200	343454720	347690176	257819920	202088880	230290592	345453504	331468320	348455040	275239168	357086784	265200336	211355984	236276384
Methyl Glucopyranoside (Alpha + Beta)	48284	58541	51691	59055	65931	68142	57691	43742	46612	47164	78056	57831	51725	34730	80627	64120
Methylmalonate (Mma)	62443728	53132136	66013484	56172396	63480680	59315388	46537080	44813680	65975120	64511508	57103504	55963268	65625568	61442464	48884068	58005764
Methylphosphate	418623	466545	486254	578612	463649	522108	469528	472093	448399	494183	536125	479113	413732	447623	546308	591263
Methylsuccinate	2969499	2709310	2529125	2268937	2232289	3181066	3481489	3622774	2674721	2922435	2094811	3060243	2656026	3216919	3109566	3067549
Myo-Inositol	11763311	11878727	10175101	11645556	12183539	12453566	14389025	13854988	12520787	11755547	12827153	11649071	13018797	11518867	13297583	13918831
Myristate (14:0)	170829152	127889200	415055872	450729504	397364864	172952528	184627968	358381408	197679488	161545840	461829632	169669424	198588672	276453792	179569200	172819280
Myristoleate (14:1N5)	13185604	9973543	8456680	13254464	10481558	15935123	14492309	16350886	14346671	10332234	12465172	11193514	12315130	14795586	10927102	10115542
Myristoylcarnitine	1177556	2575563	715698	1034302	414939	1407527	1482266	924121	1074612	903339	586426	1256105	496940	864261	614135	2490519
N-Acetyl-Aspartyl-Glutamate (Naag)	68352	77049	26584	96677	101713	53532	65623	72694	90344	79801	69807	54582	66134	48856	55167	59003
N-Acetylalanine	616065	601397	706306	762484	687428	656932	604151	661563	752717	733545	750234	817090	780808	724288	604607	651471
N-Acetylarginine	908347	1339508	954048	881021	769164	944077	930009	1035753	831433	957952	942060	1000138	689354	907582	1120081	1093600
N-Acetylasparagine	12875809	13294853	14500902	12647025	12601024	12251485	13505756	12654427	13271431	12882552	12255662	13297939	12232612	12389488	12124767	12937282
N-Acetylaspartate (Naa)	723733	428307	514578	532202	523902	952698	469943	503920	701931	598089	1457389	505953	1090202	2125695	487073	502829
N-Acetylglucosamine 6-Phosphate	227183	222152	258197	256471	157068	239689	216578	267588	218222	229171	204052	265574	187359	190135	215873	200338
N-Acetylglucosaminylasparagine	1044070	854741	1141195	1081259	1037839	985298	1056401	1006339	1202499	1136354	1123362	978616	920035	1020521	1046850	975213
N-Acetylglutamate	1550824	846528	1268083	1207638	1492555	979202	1097373	1180599	1510039	1783533	1677756	1425563	1353486	1258314	1178364	811512
N-Acetylglutamine	5696226	8947154	5192549	5961256	4292690	6036181	5412898	4991802	5667671	4384606	4587682	5037405	4237508	4815689	6260714	7244216
N-Acetylglycine	71630	133332	164302	196139	154563	206888	149112	306773	165254	143533	212904	129583	156048	100218	135355	198537
N-Acetylhistamine	N	N	N	N	N	312903	N	N	N	N	N	N	N	N	526636	6010758
N-Acetylhistidine	1409322	2439582	2465669	1276339	999330	1470196	1477831	1270270	1526481	1378874	1770745	1583370	1532356	1075213	1948953	1938320
N-Acetylleucine	94433	79818	109328	128601	141487	75638	75033	85894	142015	113825	195596	85143	172601	92527	101247	87067
N-Acetylmethionine	398250	320838	523200	410755	437906	465747	473504	491176	529116	516793	532019	418974	436147	454462	416926	416303
N-Acetylmethionine Sulfoxide	43778	52318	58231	56919	36555	39231	38800	43732	91330	76912	54184	48323	81996	39867	38330	32924
N-Acetylneuraminate	960881	1020110	1139561	1024135	1081238	919924	746768	784455	1222211	1117952	945970	896475	1092312	1039645	792261	689384
N-Acetylphenylalanine	54610	56030	91562	58003	57531	58192	71876	74130	89250	72181	66593	63688	99709	63721	64452	66070
N-Acetylserine	8188858	7986352	9159676	7765487	8152071	7116795	7927849	9854631	8873186	8403667	7390672	8907753	7168112	7513837	8777966	8042159
N-Acetyltaurine	28766698	22756048	22403556	35291640	17451194	28200416	26728744	28707470	18583300	27633134	25938616	20798666	24434054	26494666	22017920	25733650
N-Acetylthreonine	928135	919344	967232	991720	1020282	994830	953382	1020203	1027277	1113420	1107038	1245065	1067617	1064553	1027872	1051672
N-Alpha-Acetylornithine	475281	728978	485549	503076	545814	423562	851024	750306	754433	656236	945984	573988	638589	572158	479792	813990
N-Delta-Acetylornithine	8179354	13308047	6145163	7177461	7482443	12195467	9309282	7671786	5808802	6900975	10919587	5346810	6683208	8295122	13282423	10388504
N-Formylmethionine	937438	1095754	916189	997559	956448	1070961	1043551	829323	958461	1155503	1058150	946842	944711	922318	1118136	1095721
N-Formylphenylalanine	96630	102319	111196	82241	70920	85769	107011	138404	157328	119902	94993	114097	142470	104915	97132	90416
N-Glycolylneuraminate	12692476	12509138	9492249	9685067	14267314	11277278	12841125	12656965	14772480	15111899	13193860	9217067	11925376	10770931	10723712	11233773
N-Methylproline	2735673	3401241	2687252	1711246	2721186	3519006	1828067	1812049	2828012	1989945	3292451	2111954	3078110	2821058	2917362	1481913
N-Monomethylarginine	6384640	7782089	12831784	7876200	9283796	8424977	9224271	9294602	8105433	10366976	7725000	8438896	7953692	9056962	9137679	9745323
N-Oleoyltaurine	1901846	1748842	5388473	6279638	4682115	1598296	3435941	8183593	1711858	1879292	4652430	1769285	1610420	2848970	1885950	1727555
N-Palmitoyl-Sphinganine (D18:0/16:0)	1858023	1730376	2550933	2425252	2250752	2126321	1513442	1920316	1937592	2097498	2269014	1664573	2777249	2761211	1363344	1606535
N-Palmitoyl-Sphingosine (D18:1/16:0)	41614696	36160304	56658480	49859244	45695500	47301760	38637880	43185008	41634376	48905716	47496432	41733576	56641072	59123996	31804418	35803560
N-Palmitoyltaurine	2212248	1928906	7020107	7624736	5848566	2130563	3491475	13929711	1938332	2044970	5256305	1482714	1654906	3638385	1979511	2071674
N-Stearoyltaurine	2850898	2539389	15503577	12888883	12104131	2722644	5342784	15343517	3102474	2658069	10733900	3307786	2798056	6260585	2668776	3124062
N1-Methyl-2-Pyridone-5-Carboxamide	6981014	12658989	9020258	6132001	4970735	5195335	14224470	13388682	9796202	12411691	7518171	10142148	4541409	6222871	9173818	10199954
N1-Methyladenosine	4275816	4519017	4286492	4546849	4741484	4190503	5087358	4633997	5204331	5127355	4584610	4355455	2837800	3142991	3410547	4107773
N2-N2-Dimethylguanosine	N	230728	243445	196053	176119	N	305100	N	303255	232617	174475	251727	156650	162859	159031	N
N4-Acetylcytidine	101164	99307	106980	157044	176559	102992	162342	98558	167796	153656	152297	114609	N	49227	142664	181642
N6-N6-N6-Trimethyllysine	83382256	95741744	100736800	77328728	95411880	91974568	110832288	104846272	89811760	91796224	111596352	109568512	112898080	110774256	99536952	96172880
N6-Acetyllysine	98420	156444	89321	90035	99716	132241	143131	109917	107329	134652	100255	131126	117432	108790	120927	150443
N6-Carboxyethyllysine	13102621	13387408	12845008	10456898	13288867	13687254	17615608	13825404	13095627	13513460	13745015	13801129	14065402	14440613	17183168	14752471
N6-Carboxymethyllysine	150950016	91797352	185002656	112339928	173271136	102289352	187643280	188939680	172752288	168227536	189229648	188617296	175999392	182874960	126991368	115056464
N6-Succinyladenosine	7428035	5024544	3295892	4287953	3064982	7237151	5382630	3620615	3218074	6063954	7133453	4120106	3364547	3554005	7136871	5149317
Nicotinamide	2683474432	2691494400	2158799360	2781582848	2229599232	2830827008	2160361472	2119646080	2124904960	2595325696	2524864768	2065760896	2246045184	2191828736	2826334464	2813381120
Nicotinamide Adenine Dinucleotide (Nad+)	227509	259716	268025	204517	201474	243198	242758	217347	205715	245230	250594	257755	261188	253827	256875	250681
Nicotinamide Ribonucleotide (Nmn)	509679	423504	352866	240670	410195	630239	1270636	494512	297797	349141	367069	348031	316835	467814	1754372	1334211
Nicotinamide Riboside	844859	676844	366953	606202	705885	1291045	1064514	581945	667792	964175	716171	651638	487846	883791	939881	821238
Nonadecanoate (19:0)	24135584	20927636	93973856	100166352	86039672	22831500	33370266	109852880	27295828	24966456	73548616	29556786	22813612	37577600	25388964	26480502
Oleamide	8661317	3364850	2833111	58580784	4319832	2710182	20130820	132457928	5108384	10229449	6358989	1257842	12907892	7667568	8923847	29627392
Oleate/Vaccenate (18:1)	2798185984	2013832832	5898397696	7541292032	5844598784	2560882432	4499459584	7380605952	4085334528	3272438528	6549416448	3670712064	3378224384	4595817984	3419597824	2896989184
Oleoyl Ethanolamide	4277322	3618061	20375132	13549232	12439391	3739646	5745519	16355547	4118811	3856344	12415657	4438514	3351258	6482554	3662217	4296425
Oleoylcarnitine	3028133	9061254	2254045	3128072	1656939	3304105	2639276	2268499	2580314	2847863	1733868	3726500	1596169	1861051	1898903	9838355
Ophthalmate	2061878	2800678	3508625	2413350	3292564	1984390	3172545	2668448	3264696	2710289	3014630	2285603	2557766	2414493	2323989	3291176
Ornithine	57541900	101990656	93001320	80106552	60279968	50744448	45578268	51916328	62292248	71567376	81727704	50888728	73958296	55291232	78016904	70195472
Orotate	2761962	2916531	3702840	4312928	3559158	3356804	3568131	3765339	2971002	3136994	3053729	2885226	3417360	3173097	2754394	2712190
Orotidine	1825249	2010488	1790710	2010329	1975660	2101018	2320765	2074371	2203809	1896100	1898930	1606428	2108279	2408728	1817381	1861710
P-Cresol Sulfate	N	N	N	N	N	392340	909099	N	N	N	511373	N	670246	26145	1123717	40849
Palmitate (16:0)	2479848192	1976049280	5910657024	6076331008	5820393984	2279059712	3457133056	5614498304	3261829120	2720088064	5729438720	2915234560	2922718464	3953082112	2793148160	2659876864
Palmitoleate (16:1N7)	344158880	141867120	614859328	1098674176	735469504	300748288	376960640	767184384	443385824	311076768	1071760512	321889152	433943680	528443200	301999776	255350992
Palmitoyl Dihydrosphingomyelin (D18:0/16:0)	14675656	15775138	18476684	15991387	17930816	15871059	15087900	18498084	15225194	17026584	16504579	14787359	17829948	19266440	14801881	14911182
Palmitoyl Ethanolamide	4051212	3725191	22457680	15938101	14535184	3991806	4992327	18063702	4674202	4227141	12098491	4344284	3733513	6944968	3485610	3916347
Palmitoyl Sphingomyelin (D18:1/16:0)	2763981	2331951	2632531	2860568	3355731	2531673	2516548	2445867	3186169	2358304	4044647	2292563	2509227	2661749	3421369	2711226
Palmitoylcarnitine	6316169	13700580	4198105	5433848	4294521	8119352	5330743	5207708	5483889	6093486	3785013	5754579	3240777	3821317	3486214	13150025
Palmitoylcholine	7359794	10489548	12833967	8014570	6824227	8377783	8102449	7342312	4109869	7047820	7082409	6257243	6044661	7136600	6346272	9284913
Pantothenate	74741016	77611088	65546628	87464368	73540656	76473792	72164784	75181928	80283344	73159768	69361232	84235768	78551560	84360048	68491400	69296112
Pentadecanoate (15:0)	54219276	55232648	118394184	86893216	114184712	59932320	63897404	103928176	56801160	50076928	103443952	62279256	63255836	80845088	57755696	58088920
Phenol Sulfate	1177861	961402	1095158	1923142	3560185	5152454	936811	1229247	1543591	729456	897243	639008	2446224	4466051	1616402	2935681
Phenylacetylglycine	3566226	3764204	1041013	4674729	5560389	13939669	3077746	3687378	2478835	1940137	3040816	2450334	6503790	8296931	6314698	11380843
Phenylalanine	1202059392	1273380736	1597007232	1285000320	1179417216	1192556288	1160562048	1204578688	1399556480	1359974272	1354348928	1224424960	1410529664	1291480832	1212564224	1180101760
Phenylalanylalanine	1031968	810508	650719	771525	1121273	980513	791351	680287	1143675	1158852	1572367	863898	1274273	1062233	1327837	986305
Phenylalanylglycine	1039812	1129481	1601460	1433601	1452269	1194931	899361	1133450	1158811	1565825	1728246	1100813	1224182	1060954	1288030	1017353
Phenyllactate (Pla)	47004	37493	67842	68964	92749	46560	56224	48999	75408	75856	65504	41332	80652	84664	61002	42898
Phosphate	266200240	254712832	259446960	228357152	207631552	257487424	260991936	261015744	210991216	231307440	269953728	246338784	247529904	267554224	258978688	242437616
Phosphoenolpyruvate (Pep)	3315668	2941726	3827610	2981631	5358347	2959974	2486300	2354859	4450811	4325027	4149957	3258862	3222736	4005706	3179774	2058156
Phosphoethanolamine	6540964	5493311	7533115	5966972	5654215	5434782	7303704	8681235	7340451	7599376	6291995	8538953	5584398	6730090	6253699	8212462
Phosphopantetheine	404926	440059	447224	260251	405552	498144	637280	355855	194746	334549	314955	288423	259485	344144	1059658	515428
Phytosphingosine	266794	278524	362405	241219	245218	248729	291867	248173	258408	294373	311923	272577	316716	230136	334939	263914
Pipecolate	98207232	136442240	76509632	124375576	129204904	125833800	121061560	99598240	111400624	106274984	114255104	91626344	93850480	116575968	168813248	1530882304
Pro-Hydroxy-Pro	3034339	5354379	2882169	2561376	2383654	2959948	2464897	3196059	3077054	2442346	2897779	3031175	2212197	2055630	3861854	3781995
Proline	904889600	1200432896	1393059712	1491499776	1236305920	900700160	854720960	947124928	1192460288	1130754688	1316906112	1040487104	1344683008	1042480064	1062539520	1047756864
Prolylglutamine	2183388	2306729	1815123	1796758	2584954	2066436	4118870	2636502	2342768	1394364	2456970	2220839	2114864	2056094	3363066	3370223
Prolylglycine	9008700	11749108	11550126	10105261	9161377	10439592	19157628	14543792	11552190	15292492	12809755	14330404	10514045	12374683	12126208	14720611
Propionylcarnitine	179968720	213832992	177187456	193196336	249428960	258545600	204914368	217599376	209244368	243675616	326869408	200466288	303780160	250683568	208452864	201157488
Pseudouridine	2511284	3648321	2655744	3084026	3449474	2920587	3691260	3589742	2749110	2887880	2989983	2799488	2157544	2479780	3156583	3239955
Pterin	28354	24584	25646	26091	31045	30418	26164	20107	25508	28080	29632	27267	28706	22068	N	20404
Putrescine	1017474	852410	1679734	1109235	1678359	1444742	1155600	1304596	1710169	1621338	1316223	1280487	985569	1104349	1172409	1146380
Pyridoxal	388873	661725	677934	565361	685588	345841	380652	365092	636069	644521	374353	413894	280601	356696	616735	546522
Pyridoxal Phosphate	881814	728517	733589	730745	682433	866818	861764	830885	860041	753010	675029	916198	952325	885268	952625	901425
Pyridoxamine Phosphate	4216831	4464204	2740699	3282711	3313033	4469944	3226651	2823062	2605040	3817623	3502849	2760721	3223156	2729969	4877471	3503048
Pyridoxate	59726	41869	130133	89377	142123	113126	60943	67933	76528	137503	146832	245248	159024	124884	122359	156917
Pyroglutamine	7508875	7046776	8175517	9108604	8000123	7338199	7977944	8570987	7603108	8936490	7783846	6754389	6256552	7532058	6748116	7076977
Pyrraline	157091	174638	248611	151353	283394	251205	185211	132369	456446	224195	171127	N	N	85137	162913	261777
Pyruvate	25366042	21995826	23030978	26384104	23163494	24779486	23285704	25035972	20334820	19330454	17144392	14099500	16626210	15628334	19982710	16008672
Retinol (Vitamin A)	258902	3098419	273982	696195	N	348474	N	255903	264527	N	N	1038013	N	N	N	3581807
Ribitol	411468	496661	429092	526078	482830	417439	469271	447208	429111	390097	361697	408318	422859	492976	334897	367456
Riboflavin (Vitamin B2)	951008	889499	1051143	1146851	1000182	1416313	1166208	1260352	673876	839255	856679	1129784	874887	1169410	1073642	1277720
Ribonate	3926374	3626442	3146001	3353850	3925275	3654007	3459188	2903022	4658526	5090883	3604889	3121312	3819300	4456693	3280226	3247542
Ribose	1251177	1437143	1940258	2105936	1717030	1228087	1004353	1442569	2120038	1672731	1114888	1579197	1669924	1475911	452908	938917
Ribose 1-Phosphate	17877392	17483536	20448012	33294056	20174468	20856828	23717370	33261312	24762940	23440794	15726331	22586180	24593936	23760432	20212178	23278684
Ribulose/Xylulose	1221388	1326545	1633081	1486151	1015515	1124218	722954	1039733	1177517	997778	941970	1270137	1243335	1305145	538856	806420
S-Adenosylhomocysteine (Sah)	2825323	2797386	2584520	2352407	2181659	2695929	2677422	2686859	2967729	2847882	2262658	2514893	2946013	2827047	2888419	2863064
S-Adenosylmethionine (Sam)	16027982	16883912	16964292	18930872	17425640	17777972	15754017	14306605	15420604	17572120	18900414	14939273	16740455	15531664	16411305	16479304
S-Lactoylglutathione	1254375	1336648	1516172	1873934	2152685	1789058	1477861	1578687	1541153	1796395	1830684	1685370	1769764	1570018	1480508	1748443
S-Methylcysteine	2045020	1778499	1749321	1555921	1447365	1112655	1823679	2297531	1469560	1958350	1680273	1453152	1456759	1301717	1706030	1506467
S-Methylglutathione	816618	825190	872042	930272	907763	870332	831295	664330	898475	962969	932351	712482	893993	896271	912617	693115
Sarcosine (N-Methylglycine)	1622549	N	1967875	1373189	2457544	1406076	1432318	926564	1589375	1830233	2658975	1349373	1452584	1770746	1429288	2237777
Sedoheptulose-7-Phosphate	3282481	3654899	3578037	7579236	7494251	3710435	3422763	4685686	8067932	6274934	3006178	5167355	5745305	4763111	2877898	5269598
Serine	431663424	514569056	574135360	618046464	572783936	544166912	452446080	463388416	641932224	583051840	584866816	532691968	536290368	534642272	562445440	543327872
Spermidine	11772733	12097557	11243915	20709280	6892454	8890736	6881133	9215162	27879948	6734978	10749575	15970962	7058639	6827452	6532138	7553083
Sphinganine	1864418	1744704	2091212	2087460	2915428	2605172	1837629	1747942	1272239	1664998	2257959	1311418	1952300	1922006	1757294	1579457
Sphingomyelin (D18:1/14:0- D16:1/16:0)	1559973	1880697	1993214	3350079	1193989	1636330	1335660	1654080	1259969	1536302	1375770	1708056	1367560	1536871	1378328	1913893
Sphingomyelin (D18:1/15:0- D16:1/17:0)	5120679	6930007	6366848	6030237	4721317	5935469	4972506	5314566	4222022	5937025	4933042	4877944	4787596	5509811	4972601	6963215
Sphingomyelin (D18:1/17:0- D17:1/18:0- D19:1/16:0)	7105586	7234554	9546745	7565589	6684917	8883310	6863862	6945373	5092875	7677742	7989802	5635065	6794335	8378642	7541667	7593011
Sphingomyelin (D18:1/18:1- D18:2/18:0)	10079410	7943682	12234954	10017867	8676914	10259296	8826888	10095247	7541999	8758465	9815309	9904595	9823515	10992492	8531156	9198299
Sphingomyelin (D18:1/20:0- D16:1/22:0)	222214928	227409328	227296896	221193616	225103920	276115680	220750208	206123376	174730848	263247104	283169376	203821376	246569840	241431136	238638240	235695168
Sphingomyelin (D18:1/20:1- D18:2/20:0)	60670548	52171072	46411480	57584496	59480288	65717000	55973208	60300520	47068232	63790764	66952660	56104568	69274552	65334672	65523188	54474352
Sphingomyelin (D18:1/21:0- D17:1/22:0- D16:1/23:0)	132178544	107847152	155634000	118802184	130100224	205979872	129123944	118480384	73080616	145904384	165387856	107582832	151022224	174646528	104179832	130523968
Sphingomyelin (D18:1/22:1- D18:2/22:0- D16:1/24:1)	54375904	63231332	42484032	56563544	54156464	67293128	52869620	50878192	41674920	61173992	59528748	47956156	61069748	61474728	58347584	63255776
Sphingomyelin (D18:1/24:1- D18:2/24:0)	111397272	130852456	114247576	120040008	113031000	128372064	110491520	104000632	94292272	114239056	128353120	106490248	115305104	124292984	109068416	140026288
Sphingomyelin (D18:2/16:0- D18:1/16:1)	10762267	17128810	11081706	14740883	9830686	11318083	9592149	10491985	10146510	11544692	11162074	11750039	11051465	11159342	9752444	17324888
Sphingomyelin (D18:2/23:0- D18:1/23:1- D17:1/24:1)	29067932	30247076	33681980	28645402	34836856	39842120	32279994	31732702	21753100	31209456	34373556	29102032	39800844	43819324	26383456	31638444
Sphingomyelin (D18:2/24:1- D18:1/24:2)	31623110	39341872	35369128	36497108	32345232	37135812	29975192	29378620	25911604	33895408	36159840	30486490	33606056	35603540	31704886	41319980
Sphingosine	8308195	9754348	12227536	9122972	9671250	9318180	9260496	9507558	7869071	10597311	10518748	8734805	9292495	9281630	9105544	8627557
Sphingosine 1-Phosphate	173380	1329074	271715	174457	129442	166129	346171	136857	221891	N	N	284736	N	N	568824	1116748
Stachydrine	23317490	26496920	35824812	27475280	35332124	47929624	23523208	24236414	33308218	31040192	46161680	29812814	37272824	31089044	52567104	48765288
Stearate (18:0)	2132684672	1872177920	5313076224	4716478464	4869925376	1991449728	2528403712	5184550912	2282401024	2090849408	4503444992	2316277504	1868832384	3046195200	2170425088	2182948096
Stearidonate (18:4N3)	3458990	2592799	3219466	8330828	6309168	3155421	4626089	15438246	6069724	5141939	6401234	4264093	2791568	3958391	2555033	2782693
Stearoyl Ethanolamide	2246433	2240440	3837227	2337368	2417288	2552135	2508373	2570481	2084706	2542002	2360588	2426740	2588573	2635812	2078995	2206018
Stearoyl Sphingomyelin (D18:1/18:0)	164840800	135507792	172887584	157989264	115916392	189215664	125152720	126526168	95487224	161747616	180262208	116342536	126114032	144315936	145942384	148638976
Stearoylcarnitine	1807530	3267508	1634992	1548771	1338413	2050867	1726939	1575776	791333	1269847	1497056	1574539	1359659	1642097	1520118	2850699
Succinylcarnitine	296440800	271712832	311036288	272242688	279868064	295877984	350592768	332755168	308817984	314095296	270303104	323775904	292080576	296010336	286018496	286211328
Sulfate	16716970	13404134	17994336	10413112	10245622	13489492	13676328	9274277	8214611	14733024	12005506	11751561	8282372	8284350	22138468	18991424
Sulforaphane-Cysteine-Glycine	385205	496098	661119	600452	492411	512541	240760	N	788081	512750	386292	420486	517915	N	N	333136
Tartronate (Hydroxymalonate)	2002317	1676852	1814218	1847152	2050344	1914585	1928360	1805441	1868962	1920862	1989920	1930905	2022870	2220670	2105357	1966327
Taurine	3241902080	3441291264	3332109568	3372906240	3428731136	3474786560	3371099904	3461634048	3214051072	3248602880	3388157696	3268885248	3278580480	3289032192	3412794624	3480100352
Tauro-Beta-Muricholate	N	575837	17661644	716275	N	50924	53560	N	N	N	544689	N	N	119927	N	N
Taurocholate	36220	894577	20120120	1091425	N	N	74664	N	N	57887	958601	N	N	204092	N	N
Taurocyamine	6057129	5885139	4311307	7276842	6254191	5032714	5889663	6381478	6918592	6846238	5795677	7112906	5256482	4956828	5120304	5187664
Thiamin (Vitamin B1)	160427	160243	194770	202285	196685	157590	130413	145250	182487	184244	156109	140457	160228	170720	145544	146572
Thiamin Diphosphate	696626	747153	527512	626623	694855	783890	816516	627832	695497	775038	726474	620409	808381	635948	898266	848977
Thiamin Monophosphate	79356720	77018936	81726160	86332600	90173472	86383512	78521472	79564784	85365360	86648056	83553880	78579136	79376992	84600648	74867000	78172520
Threonate	142387904	138976544	148308624	134546048	145302160	158356160	165130304	155316096	138315968	145544320	142374848	145136864	141090400	158257216	177526032	178201696
Threonine	501635392	603680256	545820096	562113600	556928640	556469888	557027648	464084768	604766208	578415360	630728576	648937088	613853120	541267072	570132224	560590912
Thymidine	1805580	1943222	2043914	1998739	2221500	1700053	1447787	1607906	1972581	2034338	1625605	1410872	1851378	1662210	1488586	1644973
Thymidine 5^-Monophosphate	393014	382570	344128	264545	242278	351140	316363	323319	400172	365071	222642	360012	292686	330982	333056	362520
Thymine	62555	67520	76421	74054	67318	52720	39557	50378	70604	52643	67404	37511	57478	57385	47638	41540
Tiglylcarnitine	3435536	3821438	5090842	3437121	3868779	4109924	4461715	5322314	3307637	4064371	4816894	3111807	3945520	3771698	3949126	4132841
Trans-4-Hydroxyproline	217762848	293571360	196790784	346861120	260012080	294730784	269270176	265186800	286930560	328171136	258117184	252410976	208853344	235374864	336380736	354846080
Tricarballylate	1992888	1586886	1802752	2092597	1878837	1835856	1540802	1827529	1306662	1573868	1291362	1405845	1291977	1419706	1401404	1490151
Trigonelline (N^-Methylnicotinate)	16181945	16386250	13080635	18166334	17288054	15283852	11937023	12249685	23179448	19541528	18674606	16298811	18531666	16399165	21207606	17322340
Trimethylamine N-Oxide	5092343	4469268	3707054	10595605	10839098	6509843	6200745	7911236	12094630	7442162	7191152	5682976	9508974	5116374	8510661	6317825
Tryptophan	7359414	8326331	9517732	6751824	7622857	7445848	7452010	8022190	6746366	7951686	6799261	6860266	8377616	7294428	7480673	8496678
Tyrosine	892790464	1121776128	1298402432	1112652800	879834880	957858368	697410048	773381504	921931584	975761792	1238166016	789528320	1088274816	780978304	947870016	1031299136
Udp-Galactose	150034	172817	131578	129698	129628	155312	188200	137051	158414	133028	128307	177898	177692	138370	159812	138423
Udp-Glucose	134510	57774	100306	86511	73354	68586	69104	60879	67917	85611	136734	48536	50206	94592	61848	57763
Udp-Glucuronate	134003	143533	210056	199688	211281	192700	160976	208486	192695	160081	119227	197539	179215	177382	176603	181457
Uracil	15825154	18934044	18070068	20418596	20251092	18375640	17251220	18339232	19073852	17770536	17010556	16827660	18396184	21841062	16751412	15898084
Urate	12100426	13330635	8267813	4375660	3295745	7536273	11094101	12333615	6620194	6061626	6926664	7367824	7623982	8570559	17676594	15090353
Urea	81203776	125724576	71360792	110804720	108097664	110030648	91506600	83441776	79609416	90372096	99445096	77685096	101379344	82800176	126434960	131266040
Uridine	30630024	31525418	33142688	35215896	38501664	28048492	31435856	34173280	42713144	36460124	31758772	39596604	39811448	34827672	30270106	32768584
Uridine 5^-Monophosphate (Ump)	13190014	14333428	16584811	11022135	13833850	14404926	15051311	13362791	12151990	12937932	12486948	12413218	10068202	11119618	19072012	20807116
Valine	398833728	487703136	386043680	393652032	359531136	372461792	439437536	408292576	480332032	446934496	427325888	460287648	436924704	431406848	414300416	395130304
Valylglutamine	595692	685264	255707	324061	889849	957992	314883	245287	392633	708304	1143687	463995	699952	552004	1045937	532462
Valylglycine	2974346	3760940	4283963	3793701	4714120	4756452	3140821	3108915	3057558	4056315	5934601	2998337	4414482	3766891	5143387	4403886
Valylleucine	516592	550787	299207	327086	674350	567527	394511	296283	416378	573444	743136	430798	639716	527021	688701	457056
Xanthine	226842672	216305504	232126768	272591456	223461536	218514160	207172000	249378576	250881904	246629488	242117504	221642208	227259120	224429952	187662800	198643312
Xanthosine	842173	751349	461033	1296722	903624	826942	309660	773483	527594	1001852	737532	490380	847426	572580	432026	721047
Xanthosine 5^-Monophosphate (Xmp)	1334833	1561602	1774483	1598757	1564117	1448162	1663891	1485271	2053538	1821777	1586962	1533589	1591656	1333969	1233759	1123656
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	retention index	quantified m/z	PubChem ID	KEGG ID
1-2-Dilinoleoyl-Gpc (18:2/18:2)	2006		5288075
1-2-Dioleoyl-Gpc (18:1/18:1)	2346		10350317
1-2-Dioleoyl-Gpe (18:1/18:1)	2485		9546757
1-2-Dipalmitoyl-Gpc (16:0/16:0)	2365		452110
1-2-Distearoyl-Gpc (18:0/18:0)	3066		94190
1-5-Anhydroglucitol (1-5-Ag)	802		64960
1-(1-Enyl-Oleoyl)-Gpe (P-18:1)	1566
1-(1-Enyl-Palmitoyl)-2-Arachidonoyl-Gpc (P-16:0/20:4)	2154
1-(1-Enyl-Palmitoyl)-2-Arachidonoyl-Gpe (P-16:0/20:4)	2270
1-(1-Enyl-Palmitoyl)-2-Linoleoyl-Gpc (P-16:0/18:2)	2226
1-(1-Enyl-Palmitoyl)-2-Linoleoyl-Gpe (P-16:0/18:2)	2351
1-(1-Enyl-Palmitoyl)-2-Oleoyl-Gpc (P-16:0/18:1)	2443
1-(1-Enyl-Palmitoyl)-2-Oleoyl-Gpe (P-16:0/18:1)	2600
1-(1-Enyl-Palmitoyl)-2-Palmitoyl-Gpc (P-16:0/16:0)	2454		11146967
1-(1-Enyl-Palmitoyl)-Gpc (P-16:0)	1547		10917802
1-(1-Enyl-Palmitoyl)-Gpe (P-16:0)	1558
1-(1-Enyl-Stearoyl)-2-Arachidonoyl-Gpe (P-18:0/20:4)	2511		9547058
1-(1-Enyl-Stearoyl)-2-Linoleoyl-Gpe (P-18:0/18:2)	2633
1-(1-Enyl-Stearoyl)-2-Oleoyl-Gpe (P-18:0/18:1)	2950
1-(1-Enyl-Stearoyl)-Gpe (P-18:0)	6500
1-Arachidonoyl-Gpc (20:4)	1460
1-Arachidonoyl-Gpe (20:4)	1450		42607465
1-Arachidonoyl-Gpi (20:4)	5482
1-Arachidonylglycerol (20:4)	6450		5282281
1-Dihomo-Linolenylglycerol (20:3)	6220
1-Dihomo-Linoleoylglycerol (20:2)	6800
1-Docosahexaenoylglycerol (22:6)	6150
1-Lignoceroyl-Gpc (24:0)	1907
1-Linolenoyl-Gpc (18:3)	1422
1-Linoleoyl-2-Arachidonoyl-Gpc (18:2/20:4)	1969
1-Linoleoyl-Gpc (18:2)	1465		11988421
1-Linoleoyl-Gpe (18:2)	1482		52925130
1-Linoleoyl-Gpi (18:2)	5494
1-Linoleoylglycerol (18:2)	6477		5283469
1-Methylguanidine	2149		10111
1-Methylhistidine	2755		92105
1-Methylimidazoleacetate	2064		75810
1-Methylnicotinamide	1940		10129985
1-Myristoylglycerol (14:0)	6353.3		79050
1-Oleoyl-2-Linoleoyl-Glycerol (18:1/18:2)	3115
1-Oleoyl-2-Linoleoyl-Gpc (18:1/18:2)	2165
1-Oleoyl-2-Linoleoyl-Gpe (18:1/18:2)	2270		9546753
1-Oleoyl-3-Linoleoyl-Glycerol (18:1/18:2)	3223
1-Oleoyl-Gpc (18:1)	1540		16081932
1-Oleoyl-Gpe (18:1)	1554		9547071
1-Oleoyl-Gpg (18:1)	5610
1-Oleoyl-Gpi (18:1)	5599
1-Oleoylglycerol (18:1)	6300		5283468
1-Palmitoleoyl-2-Linoleoyl-Gpc (16:1/18:2)	2003
1-Palmitoleoyl-Gpc (16:1)	1450		24779461
1-Palmitoleoylglycerol (16:1)	6094
1-Palmitoyl-2-Arachidonoyl-Gpc (16:0/20:4)	2091		10747814
1-Palmitoyl-2-Arachidonoyl-Gpe (16:0/20:4)	2198		9546800
1-Palmitoyl-2-Linolenoyl-Gpg (16:0/18:3)	728
1-Palmitoyl-2-Linoleoyl-Glycerol (16:0/18:2)	3080		9543695
1-Palmitoyl-2-Linoleoyl-Gpc (16:0/18:2)	2160		5287971
1-Palmitoyl-2-Linoleoyl-Gpe (16:0/18:2)	2275		9546747
1-Palmitoyl-2-Linoleoyl-Gpg (16:0/18:2)	717
1-Palmitoyl-2-Oleoyl-Gpc (16:0/18:1)	2358		6436017
1-Palmitoyl-2-Oleoyl-Gpe (16:0/18:1)	2509		5283496
1-Palmitoyl-2-Oleoyl-Gpg (16:0/18:1)	745		5283509
1-Palmitoyl-2-Palmitoleoyl-Gpc (16:0/16:1)	2160
1-Palmitoyl-2-Stearoyl-Gpc (16:0/18:0)	2653
1-Palmitoyl-Gpc (16:0)	1525		86554
1-Palmitoyl-Gpe (16:0)	1544		9547069
1-Palmitoyl-Gpg (16:0)	5570		3300276
1-Palmitoyl-Gpi (16:0)	5564
1-Palmitoylglycerol (16:0)	6400		14900
1-Stearoyl-2-Arachidonoyl-Gpc (18:0/20:4)	2300		16219824
1-Stearoyl-2-Arachidonoyl-Gpe (18:0/20:4)	2424		5289133
1-Stearoyl-2-Arachidonoyl-Gpi (18:0/20:4)	870
1-Stearoyl-2-Arachidonoyl-Gps (18:0/20:4)	2565
1-Stearoyl-2-Linoleoyl-Gpc (18:0/18:2)	2380
1-Stearoyl-2-Linoleoyl-Gpe (18:0/18:2)	2522		9546749
1-Stearoyl-2-Oleoyl-Gpc (18:0/18:1)	2644
1-Stearoyl-2-Oleoyl-Gpe (18:0/18:1)	2858
1-Stearoyl-Gpc (18:0)	1606		497299
1-Stearoyl-Gpe (18:0)	1626		9547068
1-Stearoyl-Gpg (18:0)	5816
1-Stearoyl-Gpi (18:0)	5794.3
1-Stearoyl-Gps (18:0)	5800		9547101
10-Heptadecenoate (17:1N7)	5555		5312435
10-Nonadecenoate (19:1N9)	5780		5312513
12-13-Dihome	5137		10236635
12-Hete	5326		5312983
13-Hode + 9-Hode	5275		43013
14-Hdohe/17-Hdohe	5296
15-Methylpalmitate	5695		17903417
17-Methylstearate	5993		3083779
2^-Deoxyadenosine 5^-Monophosphate	1315		12599
2^-Deoxycytidine	2193		13711
2^-Deoxyguanosine	1751		187790
2^-Deoxyinosine	1688		65058
2^-Deoxyuridine	1586		13712
2-Aminoadipate	1912		469
2-Aminoheptanoate	3160		227939
2-Aminooctanoate	750		69522
2-Aminophenol Sulfate	1677		181670
2-Arachidonoylglycerol (20:4)	6170		5282280
2-Docosahexaenoylglycerol (22:6)	6000
2-Hydroxy-3-Methylvalerate	1800		164623
2-Hydroxyadipate	3000		193530
2-Hydroxybutyrate/2-Hydroxyisobutyrate	1258
2-Hydroxydecanoate	4840		21488
2-Hydroxyglutarate	3352.8		43
2-Hydroxyoctanoate	3736.8		94180
2-Hydroxystearate	5695		69417
2-Linoleoylglycerol (18:2)	6250		5365676
2-Methylcitrate/Homocitrate	575
2-Methylmalonyl Carnitine	2440		53481628
2-Oleoylglycerol (18:1)	6200		5319879
2-Palmitoleoyl-Gpc (16:1)	1425
2-Palmitoleoylglycerol (16:1)	6016
2-Palmitoyl-Gpc (16:0)	1505		15061532
2-Palmitoylglycerol (16:0)	6200		123409
2-Phosphoglycerate	4346		59
2-Piperidinone	1675		12665
3^-Dephosphocoenzyme A	2013		444485
3-(3-Hydroxyphenyl)Propionate Sulfate	1294		187488
3-(4-Hydroxyphenyl)Lactate	1379		9378
3-(4-Hydroxyphenyl)Propionate	1670		10394
3-Aminoisobutyrate	2215		64956
3-Hydroxy-3-Methylglutarate	2700		1662
3-Hydroxybutyrate (Bhba)	1443.3		441
3-Hydroxybutyryl Coa	1715		521
3-Hydroxybutyrylcarnitine (1)	2400		53481617
3-Hydroxybutyrylcarnitine (2)	2340
3-Hydroxydecanoate	4634.7		26612
3-Hydroxyisobutyrate	1619.1		87
3-Hydroxylaurate	5175		94216
3-Hydroxymyristate	5335		16064
3-Hydroxyoctanoate	3446		26613
3-Hydroxypalmitate	5476		301590
3-Hydroxystearate	5674		5282907
3-Indoxyl Sulfate	2222.2		10258
3-Methylhistidine	2670		64969
3-Phosphoglycerate	4410		724
3-Ureidopropionate	875		111
4-Cholesten-3-One	2520		91477
4-Guanidinobutanoate	2320		500
4-Hydroxy-2-Nonenal	4745		1693
4-Hydroxy-Nonenal-Glutathione	3319.2
4-Hydroxybutyrate (Ghb)	1765		10413
4-Hydroxyglutamate	1141		439902
4-Hydroxyphenylpyruvate	1690.1		979
4-Imidazoleacetate	2055		96215
4-Vinylphenol Sulfate	3320		6426766
5-(2-Hydroxyethyl)-4-Methylthiazole	2310		1136
5-Aminovalerate	2220		138
5-Dodecenoate (12:1N7)	5224		5312378
5-Hydroxylysine	2790		1029
5-Methyl-2^-Deoxycytidine	2303		440055
5-Methylcytidine	2227		92918
5-Methylthioadenosine (Mta)	2752		439176
5-Oxoproline	738.5		7405
6-Phosphogluconate	583.9		91493
7-Hydroxycholesterol (Alpha Or Beta)	1930
7-Methylguanine	2175		11361
8-Hydroxyoctanoate	2300.4		69820
9-10-Dihome	5180		9966640
Acetyl Coa	1691		444493
Acetylcarnitine	2282		1
Acetylcholine	2220
Acetylphosphate	4013.9		186
Adenine	2221		190
Adenosine	2169		60961
Adenosine 2^-Monophosphate (2^-Amp)	1497.7		94136
Adenosine 3^-5^-Cyclic Monophosphate (Camp)	1952.2		6076
Adenosine 3^-5^-Diphosphate	575		159296
Adenosine 3^-Monophosphate (3^-Amp)	1245		41211
Adenosine 5^-Diphosphate (Adp)	680		6022
Adenosine 5^-Diphosphoribose (Adp-Ribose)	553		192
Adenosine 5^-Monophosphate (Amp)	1013		6083
Adenosine 5^-Triphosphate (Atp)	.
Adenylosuccinate	560		195
Adrenate (22:4N6)	5678		5497181
Aica Ribonucleotide	797		65110
Alanine	1700		5950
Alanylleucine	3055		259583
Allantoin	1672		204
Alpha-Hydroxyisocaproate	1840		83697
Alpha-Hydroxyisovalerate	1126		99823
Alpha-Ketoglutarate	2700		51
Alpha-Tocopherol	2522		14985
Anserine	2924		112072
Arabitol/Xylitol	1932.4
Arabonate/Xylonate	2664.6
Arachidate (20:0)	6295		10467
Arachidonate (20:4N6)	5535		444899
Arachidonoyl Ethanolamide	1535		5281969
Arginine	2825		232
Argininosuccinate	2745		16950;828
Asparagine	1225		6267
Aspartate	1165		5960
Azelate (Nonanedioate)	1276		2266
Behenoyl Sphingomyelin (D18:1/22:0)	3083
Beta-Alanine	1939		239
Beta-Hydroxyisovalerate	1149.8		69362
Beta-Hydroxyisovaleroylcarnitine	2584
Beta-Muricholate	4794		5283853
Beta-Sitosterol	3054		222284
Betaine	1064		247
Betaine Aldehyde	1915		249
C-Glycosyltryptophan	2685		10981970
Campesterol	2873		173183
Caproate (6:0)	2713.7		8892
Caprylate (8:0)	4362		379
Carnitine	1978		10917
Carnosine	804		439224
Catechol Sulfate	1906		3083879
Cholate	5165		221493
Cholesterol	2707		11025495
Choline	1961		305
Choline Phosphate	700		1014
Citrate	582		311
Citrulline	1520		9750
Coenzyme A	1448		317
Corticosterone	5040		5753
Creatine	1947		586
Creatinine	2055		588
Cystathionine	2270		439258
Cysteine-Glutathione Disulfide	2465		4247235
Cytidine	2124		6175
Cytidine 5^-Diphosphocholine	4200		13804
Cytidine 5^-Monophosphate (5^-Cmp)	835		6131
Cytidine 5^-Monophospho-N-Acetylneuraminic Acid	3900		448209
Cytidine-5^-Diphosphoethanolamine	4210		123727
Cytosine	2060		597
Decanoylcarnitine	1130		10245190
Dehydroascorbate	739.6		835
Deoxycarnitine	2052		134
Dihomo-Linoleate (20:2N6)	5730		6439848
Dihomo-Linolenate (20:3N3 Or N6)	5596		5280581
Dihydroxyacetone Phosphate (Dhap)	603		668
Dimethylarginine (Sdma + Adma)	2850		123831
Dimethylglycine	1104		673
Docosadienoate (22:2N6)	6034		5282807
Docosahexaenoate (Dha; 22:6N3)	5525		445580
Docosapentaenoate (N3 Dpa; 22:5N3)	5571		6441454
Docosapentaenoate (N6 Dpa; 22:5N6)	5624.5		6441454
Docosatrienoate (22:3N3)	5823		5312556
Dopamine Sulfate (2)	1556.2
Eicosapentaenoate (Epa; 20:5N3)	5450		446284
Eicosenoate (20:1)	5950		5282768
Ergothioneine	850		3032311
Erucate (22:1N9)	6355.6		5281116
Erythronate	2186		2781043
Ethylmalonate	2785		11756
Flavin Adenine Dinucleotide (Fad)	2425		643975
Flavin Mononucleotide (Fmn)	2390		710
Fructose	2022.2		5984
Fructose-6-Phosphate	4261.4		69507
Fumarate	3084		444972
Galactitol (Dulcitol)	2309.7		11850
Galactonate	3085		128869
Gamma-Aminobutyrate (Gaba)	2048		119
Gamma-Glutamyl-Epsilon-Lysine	2717		65254;14284565
Gamma-Glutamylglutamine	1430		150914
Gamma-Glutamylhistidine	2740		7017195
Gamma-Glutamylisoleucine	2940		14253342
Gamma-Glutamylleucine	2991		151023
Gamma-Glutamylphenylalanine	2992		111299
Gamma-Glutamylthreonine	1750
Gamma-Glutamylvaline	2700		7015683
Gluconate	2922		10690
Glucosamine-6-Phosphate	4521.5		439217
Glucose	2342		79025
Glucose 6-Phosphate	4537		5958
Glucuronate	3233.3		444791
Glutamate	1500		611
Glutamate- Gamma-Methyl Ester	2170		68662
Glutamine	1291		5961
Glutarate (Pentanedioate)	2900		743
Glutarylcarnitine (C5)	2393		71464488
Glutathione- Oxidized (Gssg)	2667		65359
Glutathione- Reduced (Gsh)	790		124886
Glycerate	2070.4		752
Glycerol	758		753
Glycerol 3-Phosphate	3938.7		754
Glycerophosphoethanolamine	3075		123874
Glycerophosphoglycerol	2430		439964
Glycerophosphoinositol	3850
Glycerophosphorylcholine (Gpc)	672		71920
Glycine	1375		750
Glycosyl-N-Palmitoyl-Sphingosine	2623
Glycosyl-N-Stearoyl-Sphingosine	3053
Glycylisoleucine	3002		88079
Glycylleucine	3059		92843
Glycylvaline	2734		97417
Guanidinoacetate	2884		763
Guanidinosuccinate	1892		97856
Guanine	2032		764
Guanosine	1728		6802
Guanosine 5^- Monophosphate (5^-Gmp)	800		6804
Gulonic Acid	2750		9794176
Hexanoylglycine	2900		99463
Hippurate	2106.9		464
Histamine	3035		774
Histidine	755.9		6274
Homoarginine	2882		9085
Homoserine	2875.8		12647
Homostachydrine	1750		441447
Hypotaurine	2763.4		107812
Hypoxanthine	1291.2		790
Imidazole Lactate	2040		440129
Imidazole Propionate	2263		70630
Indolelactate	2600		92904
Indolepropionate	2795		3744
Inosine	1602.1		6021
Inosine 5^-Monophosphate (Imp)	650		8582
Inositol 1-Phosphate (I1P)	4785		440194
Isobar: Fructose 1-6-Diphosphate- Glucose 1-6-Diphosphate- Myo-Inositol 1-4 Or 1-3-Diphosphate	551
Isobutyrylcarnitine	2810		168379
Isocitrate	773		1198
Isoleucine	2800		6306
Isoleucylglycine	2719		342532
Isovalerylglycine	1950		546304
Kynurenine	2739		161166
Lactate	681.6		612
Laurylcarnitine	1235		10427569
Leucine	2864		6106
Leucylalanine	2801		259321
Leucylglutamine	2620		4305457
Leucylglycine	2778		79070
Linoleamide (18:2N6)	6205		6435901
Linoleate (18:2N6)	5535		5280450
Linolenate [Alpha Or Gamma; (18:3N3 Or 6)]	5450		5280934
Linoleoylcarnitine	1430		6450015
Lysine	2850		5962
Malate	615.6		525
Maleate	2510		444266
Malonyl Coa	1325		10663
Malonylcarnitine	2086		22833583
Maltose	3329.4		10991489
Maltotetraose	910		446495
Maltotriose	812		439586
Mannitol/Sorbitol	2260		5780
Mannose	2200		18950
Mannose-6-Phosphate	4510		439198
Margarate (17:0)	5731		10465
Mead Acid (20:3N9)	5650		5312531
Methionine	2526		6137
Methionine Sulfone	740.8		69961
Methionine Sulfoxide	1272		158980
Methyl Glucopyranoside (Alpha + Beta)	1070
Methylmalonate (Mma)	3078.4		487
Methylphosphate	3760.1		13130
Methylsuccinate	2800		10349
Myo-Inositol	3506.3		892
Myristate (14:0)	5440		11005
Myristoleate (14:1N5)	5346.9		5281119
Myristoylcarnitine	1350		53477791
N-Acetyl-Aspartyl-Glutamate (Naag)	575.3		5255
N-Acetylalanine	861.2		88064
N-Acetylarginine	2245		67427
N-Acetylasparagine	785		99715
N-Acetylaspartate (Naa)	3143		65065
N-Acetylglucosamine 6-Phosphate	4114		439219
N-Acetylglucosaminylasparagine	1212		123826
N-Acetylglutamate	1050		70914
N-Acetylglutamine	845		182230
N-Acetylglycine	731		10972
N-Acetylhistamine	2287		69602
N-Acetylhistidine	2065		75619
N-Acetylleucine	2400		70912
N-Acetylmethionine	1980		448580
N-Acetylmethionine Sulfoxide	942		193368
N-Acetylneuraminate	3072.6		439197
N-Acetylphenylalanine	2597		74839
N-Acetylserine	811		65249
N-Acetyltaurine	1249		159864
N-Acetylthreonine	821.6		152204
N-Alpha-Acetylornithine	2000		439232
N-Delta-Acetylornithine	1877		9920500
N-Formylmethionine	1543.8		439750
N-Formylphenylalanine	2336		759256
N-Glycolylneuraminate	636		123802
N-Methylproline	1335		557
N-Monomethylarginine	2845		132862
N-Oleoyltaurine	5610		6437033
N-Palmitoyl-Sphinganine (D18:0/16:0)	3090		5283572
N-Palmitoyl-Sphingosine (D18:1/16:0)	2893		5283564
N-Palmitoyltaurine	5560
N-Stearoyltaurine	5782		168274
N1-Methyl-2-Pyridone-5-Carboxamide	1250		69698
N1-Methyladenosine	2120		27476
N2-N2-Dimethylguanosine	2210		92919
N4-Acetylcytidine	1580		107461
N6-N6-N6-Trimethyllysine	2825		440120
N6-Acetyllysine	1059		92832
N6-Carboxyethyllysine	2695
N6-Carboxymethyllysine	2592
N6-Succinyladenosine	1930
Nicotinamide	1942		936
Nicotinamide Adenine Dinucleotide (Nad+)	1434		5893
Nicotinamide Ribonucleotide (Nmn)	766		14180
Nicotinamide Riboside	2040		439924
Nonadecanoate (19:0)	6068		12591
Oleamide	6581.5		5283387
Oleate/Vaccenate (18:1)	5655
Oleoyl Ethanolamide	6200		5283454
Oleoylcarnitine	1423		6441392;53477789
Ophthalmate	2085		7018721
Ornithine	2800		6262
Orotate	1638.1		967
Orotidine	2250		92751
P-Cresol Sulfate	2890		4615423
Palmitate (16:0)	5618		985
Palmitoleate (16:1N7)	5475		445638
Palmitoyl Dihydrosphingomyelin (D18:0/16:0)	2290		9939965
Palmitoyl Ethanolamide	6100		4671
Palmitoyl Sphingomyelin (D18:1/16:0)	870		9939941
Palmitoylcarnitine	1425		461
Palmitoylcholine	1482		151731
Pantothenate	1498.7		6613
Pentadecanoate (15:0)	5521		13849
Phenol Sulfate	2156		74426
Phenylacetylglycine	2317		68144
Phenylalanine	2878		6140
Phenylalanylalanine	2909		6993123;5488196
Phenylalanylglycine	2898		98207
Phenyllactate (Pla)	2208		3848
Phosphate	608		1061
Phosphoenolpyruvate (Pep)	587.3		1005
Phosphoethanolamine	638		1015
Phosphopantetheine	1596.9		987
Phytosphingosine	1367		122121
Pipecolate	2200		849
Pro-Hydroxy-Pro	2128		11673055
Proline	1603		145742
Prolylglutamine	2056
Prolylglycine	2136		7408076;6426709
Propionylcarnitine	2590		107738
Pseudouridine	800		15047
Pterin	1370		73000
Putrescine	3027		1045
Pyridoxal	2343		1050
Pyridoxal Phosphate	943		1051
Pyridoxamine Phosphate	1932		1053
Pyridoxate	2185		6723
Pyroglutamine	1900		134508
Pyrraline	2750
Pyruvate	2650		1060
Retinol (Vitamin A)	1636		445354
Ribitol	1789.6		6912
Riboflavin (Vitamin B2)	2292		493570
Ribonate	2425		5460677
Ribose	1508.2		5779
Ribose 1-Phosphate	4025		439236
Ribulose/Xylulose	1400
S-Adenosylhomocysteine (Sah)	1832.4		439155
S-Adenosylmethionine (Sam)	3002		34755
S-Lactoylglutathione	2124		440018
S-Methylcysteine	1955		24417
S-Methylglutathione	2200		3605667
Sarcosine (N-Methylglycine)	1280		1088
Sedoheptulose-7-Phosphate	599.6		616
Serine	1239		5951
Spermidine	700		1102
Sphinganine	1413		3126
Sphingomyelin (D18:1/14:0- D16:1/16:0)	1998		11433862
Sphingomyelin (D18:1/15:0- D16:1/17:0)	2082
Sphingomyelin (D18:1/17:0- D17:1/18:0- D19:1/16:0)	2312
Sphingomyelin (D18:1/18:1- D18:2/18:0)	2167		6443882
Sphingomyelin (D18:1/20:0- D16:1/22:0)	2685
Sphingomyelin (D18:1/20:1- D18:2/20:0)	2383
Sphingomyelin (D18:1/21:0- D17:1/22:0- D16:1/23:0)	2793
Sphingomyelin (D18:1/22:1- D18:2/22:0- D16:1/24:1)	2666
Sphingomyelin (D18:1/24:1- D18:2/24:0)	3033
Sphingomyelin (D18:2/16:0- D18:1/16:1)	2002
Sphingomyelin (D18:2/23:0- D18:1/23:1- D17:1/24:1)	2845
Sphingomyelin (D18:2/24:1- D18:1/24:2)	2635
Sphingosine	1393		5353955
Sphingosine 1-Phosphate	1375		5283560
Stachydrine	1440		115244
Stearate (18:0)	5872		5281
Stearidonate (18:4N3)	5395		5312508
Stearoyl Ethanolamide	1787		27902
Stearoyl Sphingomyelin (D18:1/18:0)	2400		6453725
Stearoylcarnitine	1485		6426855
Succinylcarnitine	2291
Sulfate	3728		1118
Sulforaphane-Cysteine-Glycine	2610
Tartronate (Hydroxymalonate)	610		45
Taurine	660		1123
Tauro-Beta-Muricholate	4774		168408
Taurocholate	5150		6675
Taurocyamine	710		68340
Thiamin (Vitamin B1)	1726		1130
Thiamin Diphosphate	1195.1		1132
Thiamin Monophosphate	2378		3382778
Threonate	2384		151152
Threonine	1514		6288
Thymidine	1963.7		5789
Thymidine 5^-Monophosphate	883		9700
Thymine	1654		1135
Tiglylcarnitine	2962		22833596
Trans-4-Hydroxyproline	1064		5810
Tricarballylate	578		14925
Trigonelline (N^-Methylnicotinate)	1388		5570
Trimethylamine N-Oxide	2100		1145
Tryptophan	2291		6305
Tyrosine	2430		6057
Udp-Galactose	4000		18068
Udp-Glucose	3950		8629
Udp-Glucuronate	4355		17473
Uracil	1089.7		1174
Urate	776		1175
Urea	700		1176
Uridine	1457.6		6029
Uridine 5^-Monophosphate (Ump)	590		6030
Valine	2479		6287
Valylglutamine	2295		5253209
Valylglycine	2444		136487
Valylleucine	3138		352039
Xanthine	1032		1188
Xanthosine	1275		64959
Xanthosine 5^-Monophosphate (Xmp)	580		73323
METABOLITES_END
#END