metabolite_name	301	302	303	304	305	306	307	308	309	310	311	312	313	314	315	316	317	318	319	320	321	322	323	324	325	326	327	328	329	330	331	332	333	334	335	336	337	338	340	341	342	343	344	345	346	347	348
Cer 18:1/16:0	122.8549707	88.33579097	112.4814909	125.8680773	16.61904977	70.56769062	67.89730485	117.3052925	124.8330539	90.72538114	83.28451667	71.01015103	131.5844757	124.7331712	227.2147684	107.8224206	97.33688717	106.1117246	100.6719193	72.81809119	46.99339379	57.55803334	71.52773767	54.40182715	80.19039993	73.56075409	63.75748724	98.10150359	77.21868764	49.67664294	78.65036855	84.58148799	164.9450388	83.8915892	89.70858409	73.82067792	154.0514139	52.45938044	147.3897782	70.86690998	99.40270195	33.28447956	106.7975026	523.9056618	112.0053996	43.61773749	93.41285856
Cer 18:1/18:0	311.8740939	315.7944066	232.902512	234.2741685	263.5878847	297.5720503	218.2487886	310.766742	341.0132866	310.8086911	275.6685872	399.5215398	295.9085216	270.0883699	470.7214601	394.3638631	313.7816342	428.0567645	363.4587528	376.3504837	209.3689415	168.8744133	292.4307677	328.3793123	290.6883588	245.1738685	267.3651676	186.5634516	229.9410489	213.1323218	216.3967728	289.6204774	322.8987503	256.3850795	194.466568	204.3832538	127.8522869	90.25631301	140.0553595	126.7252691	138.4685195	78.48479052	141.7935566	269.2140479	127.7845295	88.07937515	115.7771241
Cer 18:1/20:0	469.1631422	600.6749667	156.5242307	434.81781	323.5749894	424.0250898	272.8651527	525.3372946	566.1479352	312.9049651	495.5870752	505.3754504	449.075857	358.6021424	943.1988663	497.3529764	381.9490797	612.9102583	600.0901746	462.2417274	261.4954977	153.1677134	543.7221901	417.6251119	441.871931	451.8017768	520.2858777	332.8817586	464.2449787	366.4543374	421.3315941	443.1893676	582.6079054	583.5182433	390.4761504	353.0487204	292.7004198	395.5138272	495.9695046	448.278154	505.3053791	68.87841922	467.6218192	731.3019586	540.5893323	305.8164375	436.3087555
Cer 18:1/22:0	558.5537467	695.0463182	192.9450214	498.770315	518.8749548	569.8691623	403.2671387	767.5221444	763.4138061	456.3002916	520.5586428	872.8285892	490.9161301	473.2598305	1064.940583	584.9354172	399.5090004	657.5292047	669.1726629	629.5559755	400.9844122	241.2875784	707.5168351	546.9847556	649.2992382	607.0168429	748.3969268	369.1886374	611.5567934	512.6719422	518.1086262	678.0702766	615.8126548	720.030555	571.8170768	373.6156371	308.6358305	492.3208079	579.5922699	450.5787347	508.3257851	108.5200563	438.7187592	713.4322807	550.6977316	360.0803002	484.1271684
Cer 18:1/22:1	9826.159863	11650.08288	4062.065791	7133.571261	8774.361796	8667.760414	6777.444612	12109.57531	8841.536604	8051.822411	8238.930341	12343.87343	6111.059413	4540.549131	8373.757886	5903.305862	2960.952156	8199.156584	8042.147553	6580.871836	5106.233399	2957.132357	6120.452236	6491.728015	7469.268161	6842.056358	5919.818995	3044.615583	6684.773209	8476.693124	6169.216094	8391.725687	6933.125723	7521.534144	5699.227094	4175.538402	241.463838	6351.181596	7537.574394	6199.839661	5982.904306	4397.212042	7369.190058	273.5176472	6245.540867	4061.729372	5475.283039
Cer 18:1/23:0	81.32521666	105.3489215	24.36714022	94.61417316	63.83701035	82.48436181	52.16079441	137.2848114	116.1733621	63.77086191	88.26423166	136.2852838	60.8557327	61.4408188	108.8570268	84.43309987	51.43142636	92.31419911	87.51454811	67.76566509	50.68458746	30.10367811	81.21933449	78.9154552	94.43910736	75.7638268	78.2089059	48.87635194	85.3560347	53.65108428	74.98308536	88.06731909	66.17429176	109.824992	67.47848969	64.14167592	44.64921658	66.77958444	81.84761083	47.37778687	59.94508649	13.71549047	65.32957571	87.32056201	60.21001612	46.06288413	52.33487328
Cer 18:1/24:0	756.5333758	789.5648785	314.5064479	695.5451825	479.4003565	599.6960967	373.5274612	1101.495788	990.334137	440.1496461	620.2989277	826.070302	517.6859731	579.6543141	1315.936211	820.4802065	422.0289745	849.0271866	849.7951094	669.2412036	370.3148448	214.5951525	750.6901446	575.7771006	651.0076104	580.572158	776.8751319	341.170508	574.7019305	502.2206335	568.7198406	813.4246976	727.609007	766.35307	522.6276491	367.8020759	258.7522552	440.8281163	570.1796215	368.4473564	556.0182812	131.4426762	468.0702883	698.4759447	445.3047969	395.1400245	396.9439103
Cer 18:1/24:1	755.218671	897.9315803	314.6074964	526.0580331	791.0859314	822.0779475	416.6203021	934.801448	907.9500425	526.2411584	749.2119078	1325.342132	713.0797353	478.8733139	782.396071	523.8349661	448.002677	639.3965051	710.5483605	774.8448036	498.058492	285.3699206	684.0596598	465.0539566	680.1235738	536.3622698	752.5457927	268.5630923	416.4111554	635.957098	431.5417976	733.6833061	579.91519	591.884718	440.4137063	434.053574	563.0010643	340.5506627	349.6188412	285.7424439	248.0579681	143.9358727	349.1873167	346.7850978	252.913233	249.3887283	250.1496056
DHCer 18:0/18:0	26.26546137	17.08628336	16.87623039	20.00597692	15.17255703	8.320262577	29.01184146	13.45503521	18.59953999	16.69857802	12.89935137	9.888737239	12.31553118	20.91254691	30.98596346	24.74752759	18.32780118	15.36284265	12.04680525	7.289107428	6.66072369	12.91591514	17.15203189	7.824826782	17.10817094	11.67164827	6.746503177	10.32786329	9.271676466	6.449672063	10.64784615	7.341908769	19.47289946	17.32872539	11.76255927	6.33849493	7.592737238	3.591348404	16.10578587	9.424497817	10.84446621	3.896788846	11.78906207	23.50920293	7.063540514	6.007788062	26.04999002
DHCer 18:0/20:0	30.71805679	20.87287033	24.66505267	24.02121903	21.51337618	7.562238245	39.73556999	16.27528574	24.37052852	21.03493489	15.593802	12.38613009	17.3054522	24.70424352	48.32774561	27.83138872	25.38274242	17.00150327	14.58940163	7.320753169	5.395773593	16.05279509	21.01416578	11.44628234	26.45468372	17.79172919	8.515832983	12.25389559	9.850821161	8.146784061	14.58641473	10.41462627	25.4775277	22.84414612	16.5782198	7.662184104	9.736641668	5.226937236	31.07405016	13.95345777	16.75404885	6.917063571	17.61288748	30.29022241	8.744619242	10.28122425	37.77686798
DHCer 18:0/22:0	11.77606911	8.416020751	9.505123261	7.426009473	8.72671721	4.986447061	9.145391774	18.07586778	11.72194576	7.523313066	6.480234736	6.706240942	9.174065037	9.671666958	19.72020309	10.71070691	8.020774095	7.616509189	8.700718485	5.300258897	4.468004448	5.468056185	9.619288148	6.287040194	9.8491409	8.991882015	6.293354113	4.981371565	6.082031995	6.452904421	5.39708553	8.981773721	11.39174928	10.18622765	9.06189014	3.403260796	3.343377997	2.889013273	13.54288493	4.719083412	7.377847786	2.394582132	10.33708533	12.49186667	4.450639897	3.73484513	6.197970329
DHCer 18:0/23:0	5.911968006	3.707610318	5.782375881	5.869963195	2.350033859	2.288562288	3.295694151	10.0638783	5.871800366	2.59885001	2.837381223	2.81032232	2.608700842	4.460874586	8.966486213	4.936769809	3.383900872	3.794222622	3.765991633	2.867104158	2.029124446	1.968248509	4.109688407	3.317040165	3.271603238	2.716751938	3.31036208	2.887014799	2.091402175	2.401392964	2.404709882	3.581149056	4.219587911	3.836086478	3.717613847	2.025430871	0.998144402	1.708018603	3.787271783	2.339207646	3.000638183	1.268193424	2.852489069	4.622925902	1.796785497	1.655839309	1.918923522
DHCer 18:0/24:0	4.533238977	2.904108753	11.21334595	7.990350712	6.99066131	2.737304169	3.174032548	17.23192508	7.241446678	3.45022298	3.107373133	5.124412669	6.223968746	5.143954779	24.64578428	6.217693094	3.500961695	3.499323031	4.99650596	3.062041924	1.971701575	3.428625147	4.047138373	2.561549498	5.485292799	6.866254986	4.450126741	2.893428649	2.592866899	4.678464486	3.146919665	11.44534535	8.288414089	7.355712311	5.281270366	2.001567179	1.599620113	1.48169504	9.864853218	3.27333176	4.796436406	2.445243583	9.606074149	11.34796785	3.115201218	3.110154518	3.323893638
DHCer 18:0/24:1	2.713323151	2.335247959	2.0673702	2.778809866	2.027256059	2.008791115	2.559938184	4.020908488	3.015057053	1.876415786	1.742187669	2.409829469	1.970743173	2.01261358	3.410944885	2.783413026	2.305060548	2.71501561	2.442325995	1.625440346	1.524615663	1.374957604	2.036088642	1.728719085	3.007094275	2.69510966	2.065398681	1.737058376	2.29525253	1.465501152	1.68142894	1.722587189	2.814531413	2.919555566	2.685214848	1.148291036	1.756123591	1.221415154	1.488480758	1.584926994	1.670043134	1.02317192	2.189478931	3.540920947	1.54649868	1.003443395	1.504929437
doxCer 18:1/18:0	18.58302646	23.34310867	10.26364733	12.88561766	14.99895372	28.18946939	13.16056967	12.78850579	28.69227195	24.90916685	20.68122675	32.43700334	29.62946752	23.7755229	34.14210348	47.50728066	11.57623205	41.38423954	38.8431762	36.9616547	29.3631683	16.05031506	48.89383355	36.67970255	57.98892557	55.6705537	72.82094923	28.67767789	71.951657	58.93484449	48.98055901	52.67210995	63.68434108	70.64133502	35.06182859	62.47845839	56.45727386	39.78434872	41.16626554	46.68181285	54.97993791	33.25991083	58.21592798	22.43007642	64.1802051	43.49331631	41.00945968
doxCer 18:1/20:0	127.162727	122.61441	57.65542538	79.04554736	101.3082641	102.0242553	70.65781459	123.5886041	112.8880537	118.6813592	111.6218525	157.5558053	154.6284575	80.9440752	171.001237	133.3409871	58.71338398	155.6994475	131.3221372	139.344333	71.69789363	52.75240069	126.2268438	112.8520325	193.5836018	191.4563934	208.0837219	105.4897156	159.0298816	198.5283804	128.3007819	218.6217106	177.7273263	215.8670565	133.2402924	155.1027345	271.9406525	176.6879007	286.8303281	156.9808063	222.7406969	146.0610673	203.3266094	139.0257401	210.8129697	181.7306552	168.0808494
doxCer 18:1/22:0	79.34849734	140.5107933	45.16870957	80.42743115	84.6979245	103.5520336	60.13738359	145.595323	128.6818058	83.59635212	110.41342	157.0137431	80.1007972	50.59331826	78.86639844	74.64504563	35.6108533	112.5477908	129.577884	107.0009115	57.01939061	31.14946345	99.62792033	76.29098932	191.1535897	170.3318948	190.3187795	69.70286547	171.7238559	182.0030717	130.5742268	175.0127615	174.0045662	201.8161827	117.522921	167.5383655	143.61003	149.974866	153.3300513	161.3048671	118.5366892	70.96676081	153.7398454	89.27754855	154.2276142	118.1622523	130.5724252
doxCer 18:1/22:1	34.9748782	36.08718422	15.60478589	18.36828646	28.90913322	38.61753603	33.37488369	50.19589378	44.18263146	47.51837315	35.53926887	37.52154698	54.67727381	58.94811813	94.69317052	66.59762964	34.88681866	61.13429261	76.00080007	64.9710419	37.49118907	30.54689189	63.79140992	81.03736377	64.23332035	63.92817021	88.60195409	37.61963406	60.23359019	62.55290317	32.53868052	66.55934053	65.49300232	79.22130827	29.99192424	46.25438743	84.13240811	54.18260834	131.9329453	31.83436713	69.16302374	39.19325781	56.27513931	32.83486907	55.74524729	48.54589808	45.76887442
doxCer 18:1/23:0	29.65078984	25.21476333	7.838481718	21.21281348	16.05288717	24.28775851	13.66612814	34.82548146	26.51651356	24.56968928	22.14918834	39.53801844	19.48510598	14.51131254	18.71070998	21.28436279	11.90912154	27.46999784	30.65021784	30.35402869	15.48575906	6.892223408	21.55033396	20.62578897	45.23504378	38.29596607	54.19281997	13.43830151	40.72979008	37.04830108	36.65929945	43.72113676	42.67791681	47.05641631	28.14832266	23.99345284	17.46608472	39.92244713	25.89127765	38.4461203	35.46839996	17.04455264	39.2719748	17.47119652	47.49999134	22.72038912	26.25776584
doxCer 18:1/24:0	44.86779896	70.75485507	24.56923736	33.84717955	76.03999186	45.8803593	32.66068204	85.00120409	53.20639433	41.74725443	36.68281906	127.7207007	73.13959437	20.62202756	108.6011936	46.30097787	15.97037333	66.36151223	49.92924678	46.24548766	21.03179295	12.39504629	48.05845543	44.56008013	80.05785382	87.85728977	91.30289361	21.07384423	81.72508443	155.0419492	78.27822727	189.3006623	77.98330865	114.5086166	51.66760223	57.31940403	68.68899986	58.28353049	101.9111862	63.9007256	52.05926228	33.81270714	128.0843202	31.22323311	72.77098944	46.23058224	55.5431175
doxCer 18:1/24:1	71.8425584	77.60006396	22.85141171	39.44650087	42.71479039	62.1139837	28.33534847	84.47675433	70.5951247	67.3099156	80.00796153	106.4935441	69.60159173	46.67434792	55.98095578	67.78774046	21.42143875	94.0399319	81.61092202	125.2528008	30.15809982	16.44870948	82.93246497	61.34688977	185.6234712	128.9656891	146.8809893	58.95349262	145.9555902	172.6673957	127.6715248	161.2617588	183.56695	237.7506586	92.7411751	136.8304419	97.06113749	107.6086776	108.3450388	95.74798113	88.06905577	53.86078635	141.8476821	49.89872903	143.3400823	92.08790094	100.5395215
doxDHCer 18:0/16:0	0.233493124	0.176552872	0.177722479	0.063690148	0.048438103	0.090238455	0.128634891	0.094206301	0.04025133	0.195227003	0.03999483	0.071093406	0.11949713	0.122312794	0.322010875	0.210101825	0.033886028	0.00946873	0.09315131	0.107135219	0.063681196	0.034146981	0.219208578	0.078658037	0.157117102	0.15731029	0.110367738	0.191633331	0.23149108	0.047242148	0.254044959	0.193466632	0.046594212	0.357048784	0.121917128	0.233416739	0.142785272	0.007476621	0.103642364	0.099862827	0.012303536	0.075045233	0.164902521	0.402992802	0.171586477	0.092152095	0.304925171
doxDHCer 18:0/18:0	1.546344314	1.5127176	0.645590368	1.187574054	1.192520374	1.392356992	1.246437967	1.233319742	1.425068356	1.422368166	1.319507722	1.367126188	1.368024074	1.153483168	1.549187689	2.048804332	1.514332526	2.126243159	1.568006833	2.053981221	1.280870396	1.258176991	1.848533027	1.937668227	4.256334065	4.308751453	3.696697023	2.819121847	3.733165988	4.519706006	4.128230585	3.603070449	4.544944047	5.602685224	3.390564216	3.636528387	1.927890988	2.116429052	2.570534178	3.23944166	3.508061913	2.061021457	3.302686861	1.824958936	3.066352731	2.65502035	1.999309528
doxDHCer 18:0/20:0	7.475674213	7.437683198	3.559161917	5.500618503	5.14729858	5.76332878	4.521508993	6.198990563	7.346295887	6.118190625	5.813940165	5.006871572	5.662768358	4.743463926	9.466677777	5.650816936	5.057286953	6.223465128	6.015861229	5.555841411	4.043097159	2.868140104	6.057810159	4.752219761	11.74236533	11.07373996	10.4604302	8.511961486	10.70339459	8.284159254	9.712362943	8.014026947	11.33444376	12.41553118	9.831698401	7.761218426	5.708319438	5.2619839	8.248982254	8.674283977	9.796593468	3.59566097	11.6705239	14.40238478	10.5935838	5.3524085	9.591047635
doxDHCer 18:0/22:0	10.0931013	11.010232	5.620809991	7.528379025	6.75104273	7.684971067	5.763941029	7.455389499	10.28513234	8.451887604	8.118736076	7.136000578	7.129355758	7.180228867	12.33363923	8.475353095	8.062766828	10.19998931	7.986156233	8.073231359	5.447267526	3.701904161	9.13211598	6.309780716	15.60175269	13.25670287	14.72983336	12.0624187	14.47742596	10.5515337	11.87224322	9.857388603	15.88501124	15.29678169	12.33608492	8.956491107	4.499958019	6.278492896	8.939026668	12.79724054	12.20458974	4.481052682	13.90142164	18.00929551	15.30425554	7.554511106	12.69668034
doxDHCer 18:0/23:0	2.181108108	2.235525632	0.777872441	1.578294206	1.609888216	1.581357015	1.001927817	2.12396069	1.883003697	1.619616153	1.505971554	1.785984835	1.768731967	1.19813068	3.275551666	1.669723815	1.339227694	1.726160813	1.689151801	1.334874904	1.051618091	0.547692821	1.854863619	1.165808778	2.84240232	3.059959706	2.666917211	2.031626182	2.462526579	2.618582522	2.229618111	2.742345569	2.431334186	3.529646029	2.206132048	1.691786625	0.717210999	1.177645766	2.307611651	2.064471905	2.167494524	0.546504484	3.503289929	3.084226111	2.194234548	1.235571198	1.963240463
doxDHCer 18:0/24:0	9.562184343	8.879865493	3.631193376	6.508900429	5.637252134	7.049679558	4.881300931	7.575374315	12.47277376	6.483719169	6.466509968	6.392008089	5.755574888	6.87504842	14.6630454	7.009500327	5.422899356	7.700815107	7.692464149	7.335597899	3.834266755	3.146577271	9.895472059	6.097535846	12.36032669	11.0304554	10.79459653	7.745741032	11.34210981	7.480421135	11.15718138	8.2858729	11.66930618	13.41552145	9.834736423	7.163731234	2.123423728	4.876314841	7.479382573	9.52187537	10.34481313	2.508688764	9.696948266	13.47875531	9.40530736	5.256931769	8.350911918
doxDHCer 18:0/24:1	2.778065163	2.859612851	1.254155221	1.650418209	1.928522344	2.531790615	1.905339409	2.646144328	3.134832287	2.546978101	2.641481612	2.799776798	2.403724014	2.078782796	3.075675921	2.340903192	2.267931838	2.780269988	2.414211675	2.664686489	1.595872725	1.29191132	2.638250827	1.922947309	6.016387701	4.668433194	5.663980413	3.951401073	4.776841678	3.917990229	4.382524608	3.479607509	6.981098324	6.332510696	5.005602926	3.780307132	2.06004948	2.35887408	2.702504324	4.608149819	4.697360563	2.405235241	4.601197625	5.078027881	4.527859979	3.042809323	3.920695103
Gluc/Gal-Cer 18:1/16:0	554.7416004	637.3536597	442.3018994	557.9100689	419.3789792	477.3988825	443.1614144	694.3162614	652.2375154	373.7716291	453.2456069	565.131972	476.4918567	376.5093277	813.0367165	381.5770386	252.0730722	555.8134334	610.8444547	380.7929228	307.3372587	222.695575	430.3368018	549.177249	589.064364	494.7307815	452.7762123	313.4081187	443.5631654	495.431451	512.0105049	479.6571065	494.4680025	570.6085149	563.3273165	526.3971771	594.1652725	386.6214122	740.221426	505.5876947	503.1072022	311.3920428	459.6487463	604.5906634	583.3810822	303.862117	543.3135329
Gluc/Gal-Cer 18:1/18:0	847.1413961	779.1869079	374.6127294	606.6661503	565.869571	600.9924266	673.9074128	746.5298052	747.0130256	627.3750818	522.7110441	602.8007886	565.7022594	451.1640678	709.0649829	477.097087	276.6711661	688.9747725	600.0758318	491.7332702	348.4549221	303.1285392	523.9865233	643.3316816	656.5714756	668.196748	506.6800263	348.4386148	531.1510666	601.0387319	614.4872119	517.2435562	626.4973741	691.0028893	537.8293209	575.2438164	524.1485802	413.3290155	608.9200421	616.5168975	492.1124841	327.2598148	550.972718	468.7608758	662.5551701	272.0372468	628.6862895
Gluc/Gal-Cer 18:1/20:0	724.7466276	793.0662472	308.7699738	493.3479852	517.9747499	653.5248695	561.3780039	701.6434244	654.0267441	652.4395139	523.6465356	632.5116854	477.3089062	406.4470485	629.6906263	443.6836074	252.0995598	665.2372898	607.1893888	463.4756402	309.3314785	206.9553986	460.8031637	580.1601199	626.4217028	565.3310444	458.5757246	279.9356156	495.0481227	618.7142213	548.2943467	452.7857377	542.3413957	664.6289988	465.2994865	481.707478	420.1571825	372.5361333	500.0571858	564.6974588	496.7531569	326.6365908	511.0798641	435.5747002	613.5514227	264.4322169	574.4545876
Gluc/Gal-Cer 18:1/22:0	2298.997319	2679.096466	773.2478808	1535.063897	1916.51725	1931.938442	1674.287199	2523.314284	2093.973861	1995.957092	1785.234712	2502.257181	1625.481941	1105.950394	2152.592964	1312.533386	740.0529891	2233.417319	2179.617201	1722.253922	924.1634344	721.1944401	1700.447167	2063.867843	2314.490704	2032.041419	1697.083458	742.3754902	1641.871246	2596.219404	1796.879498	2181.923987	1711.52221	2530.557394	1607.56297	1563.113191	1164.150478	1422.080482	2088.932922	1996.967852	1626.947749	1105.947663	2060.386058	1121.569823	1863.321548	875.6353007	1887.845475
Gluc/Gal-Cer 18:1/24:0	6017.779664	6640.731878	2977.162333	3663.547009	9174.7368	5951.040052	4473.57081	6886.527248	6649.752153	4338.197897	4598.018428	11151.99077	6375.446602	3294.345495	8592.424221	3736.2851	1908.736151	5286.093109	4589.343841	4981.246851	3595.74884	2286.575336	5258.953131	5593.97242	6534.649947	7115.681704	4973.691559	1724.625081	3500.164395	12124.68449	4608.720702	10033.26249	4186.275899	8256.878763	4350.685759	3659.890431	4869.432125	3822.093887	8052.491588	5250.245256	2713.877951	3761.04691	9181.211745	1903.337791	4377.999668	2678.679113	4456.893515
Gluc/Gal-Cer 18:1/24:1	11050.43384	13533.50776	6346.316533	9319.168821	11218.52114	8916.992523	9370.233397	13737.19944	11532.966	9492.652308	8783.802155	12994.91069	11732.92556	6782.717489	12282.52004	7088.371458	3420.786101	10785.66437	10741.91333	8306.351565	5451.379102	3824.294978	8027.423244	9498.819008	11002.29327	10860.22999	8073.731041	4692.130864	8599.162432	12525.80079	8496.827118	9953.392729	8503.303341	12605.0217	8844.073932	10886.79841	12840.6137	6603.428871	11028.85628	9200.269466	8078.613655	6259.72304	11908.6654	5361.656858	8925.308963	5068.516814	9177.699461
SO-C18:1	2015.223879	1654.420687	767.3781336	1709.224241	1125.895002	1241.822051	1170.281004	1894.718779	2143.698302	1079.527224	1181.062734	1110.217942	1825.629853	1930.045222	3010.56455	1693.698539	1398.247467	1729.594424	1790.478875	1460.054717	898.13756	851.3093546	2022.610696	1496.665278	1722.435589	1474.279666	1819.272977	1429.596402	1682.19071	1137.751277	1534.681235	1059.798244	1829.046129	2074.576825	1389.112537	1880.705317	1189.948233	1108.675738	1765.220646	1355.366786	1706.491711	136.8645498	1190.604758	2670.149166	1531.782173	1044.282729	1275.477803
SA-C18:0	54.03080505	37.15700397	23.29052793	47.29488742	33.37416458	28.953588	28.21778028	53.47665114	56.08965987	27.38889141	28.80151155	25.30473534	38.24011008	40.42806435	68.22312771	37.27989724	26.70252663	37.73149898	45.99829496	30.09965311	22.29295224	21.83184821	44.65408919	38.60515949	33.00104947	24.20325335	32.35655483	24.47644523	27.28214599	22.30418511	32.70227031	24.76191739	34.52445129	31.17158415	26.63541279	36.81092199	22.65896326	21.52855882	29.65301887	24.81668766	34.7044205	5.304582087	24.2334054	42.86077933	23.47721045	15.57143938	20.69652413
doxSA-C18:0	8.861611055	9.444399528	3.5354349	6.901005101	4.358130721	6.184194011	3.191885533	6.144268946	11.27589504	5.145173541	5.858271202	5.079459982	8.952740461	8.11819614	14.34651046	9.053509282	6.5587908	9.240427369	7.385426598	7.063572955	2.868598335	3.063217971	11.74724911	6.519298536	11.19721592	7.563245374	10.39645026	8.257972606	10.30219979	7.605205708	8.370468442	5.827116922	9.282947006	11.47347713	5.751883693	10.85484754	3.719496478	4.001943914	6.092550638	8.364475064	9.269516844	1.091858105	7.2906915	10.90829163	7.713106119	4.327099746	6.016003734
SM-C14:0	371.6727678	316.2830955	238.1606682	467.0813818	251.4221287	283.9097906	304.4354048	445.4070023	365.0850433	263.8535319	250.4588751	212.3254303	246.2794577	238.8128042	498.8574768	167.9609098	262.8146253	167.3991225	261.4978168	132.7925382	121.4417662	180.8690336	189.239443	188.9687422	202.5114275	151.8265354	145.1368062	174.873313	192.5813501	139.238823	199.3402526	150.1056386	286.5587662	166.2754906	210.1568726	136.785291	142.0661389	149.6802713	253.6838919	165.288607	226.3517534	70.79974112	145.6673304	368.7455083	191.6904359	90.70483692	180.688601
SM-C16:0	8926.832697	8059.131904	7641.211675	6993.355638	6082.67401	7102.519653	6457.460036	7452.484647	7934.900492	7163.80821	6969.615216	6252.1732	7711.81558	6390.293818	10631.93516	7272.56643	6949.468344	7840.638808	7900.085115	7745.871825	6712.598357	6523.589074	6661.416406	6796.020411	7971.994115	6918.726962	6828.975909	6374.246006	6685.355766	6257.928273	6559.026784	5590.627123	8150.092971	7186.007678	7200.748842	5849.465689	5348.04401	5321.95307	7751.803603	7069.615038	7142.753689	5245.680016	7093.439837	9662.889776	6930.42307	5120.225909	6427.652192
SM-C18:0	4735.883022	4010.433394	2725.18052	3678.716235	4248.833664	3650.830779	3880.951083	3413.626633	3528.145904	4426.84172	3553.748306	3227.090184	3544.69943	3543.084316	4349.496712	3975.042045	3676.550223	3627.062968	3720.527767	3639.633769	3992.273344	3754.782795	3326.601427	3539.688551	3468.091427	4072.419432	3067.644713	3551.512171	3537.981885	3375.889414	3473.30648	2668.430476	3661.795264	3347.739218	3710.730512	2721.827717	1886.853917	2033.457386	3048.572398	2843.735331	3266.767769	2292.534628	3080.142584	2575.158516	3008.064781	2055.231361	2514.914823
SM-C18:1	367.56055	333.5425547	142.3402171	264.6990049	306.9694385	317.4858113	276.4877978	304.0978636	322.7040407	341.0101271	320.2676735	332.138032	354.2623738	319.823157	359.4568304	371.3282383	236.0122984	433.85937	396.1581961	402.6986047	421.0750695	322.8445201	363.8245855	378.7367701	381.3250351	366.8555098	379.1486881	251.9307897	361.7301718	356.2689567	312.381129	293.2219021	266.3928369	357.7951358	357.2089125	328.4861698	311.1360932	294.0523401	253.4188239	346.6786262	354.2653873	241.2799615	295.2656064	167.9649172	307.0671039	254.1954263	227.7668554
SM-C20:0	2050.711721	2101.767818	1068.360671	1799.768493	1224.837874	2059.820478	1626.689244	2236.001339	1603.34317	1861.212994	1799.114597	1618.366856	1578.961011	1323.785462	2766.058735	1417.940549	1116.001057	1651.530378	1869.044192	1567.670823	1221.02064	1202.194504	1508.279379	1446.457869	1859.607797	1670.256865	1616.135008	865.1099148	1633.881831	1628.256915	1645.285641	1525.994321	1853.542786	1773.058741	1289.657443	724.6230837	631.4446173	1306.648427	2108.335979	1539.707572	1274.364088	993.9213701	1678.211652	1478.391173	493.3591292	1008.929831	1768.531239
SM-C20:1	65.33360329	60.4191658	54.55550229	47.92221128	44.67804153	51.59153094	57.39605842	52.30730467	49.65476257	54.13540452	45.17440215	39.93801956	69.72713002	52.21158456	84.05897343	45.25778186	34.56333588	58.36951397	56.39048492	53.32729085	53.39778829	56.65026813	45.93984463	46.72336507	47.12912388	54.04515137	36.45478868	49.3501797	56.53844424	50.73420379	57.42565349	34.96167499	39.04729262	45.50624791	48.25742579	42.66358329	38.42084239	28.536583	52.96684075	39.26732341	53.59996199	34.74246704	42.75158531	72.77579729	44.42643522	22.60575814	41.98438067
SM-C22:0	3620.301517	3624.025358	1476.76127	2486.162776	2478.235787	3345.656816	2274.760026	3378.82193	3410.362338	2940.654651	3131.172931	3111.877282	2288.722432	2258.932888	3677.8491	2374.471637	1643.558992	3348.743069	3376.8051	3266.835504	2388.237063	1761.886266	2936.911837	2580.1455	3594.273788	2943.214314	3475.992116	1836.14457	2869.689629	3140.617335	2858.764626	3051.013807	3272.564935	3314.741345	2900.485952	1324.705194	1186.239357	2368.354206	3195.058469	2788.856574	2721.742821	1682.342544	2903.879053	2282.290496	3108.74999	1843.482703	2488.319492
SM-C22:1	158.4708543	176.9381342	107.3420488	109.6466825	166.7058779	161.1305072	109.95075	179.8078519	150.7599098	130.490586	129.1883241	133.8624419	196.5329972	111.0339485	226.0625495	133.7035339	71.28891215	167.4312082	183.2656904	157.3645025	139.4505917	116.7181976	159.5860378	137.3106746	192.1031086	162.1873086	168.2682194	85.57333884	126.0356125	181.1724787	118.0671973	171.8836411	94.96362491	180.1114871	136.3493581	115.6057723	127.338566	99.74526681	144.159653	110.9299161	112.408088	85.91896499	157.4893703	82.13352549	97.53502081	62.49014653	96.39619363
SM-C24:0	1750.731965	2167.137055	1097.799263	1318.044223	1985.758013	1860.484724	1253.025449	2406.647871	2106.663483	1620.923713	1639.35068	2508.368886	1410.94544	967.7207402	2572.797966	1213.226276	770.0015072	1644.398791	1715.537429	1575.725785	944.1586076	900.0095061	1516.49503	1527.400595	2101.936187	1829.630358	1694.219836	827.4428105	1386.209424	2256.427172	1570.246797	1960.796293	1748.610706	2121.310692	1382.66498	755.2364937	693.4859618	1417.281339	2373.485817	1665.883946	1314.255762	890.292366	2202.50848	1127.435265	1635.592142	900.287994	1438.395848
SM-C24:1	10354.27132	9023.105616	5467.975163	6964.870469	6730.149492	7980.556734	7062.561726	8488.81566	8499.546943	8062.465104	7653.922092	6887.649946	6543.320333	6102.192915	7859.856436	6321.37724	4736.478628	7268.480576	7258.05738	7109.278407	6002.891445	4898.749649	6368.571339	5807.689608	7227.565886	6380.340038	6609.350982	4637.374989	6453.109869	6021.667704	6037.778677	5253.846825	7486.496669	6821.605667	6513.234439	5506.091932	5754.733286	5198.253133	6422.192771	6014.640847	6332.43286	4341.587461	6352.823024	6104.759088	6814.789382	4537.400168	5813.412877

metabolite_name	KEGG	PubChem identifiers
Cer 18:1/16:0	C00195 	3495
Cer 18:1/18:0	C00195 	3495
Cer 18:1/20:0	C00195 	3495
Cer 18:1/22:0	C00195 	3495
Cer 18:1/22:1	C00195 	3495
Cer 18:1/23:0	C00195 	3495
Cer 18:1/24:0	C00195 	3495
Cer 18:1/24:1	C00195 	3495
DHCer 18:0/18:0	C12126  	14273
DHCer 18:0/20:0	C12126  	14273
DHCer 18:0/22:0	C12126  	14273
DHCer 18:0/23:0	C12126  	14273
DHCer 18:0/24:0	C12126  	14273
DHCer 18:0/24:1	C12126  	14273
doxCer 18:1/18:0	0	0
doxCer 18:1/20:0	0	0
doxCer 18:1/22:0	0	0
doxCer 18:1/22:1	0	0
doxCer 18:1/23:0	0	0
doxCer 18:1/24:0	0	0
doxCer 18:1/24:1	0	0
doxDHCer 18:0/16:0	0	0
doxDHCer 18:0/18:0	0	0
doxDHCer 18:0/20:0	0	0
doxDHCer 18:0/22:0	0	0
doxDHCer 18:0/23:0	0	0
doxDHCer 18:0/24:0	0	0
doxDHCer 18:0/24:1	0	0
Gluc/Gal-Cer 18:1/16:0	C01190	4416
Gluc/Gal-Cer 18:1/18:0	C01190	4416
Gluc/Gal-Cer 18:1/20:0	C01190	4416
Gluc/Gal-Cer 18:1/22:0	C01190	4416
Gluc/Gal-Cer 18:1/24:0	C01190	4416
Gluc/Gal-Cer 18:1/24:1	C01190	4416
SO-C18:1	C00319	3613
SA-C18:0	C00836	4094
doxSA-C18:0	0	0
SM-C14:0	C00550	3831
SM-C16:0	C00550	3831
SM-C18:0	C00550	3831
SM-C18:1	C00550	3831
SM-C20:0	C00550	3831
SM-C20:1	C00550	3831
SM-C22:0	C00550	3831
SM-C22:1	C00550	3831
SM-C24:0	C00550	3831
SM-C24:1	C00550	3831