#METABOLOMICS WORKBENCH ZHULABMAYO_20241011_104302 DATATRACK_ID:5287 STUDY_ID:ST003519 ANALYSIS_ID:AN005777 PROJECT_ID:PR002164
VERSION             	1
CREATED_ON             	October 12, 2024, 11:15 am
#PROJECT
PR:PROJECT_TITLE                 	Rattus norvegicus
PR:PROJECT_SUMMARY               	Rat hearts were isolated for ex vivo Langendorff perfusion. After the treatments
PR:PROJECT_SUMMARY               	were applied, right atrial tissue was collected and frozen at -80°C until IC-MS
PR:PROJECT_SUMMARY               	analysis
PR:INSTITUTE                     	Mayo Clinic
PR:LAST_NAME                     	Zhu
PR:FIRST_NAME                    	Wuqiang
PR:ADDRESS                       	5951 E Mayo Blvd, RE 1-408, Zhu Lab, Phoenix, AZ 85054
PR:EMAIL                         	zhu.wuqiang@mayo.edu
PR:PHONE                         	480-301-9693
#STUDY
ST:STUDY_TITLE                   	Effect of insluin on metabolism of ex vivo ischemia heart
ST:STUDY_SUMMARY                 	Ex vivo hearts were pre-perfused with or without insulin, followed by ischemia
ST:STUDY_SUMMARY                 	induced by the cessation of perfusion. After 25 minutes of ischemia, hearts
ST:STUDY_SUMMARY                 	underwent 30 minutes of reperfusion. Right atrial tissue was then collected for
ST:STUDY_SUMMARY                 	IC-MS analysis. Three groups were included: a control group without ischemia, a
ST:STUDY_SUMMARY                 	group with 25 minutes of ischemia followed by reperfusion, and a group
ST:STUDY_SUMMARY                 	pre-perfused with insulin for 30 minutes prior to ischemia and reperfusion.
ST:INSTITUTE                     	Mayo Clinic
ST:LAST_NAME                     	Qiu
ST:FIRST_NAME                    	Huiliang
ST:ADDRESS                       	5951 E Mayo Blvd, RE 1-408, Zhu Lab, Phoenix, AZ 85054
ST:EMAIL                         	Qiu.Huiliang@mayo.edu
ST:PHONE                         	415-629-7041
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Rattus norvegicus
SU:TAXONOMY_ID                   	10116
SU:GENOTYPE_STRAIN               	WT
SU:GENDER                        	Male and female
#FACTORS
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data
SUBJECT_SAMPLE_FACTORS           	Control-1	N1_R	Sample source:Right atrial tissue | Treatment:Non-ischemia control	Genotype=WT; RAW_FILE_NAME(Raw_file_name)=N1_R.mzML
SUBJECT_SAMPLE_FACTORS           	Control-2	N2_R	Sample source:Right atrial tissue | Treatment:Non-ischemia control	Genotype=WT; RAW_FILE_NAME(Raw_file_name)=N2_R.mzML
SUBJECT_SAMPLE_FACTORS           	Control-3	N3_R	Sample source:Right atrial tissue | Treatment:Non-ischemia control	Genotype=WT; RAW_FILE_NAME(Raw_file_name)=N3_R.mzML
SUBJECT_SAMPLE_FACTORS           	Control-4	N4_R	Sample source:Right atrial tissue | Treatment:Non-ischemia control	Genotype=WT; RAW_FILE_NAME(Raw_file_name)=N4_R.mzML
SUBJECT_SAMPLE_FACTORS           	IS-25-1	IS25_A	Sample source:Right atrial tissue | Treatment:"Ischemia for 25 mins, followed by reperfusion for 30 mins"	Genotype=WT; RAW_FILE_NAME(Raw_file_name)=IS25_A.mzML
SUBJECT_SAMPLE_FACTORS           	IS-25-2	IS25_B	Sample source:Right atrial tissue | Treatment:"Ischemia for 25 mins, followed by reperfusion for 30 mins"	Genotype=WT; RAW_FILE_NAME(Raw_file_name)=IS25_B.mzML
SUBJECT_SAMPLE_FACTORS           	IS-25-3	IS25_C	Sample source:Right atrial tissue | Treatment:"Ischemia for 25 mins, followed by reperfusion for 30 mins"	Genotype=WT; RAW_FILE_NAME(Raw_file_name)=IS25_C.mzML
SUBJECT_SAMPLE_FACTORS           	IS-25ins-1	IS25_INS_A	Sample source:Right atrial tissue | Treatment:Preperfusion of insluin for 30 mins before ischemia and reperfusion	Genotype=WT; RAW_FILE_NAME(Raw_file_name)=IS25_INS_A.mzML
SUBJECT_SAMPLE_FACTORS           	IS-25ins-2	IS25_INS_B	Sample source:Right atrial tissue | Treatment:Preperfusion of insluin for 30 mins before ischemia and reperfusion	Genotype=WT; RAW_FILE_NAME(Raw_file_name)=IS25_INS_B.mzML
SUBJECT_SAMPLE_FACTORS           	IS-25ins-3	IS25_INS_C	Sample source:Right atrial tissue | Treatment:Preperfusion of insluin for 30 mins before ischemia and reperfusion	Genotype=WT; RAW_FILE_NAME(Raw_file_name)=IS25_INS_C.mzML
#COLLECTION
CO:COLLECTION_SUMMARY            	Rat hearts were isolated for ex vivo Langendorff perfusion. After the treatments
CO:COLLECTION_SUMMARY            	were applied, right atrial tissue was collected and frozen at -80°C until IC-MS
CO:COLLECTION_SUMMARY            	analysis
CO:SAMPLE_TYPE                   	Heart
#TREATMENT
TR:TREATMENT_SUMMARY             	Ex vivo hearts were pre-perfused with or without insulin, followed by ischemia
TR:TREATMENT_SUMMARY             	induced by the cessation of perfusion. After 25 minutes of ischemia, hearts
TR:TREATMENT_SUMMARY             	underwent 30 minutes of reperfusion. Right atrial tissue was then collected for
TR:TREATMENT_SUMMARY             	IC-MS analysis
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Tissue were snap frozen in liquid nitrogen, then homogenized with Precellys
SP:SAMPLEPREP_SUMMARY            	Tissue Homogenizer. Certain volumes of homogenate were used to make sure same
SP:SAMPLEPREP_SUMMARY            	amount of tissue were extracted. Metabolites were extracted using ice-cold 80/20
SP:SAMPLEPREP_SUMMARY            	(v/v) methanol/water with 0.1% ammonium hydroxide. Extracts were vortexed
SP:SAMPLEPREP_SUMMARY            	vigorously for 2 mins, centrifuged at 17,000 g for 10 min at 4°C, and
SP:SAMPLEPREP_SUMMARY            	supernatants were transferred to clean tubes, followed by evaporation to dryness
SP:SAMPLEPREP_SUMMARY            	under nitrogen. Dried extracts were reconstituted in 100 μL of 1mM potassium
SP:SAMPLEPREP_SUMMARY            	hydroxide (KOH) in deionized water.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	ion chromatography with high resolution mass spectrometry
CH:CHROMATOGRAPHY_TYPE           	Ion exchange
CH:INSTRUMENT_NAME               	Thermo Dionex ICS-6000+
CH:COLUMN_NAME                   	Thermo IonPac AS11
CH:SOLVENT_A                     	Water
CH:SOLVENT_B                     	KOH
CH:FLOW_GRADIENT                 	0-5 min, 1% MPB; 5-25 min, 1-35% MPB; 25-39 min, 35-99% MPB; 39-49 min, 99% MPB;
CH:FLOW_GRADIENT                 	49-50 min, 99-1% MPB
CH:FLOW_RATE                     	360uL/min
CH:COLUMN_TEMPERATURE            	35
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Thermo Ortibrap IQ-X
MS:INSTRUMENT_TYPE               	Orbitrap
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	NEGATIVE
MS:MS_COMMENTS                   	. Data were acquired using a Thermo Orbitrap IQ-X Tribrid Mass Spectrometer
MS:MS_COMMENTS                   	under ESI negative ionization. All the raw data files were imported into Thermo
MS:MS_COMMENTS                   	Trace Finder 5.1 software for final analysis
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	Area under the Curve
MS_METABOLITE_DATA_START
Samples	N1_R	N2_R	N3_R	N4_R	IS25_A	IS25_B	IS25_C	IS25_INS_A	IS25_INS_B	IS25_INS_C
Factors	Sample source:Right atrial tissue | Treatment:Non-ischemia control	Sample source:Right atrial tissue | Treatment:Non-ischemia control	Sample source:Right atrial tissue | Treatment:Non-ischemia control	Sample source:Right atrial tissue | Treatment:Non-ischemia control	Sample source:Right atrial tissue | Treatment:"Ischemia for 25 mins, followed by reperfusion for 30 mins"	Sample source:Right atrial tissue | Treatment:"Ischemia for 25 mins, followed by reperfusion for 30 mins"	Sample source:Right atrial tissue | Treatment:"Ischemia for 25 mins, followed by reperfusion for 30 mins"	Sample source:Right atrial tissue | Treatment:Preperfusion of insluin for 30 mins before ischemia and reperfusion	Sample source:Right atrial tissue | Treatment:Preperfusion of insluin for 30 mins before ischemia and reperfusion	Sample source:Right atrial tissue | Treatment:Preperfusion of insluin for 30 mins before ischemia and reperfusion
2-3-diphosphoglycerate	79455	42629	75541	64677	537141	298355	159982	95322	598	209548
2-phosphoglycerate	153009248	148281760	212914992	186163280	395294528	309777600	241341136	266677984	169141216	315282784
fructose-1-6-bisphosphate	29597790	33768644	38508476	23318364	73507856	39962824	46024072	229496752	84093128	246919616
fructose-1-phosphate	90678528	69517592	100102816	37279084	149745216	143083200	81122312	334595264	142397936	251293392
fructose-6-phosphate	53933704	26435534	44562264	22421714	5708310	5282496	6969934	43383964	44369244	31621640
glucose	172761008	140975056	170566880	121941816	131184712	133140496	102456528	88508536	72175128	75849912
glucose-1-6-bisphosphate	28568956	32665090	37328688	22774590	70247392	38840220	45539892	225772816	83618968	241199696
glucose-1-phosphate	95901128	46752548	93138912	64033160	100296624	68979232	66811004	189363728	63886468	138221088
glucose-6-phosphate	296201536	152135552	273608096	145590256	25724792	37083808	42275552	245992416	269973824	199567264
glycerol-3-phosphate	85650864	132052456	134144088	157073168	267290432	270934112	246990464	297468128	340421120	358712064
lactate	845165824	741953088	886921984	675995776	832533824	938346112	798849664	789052288	709031488	685560000
mannose-6-phosphate	49973324	28917562	47987888	28747214	13547377	13902931	10343933	31299056	54806604	39744216
phosphoenolpyruvate	7760490	10504255	8027153	13780738	28307904	35107924	22607236	18713498	16244946	25130388
glyoxylate	1785975	2023617	2395255	2344415	3481939	2540352	1855932	1811263	935399	1175432
pyruvate	7001874	8005141	9863521	5919133	10142625	8773454	5897293	13873098	1292531	2163205
2-hydroxyglutarate-(2-HG)	19826654	19772052	28266724	16133978	27694012	29287200	17359056	17255728	4779944	6875315
2-oxoglutarate-(a-KG)	9430006	10029751	14523389	9112014	18686150	17876808	11191249	10920238	4024992	6267301
aspartate-(Asp)	1543245056	2056456576	1870213248	1669527296	1832026368	1394032000	1271651840	1072042752	508361568	552801088
cis-aconitate	1160317	1288833	1797354	1338520	1059435	1613843	955227	890645	675130	403562
citrate	674350528	710330048	918721600	602988928	710725824	810033216	610038720	604810816	287887456	299315616
fumarate	22006	53274	100771	95000	4327361	4277231	2606573	5026683	8751714	10118833
glutamate-(Glu)	2197594624	2358827776	2052887808	1910655360	2690671104	2550794240	2260112896	1800995712	1017630272	1369263872
isocitrate	15271238	18459058	20544950	12886180	17509358	20667700	15240601	16242815	8894958	9479507
malate	386819456	430996320	523150048	498001216	770757120	561225984	396623648	431671904	225212528	271847488
oxaloacetate-(OAA)	157404	165970	180756	131226	139722	158065	126370	131094	60759	58472
succinate	186699488	147192624	245191664	192469840	216194992	260146176	218149744	227809680	163583248	149371856
succinate-semialdehyde	14074806	14424119	15738134	6832784	16622810	13866509	9780805	10460361	11558500	10822054
deoxyribose-5-phosphate	220249	183861	171240	102374	45027	33025	24385	34159	27354	29939
erythrose-4-phosphate	10947551	6740107	10423941	6782671	2044231	2790248	2465479	10185033	10434335	7864483
gluconate	33536524	25869642	32583814	18086294	53411852	23918956	18319812	19921336	16924286	35355944
gluconate-6-phosphate	381251	406163	1030794	1092876	204640	239365	384579	1410652	3570228	3511421
glucono-1-5-lactone	929397	820040	2170065	855468	1335383	1400375	1119851	809304	326065	577388
ribose-1-5-bisphosphate	955571	973340	774231	3022341	1243340	1208797	1115282	1036253	384628	512905
ribose-1-phosphate	852924992	800520960	712123712	1115785856	824314752	656794112	544494144	640913408	457826368	548060224
sedoheptulose-1-7-bisphosphate	9953333	10196171	11827496	17242882	30962288	23936820	23235394	28381626	6645823	15501013
sedoheptulose-7-phosphate	139633568	121484896	153953520	173832960	271565216	249250560	241748704	233269280	41155708	98238984
adenylsuccinate	6788475	5641843	10289769	26284554	33592008	17747740	10872679	13099031	4016848	3251700
adenosine-5-diphosphate-(ADP)	600954112	578139584	911087168	914901568	1321916416	1097078528	819795456	1199493376	287239040	349383392
ADP-glucose	104196	68706	159438	224783	634454	595713	1101715	742127	72725	105069
ADP-ribose	1195035	693963	4281682	2380319	13383824	21133746	14177585	20244386	992057	2796897
adenosine-5-monophosphate-(AMP)	153674432	161840528	336286912	397033248	749946112	813883904	636837888	1201815168	155637120	353548672
adenosine-5-triphosphate-(ATP)	15159254	12001194	25939454	35618004	33154724	54028628	30815056	70672360	813489	11230735
cytidine-5-diphosphate-(CDP)	56270	54483	163647	344021	808122	1115739	354280	2031430	57537	117518
CDP-ethanolamine	44096	26818	50806	49286	147496	406855	207604	823722	33835	37408
cytidine-5-monophosphate-(CMP)	551155	513992	839887	1308281	2378789	3401036	2126039	7471477	543500	1370661
CMP-N-acetylneuraminate	14196930	14916186	15860111	10228831	19420086	16002959	12760322	10049517	3865144	5660017
cytidine-5-triphosphate-(CTP)	4866	15831	17508	52420	80900	164560	56953	131447	787	10424
cyclic-AMP-(cAMP)	320271	271984	632057	367915	1251242	1196061	1047881	688860	169881	258826
2-deoxyguanosine-5-diphosphate-(dGDP)	600954112	578139584	911087168	914901568	1321916416	1097078528	819795456	1199493376	287239040	349383392
2-deoxyguanosine-5-monophosphate-(dGMP)	153674432	161840528	336286912	397033248	749946112	813883904	636837888	1201815168	155637120	353548672
2-deoxyguanosine-5-triphosphate-(dGTP)	15159254	12001194	25939454	35618004	33154724	54028628	30815056	70672360	813489	11230735
2-deoxythymidine-5-monophosphate-(dTMP)	214531	139197	281095	195223	351697	263868	121187	167241	28016	35287
flavin-adenine-dinucleotide-(FAD)	206825	162677	298573	191347	488651	451209	250619	248048	86224	113392
flavin-mononucleotide-(FMN)	10367906	10045625	14198440	8359556	13766463	11789622	7553245	7172382	4200299	5810315
guanosine-5-diphosphate-(GDP)	16293034	15040723	23996796	27118010	28053764	36729960	35371332	38941180	2788000	15653361
GDP-mannose	147899	110699	263635	331636	581824	1906706	1444460	2222486	69810	153466
guanosine-5-monophosphate-(GMP)	81886960	62308952	86209792	110355656	173480480	122134008	160206144	183444752	63381552	113089584
guanosine-5-triphosphate-(GTP)	128066	89454	175067	344565	222918	771584	514379	995639	2368	135326
inosine-5-monophosphate-(IMP)	31863884	26022714	46746656	60978476	262171104	232033600	243125456	241183968	55097352	114763952
adenosine-3-phosphate-5-phosphosulfate	133444	54673	216074	287229	228505	526952	311748	755343	1579	113999
pyridoxal-5-phosphate-(P5P)	1988036	2229519	2791561	4270632	5740169	5117598	3856203	3581713	843805	1777350
thymidine-5-monophosphate-(TMP)	214531	139197	281095	195223	351697	263868	121187	167241	28016	35287
uridine-5-diphosphate-(UDP)	787648	864093	1475705	2420762	4661333	4756014	2902822	8455239	559268	2035923
UDP-N-acetylgalactosamine-(UDP-GalNAc)	148812	123093	148117	157547	405095	963392	637373	955632	48812	90341
UDP-N-acetylglucosamine-(UDP-GlcNAc)	503013	465408	644033	657184	2907471	6807864	3925137	8418296	283694	566451
uridine-5-monophosphate-(UMP)	8216061	8945502	11425861	13506101	47518636	52400932	46084212	123716480	21100292	56944564
urate	569268672	526352736	565666048	499025248	680900352	535101088	409407424	334159776	134912592	213480880
uridine	31231960	28383626	24092934	25283468	21059958	17018314	17446326	19230338	14522982	15065908
uridine-5-triphosphate-(UTP)	21250	27289	23224	55901	85895	119587	54865	144630	6183	24401
xansthosine-5-monophosphate-(XMP)	153289	158988	362457	766129	420543	577410	578905	344983	171190	259316
riboflavin-cyclic-4-5-phosphate	31269516	26104756	46009696	28405882	66183244	63484092	38101568	41846860	17463114	21584304
2-aminomuconate	1591688	1232957	1731206	476682	2232858	1802263	1117338	1050992	671939	577382
2-methylglutarate	11059337	10593745	8641829	14490217	9144638	15780589	9243160	2085133	308264	360579
2-propylglutarate	863393	409391	401347	195270	401084	914376	361925	351520	225885	394415
3-hydroxymethylglutarate	12972279	11186756	13443622	8312697	12216090	11477976	8230570	8820062	8976901	8433697
4-hydroxyglutamate-semialdehyde	2291843072	2451983616	2136098560	1967522816	2824298496	2681925120	2369944320	1893353088	1209017856	1577142272
gamma-glutamylalanine-(g-Glu-Ala)	4773608	8185880	8308189	16407043	9005474	14267919	5385754	7045702	3505518	3041858
gamma-glutamyltaurine	352877888	331720928	343446112	384259808	477849856	466130528	373982976	154653376	61976816	120157096
acetylcarnitine	2201623	2730944	3356883	2484499	4661602	4543551	2213876	1511288	904527	974873
aspartylglutamate-(Asp-Glu)	4592117	5418941	5402519	4330213	4660162	4213819	3037791	2463439	1097465	1254895
citryl-glutamate	11191936	14072757	16701301	16344486	14904690	7034648	12629420	20348086	3646947	5239406
cysteate	1949783	1541449	1528833	590756	2433729	1853083	1252974	1085967	486871	486523
glutamylglutamate-(Glu-Glu)	60274240	74222992	53421428	58295928	61184248	66246696	59468580	32320722	12374281	22841324
glutathione--reduced-(GSH)	840814528	910713856	1180805120	1237179520	1530605568	1401034880	1190720000	1359364992	1138835584	1040480768
homocysteinesulfinate	39949088	32725162	29657168	86640496	33039450	26328718	38060408	10895069	3271785	5750132
ketoleucine	3650089	4824063	4442211	4694928	3780065	4373274	4344654	4100761	4483152	4077184
N-acetylaspartate	64537824	50633232	71673320	21768772	90687216	71945664	47347220	44873520	29857660	26646954
N-acetylglutamate	564924	528532	371119	292523	375832	300386	298603	250168	167474	206733
N-acetylmethionine	816164	675917	606192	231939	954572	606554	435566	365161	663552	531378
N-acetylneuraminate	40933340	39739652	45921116	31078090	34269352	40043524	23192196	29621496	26757242	15803601
N-formylmethionine	596913	645559	821143	514161	1193482	842172	657094	537616	209697	182729
orotate	1021938	741955	1603364	1517332	3002154	2651525	1484260	2326739	565001	685407
orotidine	1358818	1013068	1239020	417227	1457447	823966	656047	692513	281032	325700
pantothenate	9113673	12931137	9224794	11934379	16114386	14343420	10394678	11465930	12754976	11324033
phosphocreatine	1241650	954223	1236357	4669336	16253935	34748988	27247106	5809538	4899199	10415765
pyroglutamate-(pGlu)	62332576	81994864	60761620	61596836	37898732	53132836	35078040	31199384	19548008	20420486
taurine	1378469760	1395671424	1478840448	1618711040	1723109888	1826112640	1720672000	1559327360	1030693056	1219982976
ureidosuccinate	12957	13117	8541	10904	122014	156226	110430	490630	290619	267910
2-hydroxybutyrate	54183	67932	57290	40464	7039	102270	59539	19997	15708	42899
3-hydroxybutyrate	997820	875091	1757209	1980911	2740045	3998956	2715107	2056779	1923105	1694454
butyrate	402776	633016	625437	376484	410283	528339	344385	349204	133409	249555
glycerophosphocholine	229200	882375	486060	1393354	699555	729365	375718	341724	126309	162863
O-phosphoethanolamine	1559314	1082555	1058820	2385206	7586706	5983645	5338607	6642982	7880747	9861500
1-pyrroline-2-carboxylate	996792	1747827	2496915	1555372	1489642	2188172	1472719	2188334	904202	741313
2-hydroxyadipate	12972279	11186756	13443622	8312697	12216090	11477976	8230570	8820062	8976901	8433697
5-phosphoribosyl-N-formylglycinamide	52858	33287	9991	43433	3865369	417525	199531	434557	167895	252421
galactarate	414550	414207	412679	332502	566300	472975	317822	337553	107057	193413
galactose-1-phosphate	264698512	137625520	283705856	251661776	348044512	342587008	230916112	207153472	58134836	70222344
galacturonate	16055038	11936322	19726434	5187457	7760151	8820942	5344910	5572576	1712063	1821827
glucarate	9935665	11406922	12335322	16372057	34007164	34421312	27380572	25647716	12784310	20235952
glucuronate-1-phosphate	13234708	7870455	9245221	15560802	13776288	13328439	12995512	12473288	11147911	10965511
glutarate	44260	59154	122196	54693	191489	157645	75724	128597	70717	47450
glycerate	72134672	75105360	100829272	49503404	45250644	51064332	38255196	39902120	10958206	16857726
hydroxypropanedioate	29207478	39485500	31663658	54471612	58038260	45330232	36405900	32712324	9893277	21384060
maleate	182200	105275	267360	334713	5444277	5891801	2422520	4503254	9396357	10368793
malonate	414883	544025	539651	406054	616258	666197	424590	601298	318971	372364
oxalate	14429846	16590293	16734775	21916796	35241300	31516060	25380998	22965006	13678130	18569678
ribonate	21481090	24552264	26749444	36758364	76027536	78621040	63643084	58531276	28369890	44925288
threonate	92261360	119259120	95419872	126568480	73879432	63112228	58068352	47633916	26459742	37025196
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name
2-3-diphosphoglycerate
2-phosphoglycerate
fructose-1-6-bisphosphate
fructose-1-phosphate
fructose-6-phosphate
glucose
glucose-1-6-bisphosphate
glucose-1-phosphate
glucose-6-phosphate
glycerol-3-phosphate
lactate
mannose-6-phosphate
phosphoenolpyruvate
glyoxylate
pyruvate
2-hydroxyglutarate-(2-HG)
2-oxoglutarate-(a-KG)
aspartate-(Asp)
cis-aconitate
citrate
fumarate
glutamate-(Glu)
isocitrate
malate
oxaloacetate-(OAA)
succinate
succinate-semialdehyde
deoxyribose-5-phosphate
erythrose-4-phosphate
gluconate
gluconate-6-phosphate
glucono-1-5-lactone
ribose-1-5-bisphosphate
ribose-1-phosphate
sedoheptulose-1-7-bisphosphate
sedoheptulose-7-phosphate
adenylsuccinate
adenosine-5-diphosphate-(ADP)
ADP-glucose
ADP-ribose
adenosine-5-monophosphate-(AMP)
adenosine-5-triphosphate-(ATP)
cytidine-5-diphosphate-(CDP)
CDP-ethanolamine
cytidine-5-monophosphate-(CMP)
CMP-N-acetylneuraminate
cytidine-5-triphosphate-(CTP)
cyclic-AMP-(cAMP)
2-deoxyguanosine-5-diphosphate-(dGDP)
2-deoxyguanosine-5-monophosphate-(dGMP)
2-deoxyguanosine-5-triphosphate-(dGTP)
2-deoxythymidine-5-monophosphate-(dTMP)
flavin-adenine-dinucleotide-(FAD)
flavin-mononucleotide-(FMN)
guanosine-5-diphosphate-(GDP)
GDP-mannose
guanosine-5-monophosphate-(GMP)
guanosine-5-triphosphate-(GTP)
inosine-5-monophosphate-(IMP)
adenosine-3-phosphate-5-phosphosulfate
pyridoxal-5-phosphate-(P5P)
thymidine-5-monophosphate-(TMP)
uridine-5-diphosphate-(UDP)
UDP-N-acetylgalactosamine-(UDP-GalNAc)
UDP-N-acetylglucosamine-(UDP-GlcNAc)
uridine-5-monophosphate-(UMP)
urate
uridine
uridine-5-triphosphate-(UTP)
xansthosine-5-monophosphate-(XMP)
riboflavin-cyclic-4-5-phosphate
2-aminomuconate
2-methylglutarate
2-propylglutarate
3-hydroxymethylglutarate
4-hydroxyglutamate-semialdehyde
gamma-glutamylalanine-(g-Glu-Ala)
gamma-glutamyltaurine
acetylcarnitine
aspartylglutamate-(Asp-Glu)
citryl-glutamate
cysteate
glutamylglutamate-(Glu-Glu)
glutathione--reduced-(GSH)
homocysteinesulfinate
ketoleucine
N-acetylaspartate
N-acetylglutamate
N-acetylmethionine
N-acetylneuraminate
N-formylmethionine
orotate
orotidine
pantothenate
phosphocreatine
pyroglutamate-(pGlu)
taurine
ureidosuccinate
2-hydroxybutyrate
3-hydroxybutyrate
butyrate
glycerophosphocholine
O-phosphoethanolamine
1-pyrroline-2-carboxylate
2-hydroxyadipate
5-phosphoribosyl-N-formylglycinamide
galactarate
galactose-1-phosphate
galacturonate
glucarate
glucuronate-1-phosphate
glutarate
glycerate
hydroxypropanedioate
maleate
malonate
oxalate
ribonate
threonate
METABOLITES_END
#END