metabolite_name	S00017431	S00017432	S00017433	S00017434	S00017435	S00017436	S00017437	S00017438	S00017439	S00017440	S00017441	S00017442	S00017443	S00017444	S00017445	S00017446	S00017447	S00017448	S00017449	S00017450
Carnitine	1382.377788	12.2192453	20.0743578	10.7736231	12.86481679	15.10487152	14.83978347	17.97811498	10.45096834	15.29079142	26.25969025	15.19691518	19.17300867	13.66931093	15.17132844	11.94723097	11.32541421	19.97842162	12.79676918	11.31177192
CAR(2:0)	10.97036324	12.11630535	11.03316386	10.12862668	11.55714543	16.94178259	13.33489266	13.00268677	13.59005441	12.80306858	13.57593643	15.4294811	11.59346988	10.76582396	12.60261172	12.12621733	10.91894627	10.58065199	12.08474755	8.79564457
CAR(3:0)	0.361730524	0.41940269	0.315210339	0.406335197	0.312311094	0.28520846	0.338904645	0.346975925	0.297980908	0.290133799	0.512735155	0.535393331	0.493200065	0.34599066	0.352800387	0.347072795	0.275794025	0.316304983	0.369620397	0.229348404
CAR(4:0)	0.002858944	0.004373716	0.002875234	0.002109421	0.002797221	0.002520309	0.002324573	0.002023507	0.0021731	0.001679403	0.003323822	0.004258668	0.003185053	0.003798934	0.003098549	0.003017836	0.002672924	0.003973897	0.004076235	0.003147002
CAR(5:0)	0.054184285	0.049968509	0.154640372	0.091457584	0.068599078	0.048623565	0.06320824	0.124490568	0.052980853	0.082872067	0.110949895	0.043042573	0.043056476	0.047186322	0.050209672	0.041821149	0.063316018	0.215882425	0.043943962	0.13609005
CAR(5:0-DC)	0.115306068	0.29243186	0.647234955	0.291259795	0.379919306	0.23117219	0.113698877	0.657078466	0.234822889	0.340489959	0.536591356	0.290720963	0.331883861	0.291013878	0.331926249	0.250872627	0.170078176	0.117313828	0.183206408	0.474086774
CAR(6:0)	0.075138526	0.126050514	0.093205552	0.051704356	0.067112775	0.066705802	0.061546025	0.053620318	0.10240113	0.041444927	0.090189081	0.190781109	0.10398582	0.080547339	0.057518087	0.077868103	0.056167676	0.153800887	0.047019611	0.050331813
CAR(8:0)	0.006317838	0.009581319	0.009730025	0.007499171	0.009080303	0.005981703	0.006272613	0.005854308	0.008055385	0.005807145	0.010338504	0.010889979	0.007302474	0.007746233	0.008853478	0.00869005	0.007007263	0.010699273	0.006411639	0.007860671
CAR(8:1)	0.001219586	0.0014691	0.002081842	0.001465722	0.003006499	0.001051895	0.001257527	0.001247052	0.001375727	0.001039575	0.002123785	0.001884231	0.0015028	0.001395836	0.001046899	0.00174811	0.001955808	0.004132955	0.00410604	0.005505311
CAR(10:0)	0.001628678	0.002708279	0.002792757	0.001789665	0.00264952	0.001235659	0.000835906	0.001158419	0.001984469	0.000827534	0.001927732	0.002048812	0.001606813	0.001816263	0.001412737	0.001410649	0.001526312	0.003984149	0.001627733	0.002255032
CAR(10:1)	0.000836816	0.001015694	0.001137485	0.000828566	0.001878735	0.001197257	0.000738682	0.000951469	0.001121826	0.000753301	0.000824901	0.000852391	0.000757666	0.000895615	0.000701984	0.000405516	0.000606986	0.002528263	0.00174026	0.001514541
CAR(12:0)	0.015069335	0.023342846	0.016357799	0.01006714	0.012233838	0.009894943	0.006636302	0.007235751	0.011741947	0.006337782	0.011328653	0.017531474	0.014091609	0.00911318	0.009809855	0.016704045	0.011020928	0.018086312	0.010123281	0.011517485
CAR(12:1)	0.002461189	0.003996569	0.002701131	0.002313486	0.001714954	0.001971432	0	0.001323374	0.002587714	0.00124311	0.001564195	0.003213372	0	0.001506255	0.001835312	0.002980377	0.002024003	0.003089485	0.001428403	0.001979955
CAR(12-OH)	0.000183681	0.000286073	0.000246542	0.000115494	0.000237679	0.000110186	5.38085E-05	6.3065E-05	0.000160029	0.00010531	0.000108278	0.000188597	6.96567E-05	0.000128801	9.97173E-05	0.000253422	0.000253972	0.000437204	0.000193109	0.000380328
CAR(14:0)	0.12201126	0.196114855	0.126383902	0.090186274	0.105140844	0.091881606	0.057227144	0.056287804	0.066698255	0.058830813	0.083832828	0.126144407	0.116620196	0.065077462	0.084102679	0.152880044	0.09079688	0.150292406	0.082255432	0.101914071
CAR(14:1)	0.04936252	0.080049973	0.060970524	0.040730605	0.041212909	0.062138264	0.039528635	0.031393406	0.055615052	0.036115645	0.044131058	0.073227246	0.069206464	0.044386255	0.042791754	0.058359608	0.038144314	0.05860789	0.035822444	0.030392493
CAR(14:2)	0.00615207	0.008218945	0.007251691	0.00566531	0.005254593	0.005818667	0.00499756	0.004407137	0.006946502	0.003186348	0.005450415	0.007047204	0.007600774	0.005055957	0.005630448	0.007848286	0.006050987	0.007824286	0.005015683	0.004618102
CAR(14:0-OH)	0.005170275	0.011257995	0.009780992	0.002578672	0.005064121	0.002937358	0.001762832	0.00314601	0.003120791	0.001376279	0.003672246	0.004232688	0.00309841	0.001937026	0.002765342	0.008746092	0.003950755	0.012709689	0.004868343	0.007242206
CAR(16:0)	0.7987832	1.180999436	0.786144895	0.550350692	0.713860966	0.474219842	0.327061177	0.36419783	0.437095755	0.363083417	0.490724334	0.709608258	0.683339423	0.380208473	0.554654645	0.948374782	0.572405259	0.801782867	0.563528011	0.630203221
CAR(16:1)	0.365550513	0.638045368	0.433831338	0.212929618	0.256721339	0.180656544	0.106363263	0.121858515	0.19329255	0.10876552	0.178877446	0.313576724	0.233014609	0.126270825	0.202512603	0.400390803	0.217248881	0.500093443	0.2135045	0.270054465
CAR(16:0-OH)	0.032251434	0.069809632	0.056470001	0.014987629	0.027945836	0.016063241	0.010190329	0.019699089	0.017831748	0.009038417	0.028364112	0.028538449	0.022587456	0.013643173	0.019738661	0.056373159	0.024934404	0.072817154	0.026615368	0.04491235
CAR(18:0)	0.599805688	0.866435575	0.677204343	0.232522985	0.480991029	0.272006829	0.168036812	0.23580197	0.239391839	0.24639991	0.328691894	0.486050727	0.482708058	0.216540045	0.321112888	0.749805958	0.363203601	0.688751399	0.414995658	0.41286782
CAR(18:1)	2.091340452	2.961148268	2.129023451	1.21633961	1.362557489	1.361404543	0.788313446	0.95631284	1.088904248	1.054702899	1.00022173	1.827411032	1.775621339	1.003663798	1.328953968	1.964235528	1.319216626	2.144030476	1.171790856	1.318076583
CAR(18:2)	0.141846618	0.179399439	0.173772864	0.094194765	0.093870271	0.102600275	0.078304301	0.08297058	0.122007124	0.084175268	0.11389676	0.147571732	0.127955259	0.07343792	0.104194719	0.137775785	0.103680457	0.183323517	0.102830668	0.126539759
CAR(18:2-OH)	0.030898024	0.058200565	0.040488615	0.016188211	0.027599839	0.023536335	0.015094912	0.02253929	0.024203692	0.014074326	0.022059585	0.034723279	0.029746608	0.01556363	0.022128861	0.047236257	0.027032359	0.058471724	0.021182746	0.035906754
CAR(20:0)	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
CAR(20:1)	0.072645542	0.108475715	0.07549236	0.042174261	0.034567446	0.024352522	0.020992466	0.020024642	0.02232719	0.021894421	0.028278654	0.073230452	0.062910149	0.037890006	0.056445036	0.092058534	0.046747177	0.096348243	0.039578887	0.034947989
CAR(20:2)	0.030065338	0.04858414	0.04062141	0.017383637	0.027254321	0.020901257	0.011725637	0.02268778	0.017202679	0.015655132	0.021505405	0.024463406	0.025880119	0.011517897	0.018775368	0.045711784	0.023838425	0.052220225	0.029569975	0.028120253
CAR(20:3)	0.004666787	0.007115448	0.005578308	0.003285053	0.004137877	0.002512851	0.001889693	0.002779404	0.003326383	0.001861852	0.0035338	0.00552905	0.004792207	0.002506772	0.003511041	0.00725203	0.004362264	0.006541877	0.004699036	0.00431932
CAR(20:4)	0.021115069	0.036823873	0.030048105	0.015623541	0.017508548	0.013716355	0.01231743	0.014994634	0.020443602	0.012337287	0.017686599	0.032871796	0.02898849	0.015678022	0.014989723	0.030241182	0.018478129	0.03239071	0.017623422	0.016575111

metabolite_name	PubChem CID
Carnitine	288
CAR(2:0)	1
CAR(3:0)	107738
CAR(4:0)	213144
CAR(5:0)	6426851
CAR(5:0-DC)	71317118
CAR(6:0)	3082079
CAR(8:0)	123701
CAR(8:1)	77908888
CAR(10:0)	10245190
CAR(10:1)	57357170
CAR(12:0)	10427569
CAR(12:1)	87087953
CAR(12-OH)	71464535
CAR(14:0)	6426854
CAR(14:1)	87088002
CAR(14:2)	87087940
CAR(14:0-OH)	71464541
CAR(16:0)	11953816
CAR(16:1)	76040365
CAR(16:0-OH)	71464553
CAR(18:0)	6426855
CAR(18:1)	6441392
CAR(18:2)	53477834
CAR(18:2-OH)	71464556
CAR(20:0)	53477833
CAR(20:1)	71464507
CAR(20:2)	71464509
CAR(20:3)	54500892
CAR(20:4)	53477832