#METABOLOMICS WORKBENCH ryanfunk_20190703_092013 DATATRACK_ID:1756 STUDY_ID:ST001211 ANALYSIS_ID:AN002019 PROJECT_ID:PR000814
VERSION             	1
CREATED_ON             	July 12, 2019, 1:41 pm
#PROJECT
PR:PROJECT_TITLE                 	Metabolic Markers of Methotrexate Response
PR:PROJECT_TYPE                  	In Vitro
PR:PROJECT_SUMMARY               	Untargeted metabolomics study of methotrexate pharmacological response.
PR:INSTITUTE                     	University Of Kansas
PR:DEPARTMENT                    	Pharmacy Practice
PR:LABORATORY                    	Funk
PR:LAST_NAME                     	Funk
PR:FIRST_NAME                    	Ryan
PR:ADDRESS                       	2106 Olathe Boulevard, Kansas City, Kansas, 66160, USA
PR:EMAIL                         	ryanfunk@kumc.edu
PR:PHONE                         	9139456904
PR:FUNDING_SOURCE                	KL2TR002367
#STUDY
ST:STUDY_TITLE                   	Metabolomic Markers of Methotrexate Response, In Vitro
ST:STUDY_SUMMARY                 	Erythroblastoid cells (K562) maintained in logarithmic growth phase were treated
ST:STUDY_SUMMARY                 	with 1000 nM methotrexate or vehicle alone (i.e. D-PBS) under standard culture
ST:STUDY_SUMMARY                 	conditions for 24 hours. Cellular response to methotrexate was measured based on
ST:STUDY_SUMMARY                 	anti-proliferative activity by cell counting. Cells were washed, flash frozen in
ST:STUDY_SUMMARY                 	liquid nitrogen and submitted for metabolomics analysis to the NIH West Coast
ST:STUDY_SUMMARY                 	Metabolomics Center.
ST:INSTITUTE                     	University Of Kansas
ST:DEPARTMENT                    	Pharmacy Practice
ST:LABORATORY                    	Funk Lab
ST:LAST_NAME                     	funk
ST:FIRST_NAME                    	ryan
ST:ADDRESS                       	2106 Olathe Boulevard
ST:EMAIL                         	ryanfunk@kumc.edu
ST:PHONE                         	9135885000
ST:NUM_GROUPS                    	2
ST:TOTAL_SUBJECTS                	20 samples
#SUBJECT
SU:SUBJECT_TYPE                  	Cultured cells
SU:SUBJECT_SPECIES               	Homo sapiens
SU:TAXONOMY_ID                   	9606
SU:AGE_OR_AGE_RANGE              	53 years
SU:GENDER                        	Female
SU:CELL_BIOSOURCE_OR_SUPPLIER    	Coriell
SU:CELL_STRAIN_DETAILS           	GM05372
SU:CELL_PRIMARY_IMMORTALIZED     	Epstein-Barr Virus
SU:CELL_PASSAGE_NUMBER           	Six
SU:CELL_COUNTS                   	15 million
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	-	1	Group:Control	
SUBJECT_SAMPLE_FACTORS           	-	2	Group:Control	
SUBJECT_SAMPLE_FACTORS           	-	3	Group:Control	
SUBJECT_SAMPLE_FACTORS           	-	4	Group:Control	
SUBJECT_SAMPLE_FACTORS           	-	5	Group:Control	
SUBJECT_SAMPLE_FACTORS           	-	6	Group:Control	
SUBJECT_SAMPLE_FACTORS           	-	7	Group:Control	
SUBJECT_SAMPLE_FACTORS           	-	8	Group:Control	
SUBJECT_SAMPLE_FACTORS           	-	9	Group:Control	
SUBJECT_SAMPLE_FACTORS           	-	10	Group:Control	
SUBJECT_SAMPLE_FACTORS           	-	11	Group:Methotrexate	
SUBJECT_SAMPLE_FACTORS           	-	12	Group:Methotrexate	
SUBJECT_SAMPLE_FACTORS           	-	13	Group:Methotrexate	
SUBJECT_SAMPLE_FACTORS           	-	14	Group:Methotrexate	
SUBJECT_SAMPLE_FACTORS           	-	15	Group:Methotrexate	
SUBJECT_SAMPLE_FACTORS           	-	16	Group:Methotrexate	
SUBJECT_SAMPLE_FACTORS           	-	17	Group:Methotrexate	
SUBJECT_SAMPLE_FACTORS           	-	18	Group:Methotrexate	
SUBJECT_SAMPLE_FACTORS           	-	19	Group:Methotrexate	
SUBJECT_SAMPLE_FACTORS           	-	20	Group:Methotrexate	
#COLLECTION
CO:COLLECTION_SUMMARY            	Cells were counted, a volume containing 15 million cells were collected, washed
CO:COLLECTION_SUMMARY            	with
CO:SAMPLE_TYPE                   	K562
CO:STORAGE_CONDITIONS            	-80℃
CO:TISSUE_CELL_QUANTITY_TAKEN    	15 million cells
#TREATMENT
TR:TREATMENT_SUMMARY             	Cells were maintained under normal growth conditions in a humidified,
TR:TREATMENT_SUMMARY             	temperature- and CO2-controlled incubator at 37ºC and 5% CO2. Cells were kept
TR:TREATMENT_SUMMARY             	at density between 2.0x105 and 1.0x106 cells/mL to maintain logarithmic growth
TR:TREATMENT_SUMMARY             	conditions to promote maximum proliferative activity over the experimental
TR:TREATMENT_SUMMARY             	period. All experiments were conducted within six passages following removal
TR:TREATMENT_SUMMARY             	from cryopreservation. On the day of experimentation, K562 cells were seeded at
TR:TREATMENT_SUMMARY             	a density of 4.0x105 cells/mL and exposed to 1000 nM MTX or D-PBS (i.e. vehicle)
TR:TREATMENT_SUMMARY             	for 24 hours under normal growth conditions.
TR:TREATMENT_COMPOUND            	Methotrexate
TR:TREATMENT_ROUTE               	In Media
TR:TREATMENT_DOSE                	1000 nM
TR:TREATMENT_DOSEDURATION        	24 hours
TR:TREATMENT_VEHICLE             	Dulbecco's Phosphate Buffered Saline (without Calcium/Magnesium)
TR:CELL_STORAGE                  	Liquid Nitrogen
TR:CELL_GROWTH_CONTAINER         	T-175 Flask
TR:CELL_GROWTH_CONFIG            	Suspension
TR:CELL_INOC_PROC                	Seeded at 4.010^5 cells/mL
TR:CELL_MEDIA                    	RPMI 1640 medium (catalog no. 61870-127, ThermoFisher Scientific, Waltham, MA)
TR:CELL_MEDIA                    	supplemented with 10% fetal bovine serum (catalog no. S11150, Atlanta
TR:CELL_MEDIA                    	Biologicals, Lawrenceville, GA) along with 100 units/mL penicillin and 1,000
TR:CELL_MEDIA                    	units/mL streptomycin (catalog no. 15140122, ThermoFisher Scientific, Waltham,
TR:CELL_MEDIA                    	MA)
TR:CELL_ENVIR_COND               	humidified, temperature- and CO2-controlled incubator at 37ºC and 5% CO2
TR:CELL_HARVESTING               	Counted and a volume containing 15x10^6 cells were collected, washed, flash
TR:CELL_HARVESTING               	frozen in liquid nitrogen
TR:CELL_PCT_CONFLUENCE           	NA
TR:CELL_MEDIA_LASTCHANGED        	24 hours prior to collection
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Cell pellets were sent to the West Coast Metabolomics Center and were processed
SP:SAMPLEPREP_SUMMARY            	on laboratory Standard Operating Procedures for Sample Preparation of Blood
SP:SAMPLEPREP_SUMMARY            	Plasma or Serum Samples for Lipidomic, Biogenic Amine, and Primary Metabolomic
SP:SAMPLEPREP_SUMMARY            	Analysis using a biphasic MeOH/MTBE/Water extraction procedure. The upper
SP:SAMPLEPREP_SUMMARY            	organic phase was used for lipidomics analysis and the aqueous phase was used
SP:SAMPLEPREP_SUMMARY            	for analysis of primary metabolism and biogenic amines.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	Lipidomics
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
CH:INSTRUMENT_NAME               	Agilent 6530
CH:COLUMN_NAME                   	Waters Acquity CSH C18 (100 x 2.1mm, 1.7um)
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:ANALYSIS_PROTOCOL_FILE        	Fiehn_laboratory_Lipidomics_CSH_QTOF_lipidomics.pdf
#MS
MS:INSTRUMENT_NAME               	Agilent 6550 QTOF
MS:INSTRUMENT_TYPE               	QTOF
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	NEGATIVE
MS:MS_COMMENTS                   	MS acquisition, data processing, and feature assignments were conducted at the
MS:MS_COMMENTS                   	West Coast Metabolomics Center. Please reference the attached protocols.
MS:MS_RESULTS_FILE               	ST001211_AN002019_Results.txt	UNITS:Peak height	Has m/z:Yes	Has RT:Yes	RT units:Minutes
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	Peak height
MS_METABOLITE_DATA_START
Samples	1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20
Factors	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Methotrexate	Group:Methotrexate	Group:Methotrexate	Group:Methotrexate	Group:Methotrexate	Group:Methotrexate	Group:Methotrexate	Group:Methotrexate	Group:Methotrexate	Group:Methotrexate
Ceramide (d18:1/17:0) iSTD	885672	904029	878172	858226	817067	920316	707067	849932	923002	888614	886951	861661	851363	817857	894920	757343	830377	806063	815989	868696
CUDA iSTD	91740	90531	87265	92487	82290	88993	78769	84393	89311	90813	91393	90825	89495	87179	88200	80121	82017	84990	87486	86725
FA (16:0)-d3 iSTD	662809	607577	613263	591234	528159	644672	482778	598991	602033	600087	619445	602794	575211	596594	566540	498692	515379	576357	597254	650376
LPC (17:0) iSTD	213064	203272	206254	191109	182518	220115	193470	199528	206248	208146	205686	200976	211903	201652	195359	182068	181978	191074	201528	211803
LPE (17:1) iSTD	201162	193480	194704	179734	166241	195285	168946	180112	191653	194046	190064	188566	186760	181357	179723	165788	164686	170718	178907	202419
MAG (17:0/0:0/0:0) iSTD	755376	724949	728449	615176	615182	641932	483635	666047	689138	765051	705192	711784	673985	706500	632438	616542	613083	666889	623009	728315
PC (12:0/13:0) iSTD	6590	6541	6494	6366	5729	6831	5169	6074	6555	6612	6046	6296	5891	6363	6054	5584	5825	6116	6333	6867
PE (17:0/17:0) iSTD	342548	318433	316440	319525	255005	345229	243753	312141	337327	315664	301015	327500	263730	289685	253826	190484	336202	335541	283746	286457
PG (17:0/17:0) iSTD	2156249	2154776	2095112	1972734	1419946	1977843	1709106	1879476	2020647	2061107	1892160	2018576	1832750	1992873	1665081	1433819	1934456	2045420	1977411	2087232
SM (d18:1/17:0) iSTD	66373	57793	64724	55879	22281	59697	40624	44314	48803	44252	25764	31292	23586	33672	16793	14427	24666	27964	27734	29925
Ceramide (d32:1)	41324	34163	29245	28018	15591	32767	28389	26983	31486	28099	61727	67578	62040	73708	37314	33072	76442	83182	87563	71298
Ceramide (d33:1)	21779	19215	15583	14632	6532	15978	12988	13198	14774	14818	19983	23197	19969	25543	12247	10930	23903	25381	26267	23288
Ceramide (d34:0)	16047	13689	11746	10856	4693	12093	9160	10200	10479	9389	21866	24473	21325	30029	13044	10378	21286	23544	24731	23748
Ceramide (d34:1)	610708	536534	472756	452227	296331	514693	446375	470477	506330	445590	817746	850334	837960	920819	632469	556006	975937	1002112	1021667	873361
Ceramide (d34:2)	180296	150728	121654	113779	52524	129135	115565	106298	132398	113340	183975	195397	182445	204200	102850	92282	182565	200793	212623	188314
Ceramide (d36:1)	37191	32343	29362	27321	12781	31618	24383	25697	28909	23857	47611	58690	48676	69410	32245	26771	70455	81162	79175	56205
Ceramide (d38:1)	8934	6643	6629	5650	2623	6520	4886	5836	5899	5187	12573	15103	12123	18764	7552	6732	17744	22449	21628	15376
Ceramide (d40:1)	111314	90972	90185	80152	33036	83108	68716	83557	78103	72475	141146	165047	135638	211890	90948	79112	218290	260783	250050	177994
Ceramide (d42:0)	25692	21278	19595	19644	9044	20965	15190	16736	20751	20033	27426	30707	27472	36962	19593	15368	44556	52665	53519	25859
Ceramide (d42:1)	896734	815888	799683	729529	368440	753967	675138	729882	715578	670236	721552	796237	704221	976450	511822	456289	1062253	1225039	1182923	870015
Ceramide (d42:2) A	159153	148143	144773	132170	75998	134944	129242	140295	134153	123201	222666	248078	216931	266634	170375	162961	263725	288959	286163	290615
Ceramide (d42:2) B	579211	505489	494222	436406	200713	437992	413509	443893	428466	394801	615061	706807	584231	847649	396514	359361	843242	990246	955306	834791
Ceramide (d44:1)	32109	27033	26729	25714	11757	26314	20251	23035	23726	21089	19866	23950	20297	30049	13561	12285	36472	41316	41465	25035
FA (14:0) (myristic acid)	67223	41993	78088	66158	28102	65326	41890	72793	41138	44786	64968	75104	60527	75779	41462	39845	75727	89662	81341	93894
FA (14:1) (physeteric acid)	1903	1084	2069	1867	795	1606	1169	1993	1329	1464	3278	2676	3375	3324	1934	1666	2450	2757	3210	4781
FA (16:1) (palmitoleic acid)	26557	15859	35964	29200	10561	20024	14354	28812	17245	14400	47430	91830	45328	87867	37661	33216	65544	82637	70324	83404
FA (18:1) (oleic acid)	524274	335502	669042	546236	248407	464073	309087	537161	344737	316983	1062611	1442613	1055089	1510594	762404	686718	1127181	1332957	1347350	1724970
FA (18:2) (linoleic acid)	13801	9594	17394	14285	10637	14510	11736	16466	3558	9533	27685	54479	27715	51519	25659	22549	39872	51891	41373	47410
FA (20:1) (eicosenoic acid)	119638	72664	136190	111543	44829	78636	69868	107501	65515	71632	291970	306731	281071	330297	172306	150091	215666	244997	273538	357018
FA (20:2) (eicosadienoic acid)	25442	16826	28402	23026	9724	18340	15709	22421	14972	15209	121204	127907	117575	133996	67914	57370	70669	76835	99174	134988
FA (20:3) (eicosatrienoic acid)	1609	1406	2501	1780	787	1353	1262	1931	1317	1230	6671	9147	7055	9648	4728	4215	7779	9688	9012	10472
FA (20:3) (homo-gamma-linolenic acid)	2056	1406	3012	2338	787	1669	1262	2189	1317	1230	5673	10048	5332	9792	4486	4065	7653	9424	8583	11129
FA (20:4) (arachidonic acid)	10050	7615	19462	13413	3415	8779	6075	14094	6225	5696	59982	142986	57965	139596	59901	55860	119799	144483	115276	162008
FA (20:5) (eicosapentaenoic acid)	1599	1486	1336	2045	723	1598	1180	1996	1180	1130	6129	14667	6278	15094	6359	5436	10710	14576	12825	17291
FA (22:1) (erucic acid)	60765	43297	48966	39948	19757	39684	35124	34108	36573	33980	64979	68193	58453	66702	35891	32309	49586	60314	60006	64175
FA (22:2) (docosadienoic acid)	26708	18966	25019	22299	9547	18271	16196	18973	15864	16093	113615	117921	111631	111659	58355	48758	63775	70096	86674	108731
FA (22:6) (docosahexaenoic acid)	15585	11540	24741	18196	5371	12256	9595	19283	9362	8794	79681	106960	78931	114719	53461	48838	100993	123731	125291	107760
FA (26:0) (cerotic acid)	71633	54242	53049	46794	19385	45842	37399	43211	44382	38852	20995	22634	20181	24027	13882	12130	20631	22831	23044	18626
GlcCer (d40:1)	134985	116297	132259	106697	50987	111253	99304	112913	108630	102708	192938	213476	174700	260769	126349	117791	213867	253939	244677	195092
GlcCer (d41:1)	20121	17886	19540	15422	7248	16115	14748	16590	15322	14918	25855	30291	23873	37597	15103	14682	29055	36092	33927	29475
GlcCer (d42:1)	439772	410454	446111	378769	190086	376846	365396	381804	358757	359697	393732	426235	359227	521693	267747	256541	474762	535267	527748	406527
GlcCer (d42:2)	223243	199952	229400	186438	90320	189997	161511	177830	190564	173908	343351	388942	312558	436796	217583	209842	346188	414013	400643	396499
GlcCer(d14:1(4E)/20:0(2OH))	2596	1750	1559	2396	422	2282	2183	2398	2409	2508	2319	1901	1873	2888	1384	692	2728	3583	2566	2405
LPC (14:0)	2998	2593	2688	1968	882	2451	2908	2265	2429	2204	585	1056	541	988	442	467	1086	1338	1305	1185
LPC (16:0)	167491	140958	156560	127985	52191	136281	139894	130515	133701	116135	51744	89199	52966	92704	36169	35732	87503	109683	93173	80342
LPC (16:1)	3020	2613	3111	2358	986	2428	3217	2369	2374	2113	807	1406	801	1402	580	574	1412	1793	1402	1279
LPC (18:0) A	110857	87849	94780	80805	33130	92295	2181	92488	84738	77773	32327	51655	33226	60472	24213	22327	53568	67434	59107	45979
LPC (18:0) B	110857	87849	94780	80805	33130	92295	84852	92488	84738	77773	32327	51655	33226	60472	24213	22327	53568	67434	59107	45979
LPC (18:1)	33540	27858	31494	25935	10221	28104	35055	27254	27224	23044	14329	27760	15145	28479	11807	10924	26264	33145	27719	26888
LPC (18:2)	391	429	339	312	121	344	513	305	312	233	378	537	345	645	219	259	713	817	687	585
LPC (20:1)	1302	3815	4073	3358	1538	3739	3901	3593	3964	3237	2224	4023	2219	4211	1837	1764	3391	4220	3827	3666
LPC (20:2)	711	532	655	587	347	650	693	579	637	459	678	1316	600	1274	681	561	866	1112	1074	1015
LPC (20:3)	244	253	247	202	95	247	273	222	167	196	123	237	127	254	91	121	271	249	237	193
LPC (22:5)	359	323	356	274	162	317	321	328	222	215	246	381	231	376	171	149	402	482	467	290
LPC 20:4;	375	324	363	286	134	333	530	307	318	228	527	947	496	876	375	247	1052	1250	1055	647
LPE (16:0)	61052	49968	58423	45998	18721	45507	42409	44179	40630	39342	14378	23926	13939	23435	9509	9352	23702	28286	27777	18244
LPE (18:2)	1473	978	1486	757	465	1027	1599	1121	1012	914	1235	1855	1014	2047	936	624	2297	2651	2559	1363
LPE (20:4)	6342	4018	6849	3472	2005	4157	6745	4369	4289	3795	7051	12201	6489	12049	5578	3469	12503	14213	13822	8183
LPE (22:6)	2340	1594	2463	1507	868	1794	2505	1730	1618	1495	2927	4626	2497	4647	2052	1461	4618	5260	5118	3134
LPE 18:0;	296040	238916	273537	212222	89823	221183	198757	216248	198554	181969	80853	127347	80033	145893	56630	52449	151724	177239	177084	112409
PC (32:0)	177177	170202	172186	160051	101972	167802	152052	149523	155899	151552	65922	71132	61904	73980	46702	45893	83676	89973	89584	67662
PC (32:1)	543061	514457	538228	492615	334164	486098	441805	453509	465450	451902	276738	308414	258272	321814	214466	205501	364396	394609	379704	291408
PC (32:2)	26163	24907	26145	24287	17699	24174	21238	21781	23612	22589	8187	9115	7589	9925	7126	6263	11120	11044	11413	8115
PC (33:1)	67442	64211	66315	59764	40351	60000	55168	57596	56793	56440	49324	54859	45707	62786	36488	35089	63809	68730	65830	53652
PC (33:2)	29317	28300	23315	23362	3259	22075	17882	17117	21220	18803	43468	54618	36889	78322	20820	12941	62143	68776	61100	62133
PC (34:0)	149388	137696	142630	136621	83178	145482	123506	131625	133926	120978	59379	65112	55881	76277	46804	41611	79689	85242	83928	66892
PC (34:1)	2264431	2165055	2188135	2064451	1252105	2036626	1815787	1898514	1947173	1830926	1991856	2280332	1877768	2507730	1503244	1426263	2371082	2639547	2528461	2403390
PC (34:2)	195818	188798	198345	178477	108154	175751	159433	156387	166454	160267	122857	144738	117008	157209	90227	86750	162840	180761	170559	141700
PC (34:3)	7746	7114	7581	7017	5084	7177	6216	6601	6540	6241	4897	5461	4795	5879	3878	3838	6758	7251	6883	5415
PC (34:4)	6421	6256	6467	5999	4012	6375	5268	5640	6240	5339	5176	6075	5122	6287	4293	3987	7524	8082	7760	5629
PC (35:1)	44053	41664	42346	40367	24412	41608	36580	40211	39414	35288	41877	48747	41485	57919	33790	30908	55163	59537	59575	52112
PC (35:2)	25760	24931	26354	24097	15489	23634	21388	22892	22730	22403	6012	6812	5686	29725	4750	4441	7188	7755	7455	26919
PC (35:4)	1179	945	971	708	487	627	742	741	699	691	1092	1394	1011	1583	922	754	1340	1217	1144	1571
PC (36:1)	1117841	976397	1030111	980967	598274	1035842	894296	994663	956480	862080	797010	859678	770209	1055079	636525	570837	1023910	1084854	1079756	976982
PC (36:2)	199051	196443	208205	189015	109258	173732	150854	161670	172481	159667	197206	222816	176253	247549	145488	135503	225525	246496	235418	218910
PC (36:3) A		264	180	298	790	614	654	589	698	713	390	267	740	287	722	335	329	182	571	498
PC (36:3) B	33383	30832	32436	30765	20782	30159	26239	27673	28199	27005	33818	40290	33358	41191	26433	25102	42955	46947	44186	38237
PC (36:4) A	4087	3741	4142	3659	2671	3797	3428	3908	3802	3218	2955	3478	2832	3499	2373	2446	4016	4425	4070	3523
PC (36:4) B	50954	44686	46986	42892	27076	44540	36278	39032	43748	37553	69650	85806	71033	85509	53779	51926	88214	98684	95209	69446
PC (36:5) A	6629	3063	5176	4677	5441	9833	4462	5711	7959	5850	5042	6515	5465	6433	4105	4200	7637	8159	8011	5617
PC (36:5) B	13210	12032	12891	11994	7848	11412	10637	11604	11769	10706	16011	18383	15675	18388	12926	12123	21139	23728	22665	16557
PC (37:4)	983	922	915	850	689	957	897	936	942	908	1495	1623	1489	1712	1192	1141	1706	1797	1958	1350
PC (38:2)	104742	94005	104179	96954	54902	96064	80162	86808	96161	83323	102487	113957	97110	135564	77971	68857	108834	119772	118002	136707
PC (38:3)	25982	24417	26896	25143	14533	23756	20416	22390	22986	20715	33220	39392	30804	42745	25744	23306	36424	39696	38734	37891
PC (38:4) A	17637	15838	15745	14826	8840	16039	12524	14638	14874	13262	22110	26652	22460	28703	17446	15617	29077	31497	30440	23272
PC (38:5) A	61509	52961	57601	50336	24214	49768	44349	45487	46875	42734	57357	72475	59707	78353	43275	39536	77653	88170	86855	67351
PC (38:5) B	8797	7420	7462	7226	4363	6974	5770	6709	6622	6350	9801	12321	10082	13597	7276	6723	13176	14904	14314	10762
PC (38:6)	38172	33541	36739	31080	18091	30456	25339	29028	29593	26425	39777	49341	38983	50850	27010	28880	55024	61793	59703	43443
PC (40:5) A	8522	8073	7724	7317	4215	7612	6359	7194	7275	6582	10975	12584	11138	14147	8280	7572	14038	15014	14666	11549
PC (40:5) B	1902	1727	1481	1807	702	1467	928	1467	1585	1609	877	962	794	1086	687	722	1117	1190	1258	871
PC (40:6) B	56661	53630	51280	47802	16024	36559	37005	43231	37134	39231	19339	21754	19167	23727	14560	12718	25584	28603	26631	24644
PC (40:7)	46716	43087	44661	36755	8157	29250	55172	30968	30020	30677	52168	73420	46501	89716	24666	21148	72644	98515	91286	74480
PC (p-34:0) or PC (o-34:1)	376663	363515	375764	359492	214931	355198	312750	325684	340194	317558	272342	304851	259286	342659	216070	192818	296243	317769	313056	319285
PC (p-34:1) or PC (o-34:2) A	15903	15001	15873	14266	9079	13805	12516	13065	13659	13019	12675	13966	11821	16475	9841	9373	13356	14260	13828	14143
PC (p-34:1) or PC (o-34:2) B	137153	132996	135548	129166	73577	120699	104338	110766	117406	107616	144350	161647	131924	182448	108712	96430	152717	167356	159885	169663
PC (p-34:2) or PC (o-34:3)	5092	4653	5016	4540	3181	4495	3709	4093	4232	4070	6576	7620	6279	7981	5208	5244	6822	7342	7809	7010
PC (p-36:1) or PC (o-36:2)	47941	44706	48591	45767	25220	43792	34864	37618	42768	37043	43969	51448	41787	59840	33903	29741	44861	49135	48772	57613
PC (p-36:2) or PC (o-36:3)	2175	2442	2314	2035	1422	2330	2018	1882	1995	1851	3073	3570	2813	3798	2337	2249	2935	3232	3249	3477
PC (p-36:3) or PC (o-36:4)	17643	16227	17125	16889	9894	16298	12953	14421	15799	14933	13317	16309	13531	17797	11303	9974	15253	16313	15967	13941
PC (p-36:4) or PC (o-36:5)	8636	7511	7852	7448	4249	6964	5739	6213	6689	6239	11560	15268	12060	14244	9572	8577	12199	13323	13030	11618
PC (p-38:4) or PC (o-38:5) A	9162	8748	9598	9051	5517	8869	7269	7837	8610	8020	10328	12929	10466	13115	8358	7696	10752	12183	11253	10735
PC (p-38:4) or PC (o-38:5) B	1487	1425	1605	1498	784	1401	1218	1340	1454	1188	3334	4025	3347	4192	2869	2528	3962	3982	4012	3072
PC (p-38:5) or PC (o-38:6)	5436	4463	5286	5003	3002	4874	3824	4220	4465	4302	6956	4454	3709	4623	2997	2795	4230	4713	4072	6537
PC (p-40:3) or PC (o-40:4)	976	838	767	747	471	886	689	704	842	769	1108	1124	1094	1433	901	845	1026	1232	1167	1142
PC (p-40:4) or PC (o-40:5)	1373	1318	1343	1320	888	1467	1146	1339	1226	1249	1761	2030	1801	2309	1493	1295	1989	2218	1997	2050
PC 32:0e; PC 16:0e/16:0;	103088	98629	107836	98908	56802	98529	82033	86763	89198	82902	38458	42057	35501	48592	28840	26204	42940	47197	46847	38349
PC 32:1e; PC 16:0e/16:1;	70210	66839	71346	65112	38939	63169	56529	58177	59461	59323	40608	45852	36814	51052	31409	29365	42647	45976	44610	41159
PC 34:0e; PC 18:0e/16:0;	83100	73419	79351	69785	40212	79137	62542	71513	66862	62171	40264	43866	38938	56756	30583	28055	44243	49620	49318	43378
PC 36:1e; PC 18:0e/18:1;	179786	155674	167550	145956	87757	159131	135480	156070	146561	134815	134944	144390	130513	192412	104063	94668	151644	172673	168977	172829
PC 38:2e; PC 16:0e/22:2;	6275	5522	6660	5770	3301	5441	4320	3104	5338	4766	8900	11095	8578	11132	6683	6079	7856	9244	8579	10492
PC 38:4e; PC 18:0e/20:4;	4314	3771	3959	3986	2345	4216	2959	3632	4025	3314	4715	5889	5079	6706	4278	3723	5991	6184	5997	5506
PE (34:1)	1546712	1494361	1532904	1430421	712313	1299732	1146158	1223588	1292228	1195191	899545	1049250	815021	1072721	610713	525916	1015419	1130632	1085076	978067
PE (34:2)	162268	152958	155394	138650	74989	133707	124349	121157	135288	130950	92343	107315	82485	109273	62626	57733	138488	145244	141162	79588
PE (36:1)	121627	113868	114724	108675	60949	106336	93516	98881	101773	95822	102809	122192	97842	138024	76424	71815	127853	144150	138267	130084
PE (36:2)	1626388	1596239	1573133	1478200	744574	1411886	1255686	1337868	1400830	1315786	1391011	1564364	1268078	1760402	953256	849313	1624894	1772627	1719993	1663936
PE (36:3)	66795	59598	60372	54518	20890	49643	41588	46747	48753	46954	81355	105616	74945	110388	47137	41292	117462	137262	129754	85792
PE (36:4)	64659	57712	61744	56238	30568	52241	46530	46718	51946	49732	48208	59212	46167	52228	31399	29812	75706	84914	79484	39720
PE (38:2)	7852	7683	8088	7186	4132	6966	5882	6096	6578	5969	7561	8919	6880	9588	5587	5305	8928	9779	9580	8421
PE (38:4) A	9914	12399	12879	7378	3995	9354	9689	10515	8284	8716	8345	5358	11815	10793	5452	8071	26164	26945	23034	10772
PE (38:4) B	657458	617397	624095	589935	310936	577116	469671	525795	552056	501627	650740	766576	627359	806299	449624	394706	933675	1036923	1003685	629558
PE (38:6)	306192	233694	290535	196704	46262	202689	174060	202961	182191	186199	176879	238398	146154	278640	46236	49492	236635	385272	389080	182338
PE (40:6)	2013	1784	2546	1965	914	2209	1566	1677	1655	1589	2056	2798	1945	2877	1356	1445	3290	3488	3176	2507
PE (p-34:1) or PE (o-34:2)	1814418	1700414	1687061	1544135	760060	1547628	1410369	1487349	1524116	1390789	1391978	1540362	1255087	1852511	951085	840495	1583073	1742563	1697611	1704616
PE (p-34:2) or PE (o-34:3)	271447	260083	239872	213876	77700	203629	187862	198509	205616	195114	215349	250945	186401	301390	127359	103656	281973	324720	302287	250062
PE (p-36:1) or PE (o-36:2)	1554558	1364178	1397049	1199021	619451	1249192	1203033	1329567	1265292	1144230	1109008	1189998	998811	1656492	755657	671238	1373306	1627443	1609436	1481936
PE (p-36:2) or PE (o-36:3)	332796	295307	312378	268853	96277	259322	226382	253946	254437	226220	290203	323218	248893	404617	163556	131090	329312	377973	361161	344822
PE (p-36:4) or PE (o-36:5)	658726	622288	617723	569082	255073	531312	434059	472958	508579	490583	745110	922366	710847	962231	511129	426611	822380	948496	907667	848946
PE (p-38:2) or PE (o-38:3)	127276	110837	126370	101972	43765	96947	85185	92001	96454	88251	156968	195518	135784	227822	90340	82580	152110	187917	183598	223648
PE (p-38:3) or PE (o-38:4)	97461	84205	86341	75110	30879	79240	66138	73497	75627	64150	85142	98487	75301	132829	50796	44248	107927	125129	124595	114175
PE (p-38:4) or PE (o-38:5)	512725	463974	479360	428424	223255	437008	375754	413730	415963	369146	538142	628408	520895	732320	392846	331808	649868	729351	692878	638588
PE (p-38:5) or PE (o-38:6)	428455	402177	400930	360999	156692	346801	285659	313287	333489	317772	556598	698746	524498	726714	373948	324462	608075	700209	665975	667277
PE (p-38:6) or PE (o-38:7)	219037	198173	204864	188987	87280	186849	142899	153125	176497	170604	237614	286909	227467	274481	174759	149200	289537	305402	288402	246330
PE (p-40:4) or PE (o-40:5)	6600	5575	5919	4865	2611	5270	4200	5043	4912	4329	8024	9806	7853	11635	5329	4462	8369	10030	9655	9715
PE (p-40:5) or PE (o-40:6)	173095	155368	159910	142539	67555	142892	122603	136490	138683	121898	191918	225756	182801	263090	134407	109524	223723	252164	237804	228032
PE (p-40:6) or PE (o-40:7)	347579	315093	322184	295433	109193	289082	227339	259841	274916	242388	357711	423583	325140	515438	230841	185351	434401	502675	471066	435507
PE (p-40:7) or PE (o-40:8)	78671	71317	74586	65536	23831	59865	45778	50320	55546	53916	101209	132944	90295	132754	60074	50134	124801	140737	125944	126560
PE 32:2e; PE 16:1e/16:1;	219150	211069	197925	181688	71415	165689	151536	158131	164478	165045	126354	147515	108693	170059	77440	66438	138866	162332	157122	137772
PE 34:1e; PE 18:1e/16:0;	25788	21902	24355	20417	9242	21336	17612	20247	18984	16291	18184	21909	16028	26519	11211	10392	23120	28253	28810	28448
PE 35:2e;	32340	29274	28402	25277	12348	26580	24285	26762	26667	24623	24604	26807	22814	36740	17015	14343	33158	38790	37576	32900
PE 36:3e; PE 18:2e/18:1;	551806	505721	513696	464449	228736	454278	408676	436506	453266	405761	410785	458121	360079	571202	281595	241955	461995	516591	488983	549333
PE 36:4e; PE 16:1e/20:3;	174189	169474	161374	148103	59147	141115	117185	131553	138029	129512	141491	165422	126693	194127	86864	75248	173036	198183	190619	173894
PE 36:5; PE 16:0-20:5;	9906	8714	9319	8145	5113	8644	7318	7689	7989	7536	6395	7705	6338	7495	4295	4492	10149	11339	11357	5605
PE 36:6e; PE 16:1e/20:5;	122778	101258	112273	93727	40590	98609	78426	87764	91110	86231	135555	180098	120611	219069	69965	60459	34648	219507	222705	151912
PE 38:2; PE 18:0-20:2;	94540	76290	87850	71337	34824	69691	59121	68786	68633	60473	88288	107852	79848	120718	56242	51167	118746	139613	138118	98362
PE 38:2; PE 18:1-20:1;	86350	77739	83946	73735	35354	71776	61646	68572	73808	64524	89050	101367	81799	118920	59213	49906	98089	114030	112692	117188
PE 38:2e; PE 16:1e/22:1;	147000	134439	143079	120156	55615	118596	115486	122002	117592	112585	136219	147020	120707	193827	81894	77561	141649	169805	170508	196203
PE 38:3; PE 18:0-20:3;	56576	46324	53558	46214	16169	43510	34659	41020	41124	35154	41810	53881	39050	60787	23337	18786	67015	79503	75790	43294
PE 38:3; PE 18:1-20:2;	70234	62693	69017	60706	27060	56072	46342	52680	54408	47902	65608	81427	61061	88446	42136	36086	88451	100097	98079	68384
PE 38:4e; PE 18:0e/20:4;	69562	58250	61703	54401	17182	54656	45181	55595	54058	46377	43044	50381	40567	75441	26309	20422	71094	85636	79522	59593
PE 38:5; PE 18:0-20:5;	106046	95753	98227	87025	31376	79319	62069	72559	74972	73717	81356	106051	76507	114279	46467	40199	140723	166231	155942	80475
PE 38:5; PE 18:1-20:4;	156179	141889	146858	139032	73008	137091	111784	120652	131837	125711	202437	247509	197406	236482	147031	133528	307080	327542	317715	188966
PE 38:5e; PE 16:0e/22:5;	71995	68044	66432	60268	23364	57262	48542	55676	54890	53023	85153	105369	79761	126697	55482	43749	105962	123362	111918	111315
PE 38:5e; PE 16:1e/22:4;	109211	99754	105939	91846	30149	83270	63450	70674	80246	69991	149158	190579	134140	199591	86735	68075	151208	177292	163614	181926
PE 38:7e; PE 18:2e/20:5;	18748	17273	18016	17000	8736	17897	13958	14039	17110	15579	32481	40605	29553	41129	19314	17674	39541	43260	42278	34214
PE 40:1; PE 22:0-18:1;	28768	24015	27513	23615	11119	21977	19864	22216	20903	19534	19405	23525	19098	26320	12697	12418	26610	30359	31832	19985
PE 40:2; PE 18:0-22:2;	46249	40013	48780	40057	18217	37306	30860	34780	35435	32909	51322	62674	46628	65662	31416	30558	61910	71084	75019	54323
PE 40:2e; PE 18:1e/22:1;	33559	30694	31249	26599	12549	27307	27005	28564	26901	26394	29249	33093	26560	45828	18348	16967	35692	41806	44554	45843
PE 40:3; PE 18:1-22:2;	10503	9229	10741	9593	5163	8897	7453	7967	9158	7903	14362	18206	13386	20022	9790	9139	18551	21328	21354	15626
PE 40:3e; PE 18:1e/22:2;	43412	39972	42345	36340	16617	34814	34124	34574	34078	32859	55812	65073	48509	82808	34593	32590	54075	66150	66926	80874
PE 40:4; PE 18:0-22:4;	117167	95419	109440	94466	32280	93481	67442	82015	84839	70662	85403	115917	83478	125795	47910	38441	129088	150450	145331	94539
PE 40:4e; PE 18:2e/22:2;	9995	8687	9924	8171	4233	7911	7088	7634	7783	7259	14231	18398	12149	21538	8309	8427	13642	16966	16862	19693
PE 40:5; PE 18:0-22:5;	231980	213499	219843	204035	97286	196555	155410	179128	185938	166896	188144	229693	180626	237495	128239	111389	266944	294156	285120	190333
PE 40:5e; PE 18:1e/22:4;	43028	36965	40319	34574	18234	35874	29562	33507	33761	29236	44552	54259	42934	64955	31014	26331	48149	57606	56895	58019
PE 40:6; PE 18:0-22:6;	1500468	1392114	1404747	1321842	584292	1252328	1061789	1185247	1207915	1117454	1018087	1234832	962515	1284738	638170	551502	1437405	1621224	1537854	1117880
PE 40:7e; PE 18:2e/22:5;	56701	52829	52540	46781	15932	44231	33016	36982	41619	37452	70890	90987	63642	99372	40125	34529	82991	97548	93254	92494
PE 42:3e;	12808	12266	12974	10756	5173	10358	10251	10535	10150	10122	8854	9899	8102	12875	5615	5142	10216	12042	12223	13518
PG 32:0;	10594	9391	9985	8653	4204	8607	6801	8550	8028	7579	2491	2653	2227	3685	1535	1404	3905	4794	4594	3116
PG 32:1; PG 14:0-18:1;	8427	7989	8465	7030	3554	7421	4804	7082	6568	6817	2843	3061	2688	4294	1655	1708	4551	5475	5377	4272
PG 34:1; PG 16:0-18:1;	655713	558058	609002	520413	174433	452181	406945	431247	441799	434870	235204	306918	225065	338357	109235	100745	291805	384274	354787	353486
PG 34:2; PG 16:1-18:1;	14779	13907	15106	12317	5275	12156	7780	11550	11083	11415	7602	9156	7149	11627	4597	4280	11157	13983	13320	11736
PG 36:1; PG 18:0-18:1;	257314	231949	230439	207777	60738	184622	164489	168644	172638	173474	148576	195202	139941	229165	77815	64757	221123	271902	254721	213318
PG 36:2; PG 18:1-18:1;	92075	79277	85621	68727	27352	65175	41233	66473	62597	59550	89142	110596	80145	151896	51752	48002	119836	159616	139594	145772
PG 36:3; PG 18:1-18:2;	4983	4770	5238	4427	2133	4193	3049	4227	3990	3977	9771	11468	8155	13751	5868	5597	11057	13079	12538	12792
PG 38:2; PG 18:1-20:1;	65695	64145	53591	54278	8337	49420	40787	39016	49301	42335	99965	125163	84903	175105	48315	29613	140251	154933	140239	144397
PG 38:3; PG 18:1-20:2;	8891	7137	8239	6539	1751	5610	4362	5731	5458	5455	20559	28961	18693	36664	9770	8147	21524	30322	26103	28500
PG 38:4; PG 18:1-20:3;	7013	5797	6202	5225	2530	5326	3873	5633	5292	5078	6445	7239	6140	10716	4327	3880	8411	10069	9566	9872
PG 38:6; PG 16:0-22:6;	4446	4387	4178	4115	2077	4101	2717	3931	3822	3588	2921	3611	2762	4450	1857	1687	5429	6325	6185	3363
PG 40:3; PG 18:1-22:2;	19859	18319	19177	15319	2611	13482	7893	12493	14081	13015	61413	86922	48921	104556	23867	16741	67544	88922	78463	77117
PG 40:7; PG 18:1-22:6;	16617	15825	15756	13511	6306	13768	8402	13716	13027	12771	27910	37991	27641	46325	17462	17402	48017	59658	54347	33905
PI 32:0; PI 16:0-16:0;	76045	64245	70911	58736	28476	49730	46183	56052	49503	48493	4653	4623	4793	4585	3079	2680	6763	8219	8270	5509
PI 32:1; PI 16:0-16:1;	64277	53529	55577	45965	17774	41380	38100	41589	38264	37337	8284	9382	8707	10851	4543	4388	13046	16708	15417	11668
PI 34:0; PI 16:0-18:0;	789046	552772	693360	458853	86809	378368	366130	498066	367202	423066	62864	78731	60866	86019	18990	16456	74134	144971	128742	93886
PI 34:1; PI 16:0-18:1;	568192	493937	544918	457985	217802	398423	387138	429333	385038	391164	181657	211926	184704	239394	113780	106060	235691	298830	278833	245984
PI 34:2; PI 16:1-18:1;	80901	73388	76515	65788	28592	58474	54815	58161	55605	54557	25405	29072	25436	31688	14964	14458	31555	39077	36661	35865
PI 36:0; PI 18:0-18:0;	23172	19958	19897	20331	6486	16063	12078	15075	16866	18266	3543	3929	4007	2836	2614	2140	3429	4059	3941	3274
PI 36:1; (PI 18:0-18:1) A;	1870817	1703225	1718749	1519271	478909	1247032	1252573	1361762	1210757	1298291	665192	798102	661774	1029057	366885	320590	839562	1082605	996089	1010521
PI 36:1; (PI 18:0-18:1) B;	322671	306045	301880	266597	77584	202236	205204	218328	194731	207588	227965	286569	217012	355623	113582	98702	253009	334341	315708	292119
PI 36:2; PI 18:0-18:2;	181448	164484	180949	153835	60824	120894	118626	125891	117180	125938	145856	177756	138250	195676	83166	77912	154055	198803	179633	176391
PI 36:2; PI 18:1-18:1;	401016	359340	385679	334126	135558	283987	283672	303731	286832	299526	201903	233721	199781	282858	110568	105905	219256	288825	265407	308349
PI 36:3; PI 18:1-18:2;	25474	22645	26265	22072	9330	17799	17636	19051	17933	17588	22759	26438	21544	26680	12285	12551	24644	30383	28126	26269
PI 36:4; PI 16:0-20:4;	69240	60993	68549	58914	25005	51483	47302	53069	49405	47498	57984	64753	58470	65428	31729	31497	65625	80264	77070	55493
PI 37:2; PI 18:0-19:2;	74309	52679	68124	40808	2965	32603	36977	44574	31228	37991	83298	120971	72767	155103	22229	22369	70021	144322	126568	117637
PI 38:1; PI 18:0-20:1;	113871	109715	106130	95153	31620	76098	77845	87780	74289	80167	26546	29505	25651	37767	15982	13687	37148	46611	43722	43450
PI 38:2; PI 18:0-20:2;	538672	508606	513864	452950	152402	350953	336864	373541	347512	368911	706051	924027	671715	1093246	387049	326471	708976	923504	835074	936278
PI 38:3; PI 18:0-20:3;	498732	406887	456038	335953	46225	282821	263026	305901	265275	273430	486636	685407	443258	873422	164369	133041	546015	856801	767644	669511
PI 38:3; PI 18:1-20:2;	215665	201201	212663	181987	75796	153259	155218	168689	151622	152943	229703	270649	224197	316151	139834	127931	251534	310957	285224	280562
PI 38:4; PI 18:0-20:4;	893098	783887	876840	746380	325350	621691	614980	687889	594623	607877	1109086	1316698	1135701	1493375	682429	614229	1187843	1544254	1397893	1162686
PI 38:4; PI 18:1-20:3;	18715	16614	18155	15399	7172	12987	13212	15099	13490	12841	16683	18368	16084	21019	9731	9196	19114	23849	22741	21704
PI 38:5; PI (18:1-20:4) A;	207904	187719	211323	185732	88034	162281	151557	167707	156545	151148	250651	282414	247827	292607	161196	151379	273675	328798	310556	286321
PI 38:5; PI (18:1-20:4) B;	52903	46195	52364	45321	18746	36650	35395	38777	36638	35063	48893	55464	47409	57144	26736	25417	50682	65133	59252	48253
PI 40:1; PI 18:0-22:1;	23171	21135	23488	21017	8005	16529	14559	17776	16546	15696	6196	7199	5851	8523	3920	3722	8406	10463	10143	8670
PI 40:2; PI 18:0-22:2;	82867	81464	86485	77010	27449	57817	54320	61705	57414	57626	81250	102882	76510	113012	48575	42442	87422	111649	104810	97292
PI 40:3; PI 18:1-22:2;	31546	29658	32318	27638	7776	19688	18920	19541	19829	21325	37832	52816	35535	59103	17879	15872	43849	62382	56787	52655
PI 40:4; PI 18:0-22:4;	406637	329012	361236	279693	38531	233804	208376	246745	210792	222471	376262	549850	355886	683401	129795	107900	423091	668027	597381	507475
PI 40:5; PI 18:0-22:5;	67265	61269	63760	56716	22907	46869	46206	52358	45260	48340	71719	88878	73726	105132	42948	38401	72454	99159	86999	92464
PI 40:6; PI 18:0-22:6;	57873	53314	56904	50358	22191	41791	43403	47406	40406	41726	56461	66816	55112	74268	36090	34118	57327	70939	66367	66727
PI 42:2; PI 18:0-24:2;	12223	11586	13084	11767	4455	9097	7958	8954	9227	8873	5826	7293	5259	7889	3436	3486	8088	9797	9173	7468
PS 34:1; PS 16:0-18:1;	50567	50710	51076	47204	24060	37495	43558	40332	40732	41581	21860	24076	21652	26919	15152	14509	23961	28975	29218	24130
PS 36:1; PS 18:0-18:1;	280820	276738	279958	232440	73263	180869	217818	209831	202084	204295	261594	321695	243317	373432	136638	113659	283353	356008	347255	333847
PS 36:2; PS 18:1-18:1;	17314	17809	17750	16692	9099	13247	16429	15258	15217	15266	17195	19334	16245	23174	12805	11674	17178	20963	20504	23197
PS 38:4; PS 18:0-20:4;	5150	4960	4904	4431	2664	4146	4427	4498	4198	4345	6330	7022	6075	7994	5032	4265	8028	9820	10226	6570
SM (d34:0)	3506	3517	3799	3255	2265	3551	3338	3188	3308	3230	3465	3829	3689	4555	3094	2807	3239	3650	3577	5597
SM (d34:1)	299520	285323	297219	265406	174339	278312	274070	279941	263763	265971	291365	318117	280945	345596	224307	230465	318055	352250	335447	320389
SM (d34:2)	73113	69909	79001	69467	39059	68349	64084	66797	63078	63108	74982	88869	69590	94862	51767	51215	80836	93980	88447	72782
SM (d36:1)	11238	10694	10765	10266	7101	11289	10148	10689	9726	9684	7611	8202	7866	10532	6271	6471	9818	10463	10323	9442
SM (d36:2)	3047	2569	2802	2387	1091	2442	2152	2386	2249	2123	2531	3069	2168	3931	1482	1368	2994	3973	3660	3053
SM (d36:3)	60	53	50	75	39	90	33	65	61	73	64	107	67	107	93	60	93	83	65	102
SM (d38:2)	422	384	479	451	278	475	439	362	388	406	467	515	431	534	311	423	473	527	541	460
SM (d40:3)	199	203	245	169	115	226	199	194	203	185	255	337	227	353	197	208	262	262	291	329
SM (d42:2) B	138949	126861	137473	118661	68200	128355	113371	121201	119229	111782	143287	164207	135670	191344	99104	99113	162517	190143	185614	185616
SM (d42:3)	13751	13087	14284	13857	8074	13352	10813	11699	12511	11633	15838	19947	15414	20175	12880	12298	18949	19666	19306	18208
SM (d44:2)	2397	2316	2502	2074	1123	2291	2074	1385	2056	2158	1843	1988	2635	3791	2003	1962	3318	4023	3922	4017
SM d38:1; SM d14:1/24:0;	4746	4695	4705	4507	3179	4943	4316	4375	4238	4007	4184	4609	4132	5554	3468	3612	5121	5212	5362	5203
SM d40:1; SM d14:1/26:0;	64339	58625	63077	53415	33644	59832	54331	59033	53272	51788	59344	67632	64724	85509	42350	41197	77140	88873	85870	71844
SM d40:2; SM d14:2/26:0;	6223	5799	6281	5945	3494	5928	5193	5467	5422	5064	6986	8242	6684	8831	5682	5245	8933	9059	8942	7462
SM d41:1; SM d14:1/27:0;	13562	11762	13253	10402	5550	11794	10679	11972	10200	10299	10339	12311	10309	16671	7134	6709	13418	16173	15189	13578
SM d41:2; SM d14:2/27:0;	5402	148	226	375	110	5543	265	248	276	96		196	182	6273	221	3374	400	299	5743	249
SM d42:1; SM d14:1/28:0;	168782	149492	157015	135675	68221	147414	142236	152622	131654	134649	181336	203882	167786	270168	123744	115901	253648	294244	280678	224291
SM d43:1; SM d14:1/29:0;	766	1148	1179	869	366	896	1121	1123	961	995	1334	1715	1470	2250	735	923	1804	2113	2072	1899
SM d43:2; SM d14:2/29:0;	1530	1269	1385	1253	610	1322	1132	1140	1091	1108	1240	1547	1327	1951	984	875	1498	1761	1825	1607
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	InChI Key	Species	quantitated m/z	retention times
Ceramide (d18:1/17:0) iSTD	ICWGMOFDULMCFL-QKSCFGQVSA-N	[M+Cl]-	586.5004	6.19
CUDA iSTD	HPTJABJPZMULFH-UHFFFAOYSA-N	[M-H]-	339.2699	0.59
FA (16:0)-d3 iSTD	IPCSVZSSVZVIGE-FIBGUPNXSA-N	[M-H]-	258.2558	2.45
LPC (17:0) iSTD	SRRQPVVYXBTRQK-XMMPIXPASA-N	[M+Hac-H]-	568.3665	1.91
LPE (17:1) iSTD	LNJNONCNASQZOB-HEDKFQSOSA-N	[M-H]-	464.2829	1.38
MAG (17:0/0:0/0:0) iSTD	SVUQHVRAGMNPLW-UHFFFAOYSA-N	[M+Hac-H]-	403.3105	3.11
PC (12:0/13:0) iSTD	FCTBVSCBBWKZML-WJOKGBTCSA-N	[M+Hac-H]-	694.4681	3.61
PE (17:0/17:0) iSTD	YSFFAUPDXKTJMR-DIPNUNPCSA-N	[M-H]-	718.5421	6.5
PG (17:0/17:0) iSTD	ZBVHXVKEMAIWQQ-QPPIDDCLSA-N	[M-H]-	749.5374	5.24
SM (d18:1/17:0) iSTD	YMQZQHIESOAPQH-JXGHDCMNSA-N	[M+Hac-H]-	775.5986	5.33
Ceramide (d32:1)	ZKRPGPZHULJLKJ-JHRQRACZSA-N	[M+Cl]-	544.4507	5.123333333
Ceramide (d33:1)	QBFXCLDNTKBAPQ-STSAHMJASA-N	[M+Cl]-	558.4669	5.475
Ceramide (d34:0)	GCGTXOVNNFGTPQ-JHOUSYSJSA-N	[M+Hac-H]-	598.5411	6.06
Ceramide (d34:1)	YDNKGFDKKRUKPY-TURZORIXSA-N	[M+Cl]-	572.483	5.84
Ceramide (d34:2)	XXWRZIYYFPIQHE-XPAOSYCESA-N	[M-H]-	534.4895	5.206666667
Ceramide (d36:1)	MJQIARGPQMNBGT-WWUCIAQXSA-N	[M+Cl]-	600.5143	6.55
Ceramide (d38:1)	XWBWIAOWSABHFI-NUKVNZTCSA-N	[M+Hac-H]-	652.59	7.26
Ceramide (d40:1)	KEPQASGDXIEOIL-GLQCRSEXSA-N	[M+Hac-H]-	680.6219	7.94
Ceramide (d42:0)	BPLYVSYSBPLDOA-WVILEFPPSA-N	[M+Cl]-	686.6234	8.78
Ceramide (d42:1)	ZJVVOYPTFQEGPH-AUTSUKAISA-N	[M+Cl]-	684.6093	8.57
Ceramide (d42:2) A	VJSBNBBOSZJDKB-KPEYJIHVSA-N	[M+Cl]-	682.5933	7.81
Ceramide (d42:2) B	VJSBNBBOSZJDKB-KPEYJIHVSA-N	[M+Cl]-	682.5938	7.92
Ceramide (d44:1)	CJROVRTUSFQVMR-GVOPMEMSSA-N	[M+Cl]-	712.6389	9.16
FA (14:0) (myristic acid)	TUNFSRHWOTWDNC-UHFFFAOYSA-N	[M-H]-	227.2063	1.6
FA (14:1) (physeteric acid)	AFGUVBVUFZMJMX-KTKRTIGZSA-N	[M-H]-	225.1908	1.16
FA (16:1) (palmitoleic acid)	SECPZKHBENQXJG-FPLPWBNLSA-N	[M-H]-	253.2217	1.79
FA (18:1) (oleic acid)	ZQPPMHVWECSIRJ-KTKRTIGZSA-N	[M-H]-	281.2532	2.69
FA (18:2) (linoleic acid)	JBYXPOFIGCOSSB-XBLVEGMJSA-N	[M-H]-	279.2375	2.03
FA (20:1) (eicosenoic acid)	BITHHVVYSMSWAG-KTKRTIGZSA-N	[M-H]-	309.2835	3.33
FA (20:2) (eicosadienoic acid)	XSXIVVZCUAHUJO-HZJYTTRNSA-N	[M-H]-	307.268	2.91
FA (20:3) (eicosatrienoic acid)	AHANXAKGNAKFSK-PDBXOOCHSA-N	[M-H]-	305.2515	2.48
FA (20:3) (homo-gamma-linolenic acid)	HOBAELRKJCKHQD-QNEBEIHSSA-N	[M-H]-	305.253	2.33
FA (20:4) (arachidonic acid)	YZXBAPSDXZZRGB-DOFZRALJSA-N	[M-H]-	303.2375	1.89
FA (20:5) (eicosapentaenoic acid)	JAZBEHYOTPTENJ-JLNKQSITSA-N	[M-H]-	301.2215	1.46
FA (22:1) (erucic acid)	DPUOLQHDNGRHBS-KTKRTIGZSA-N	[M-H]-	337.3137	3.89
FA (22:2) (docosadienoic acid)	HVGRZDASOHMCSK-AVQMFFATSA-N	[M-H]-	335.2983	3.46
FA (22:6) (docosahexaenoic acid)	MBMBGCFOFBJSGT-KUBAVDMBSA-N	[M-H]-	327.2374	1.68
FA (26:0) (cerotic acid)	XMHIUKTWLZUKEX-UHFFFAOYSA-N	[M-H]-	395.3915	6.06
GlcCer (d40:1)	YIGARKIIFOHVPF-YAEABVQUSA-N	[M+Cl]-	818.6293	7.275
GlcCer (d41:1)	SJGWLQDELUWRDA-MUYAOIFFSA-N	[M+Cl]-	832.644	7.61
GlcCer (d42:1)	POQRWMRXUOPCLD-AAAFHMTMSA-N	[M+Cl]-	846.6606	7.93
GlcCer (d42:2)	WBOZIXHPUPAOIA-RBELZSLISA-N	[M+Cl]-	844.6464	7.25
GlcCer(d14:1(4E)/20:0(2OH))	YYILQTLJZBSOCA-IMJQGFQJSA-N	[M-H]-	714.5551	5.025
LPC (14:0)	VXUOFDJKYGDUJI-OAQYLSRUSA-N	[M+Hac-H]-	526.3182	1
LPC (16:0)	ASWBNKHCZGQVJV-HSZRJFAPSA-N	[M+Hac-H]-	554.3508	1.54
LPC (16:1)	LFUDDCMNKWEORN-ZXEGGCGDSA-N	[M+Hac-H]-	552.3339	1.12
LPC (18:0) A	IHNKQIMGVNPMTC-RUZDIDTESA-N	[M+Hac-H]-	582.3812	2.16
LPC (18:0) B	IHNKQIMGVNPMTC-RUZDIDTESA-N	[M+Hac-H]-	582.3817	2.35
LPC (18:1)	YAMUFBLWGFFICM-PTGWMXDISA-N	[M+Hac-H]-	580.3658	1.69
LPC (18:2)	SPJFYYJXNPEZDW-FTJOPAKQSA-N	[M+Hac-H]-	578.3515	1.27
LPC (20:1)	GJTDRNFWIDPARY-GTPZACKGSA-N	[M+Hac-H]-	608.3949	2.5
LPC (20:2)	YYQVCMMXPIJVHY-ZOIJLGJPSA-N	[M+Hac-H]-	606.3806	1.89
LPC (20:3)	BBNHCUBQEQJHIG-FZZJNMCHSA-N	[M+Hac-H]-	604.3656	1.47
LPC (22:5)	YBUXFQUGNPBZPS-YNBHEIDWSA-N	[M+Hac-H]-	628.3651	1.34
LPC 20:4;	GOMVPVRDBLLHQC-DOFZRALJNA-N	[M+Hac-H]-	602.3501	1.23
LPE (16:0)	CKPBBEOJHAPPBT-HXUWFJFHSA-N	[M-H]-	452.2818	1.56
LPE (18:2)	DBHKHNGBVGWQJE-USWSLJGRSA-N	[M-H]-	476.2824	1.27
LPE (20:4)	JPNPIRVRGLGTRE-YSKCIPFOSA-N	[M-H]-	500.2816	1.19
LPE (22:6)	XEVRBOQZSXWGQO-PAUXXPOVSA-N	[M-H]-	524.2817	1.18
LPE 18:0;	BBYWOYAFBUOUFP-UHFFFAOYNA-N	[M-H]-	480.313	2.4
PC (32:0)	KILNVBDSWZSGLL-KXQOOQHDSA-N	[M+Hac-H]-	792.5779	5.68
PC (32:1)	QIBZFHLFHCIUOT-NPBIGWJUSA-N	[M+Hac-H]-	790.562	5.1
PC (32:2)	GPWHCUUIQMGELX-VHQDNGOZSA-N	[M+Hac-H]-	788.5461	4.6
PC (33:1)	GXTATYLPYLLNLV-MGIDVFSBSA-N	[M+Hac-H]-	804.5771	5.44
PC (33:2)	SBNDHGBVMZMSNL-UESLNCBNSA-N	[M+Hac-H]-	802.5615	4.93
PC (34:0)	PZNPLUBHRSSFHT-RRHRGVEJSA-N	[M+Hac-H]-	820.6113	6.36
PC (34:1)	WTJKGGKOPKCXLL-VYOBOKEXSA-N	[M+Cl]-	794.5513	5.75
PC (34:2)	JLPULHDHAOZNQI-ZTIMHPMXSA-N	[M+Hac-H]-	816.5785	5.23
PC (34:3)	CNNSEHUKQJCGTE-UPPWDXJYSA-N	[M+Hac-H]-	814.5618	4.78
PC (34:4)	YWDDIWXKFJEMKF-JTZVLWBESA-N	[M+Hac-H]-	812.5458	4.52
PC (35:1)	MFHIZGSSDZJFKD-IYEJTHTFSA-N?	[M+Hac-H]-	832.6081	6.09
PC (35:2)	ZSKWZJYUVZYDQU-WESJWMGVSA-N	[M+Hac-H]-	830.5923	5.59
PC (35:4)	LYNZMLHNPYEREG-ZHMZGHMTSA-N	[M+Hac-H]-	826.5612	4.84
PC (36:1)	ATHVAWFAEPLPPQ-VRDBWYNSSA-N	[M+Cl]-	822.5809	6.445
PC (36:2)	SNKAWJBJQDLSFF-NVKMUCNASA-N	[M+Cl]-	820.5641	5.94
PC (36:3) A	YPAZQMWFRMHBBM-CLKMJQEKSA-N	[M+Cl]-	818.5494	5.44
PC (36:3) B	YPAZQMWFRMHBBM-CLKMJQEKSA-N	[M+Hac-H]-	842.5939	5.41
PC (36:4) A	IIZPXYDJLKNOIY-JXPKJXOSSA-N	[M+Hac-H]-	840.5781	4.84
PC (36:4) B	IIZPXYDJLKNOIY-JXPKJXOSSA-N	[M+Cl]-	816.534	5.145
PC (36:5) A	DYDDZDMJSQYFGN-OIVUZXIWSA-N	[M+Hac-H]-	838.5612	4.44
PC (36:5) B	DYDDZDMJSQYFGN-OIVUZXIWSA-N	[M+Hac-H]-	838.562	4.74
PC (37:4)	QRPUCJXFPYFTMB-FBFLODOBSA-N	[M+Hac-H]-	854.5922	5.49
PC (38:2)	KXXLFCAPKGRXBT-FMJYHZMHSA-N	[M+Hac-H]-	872.64	6.41
PC (38:3)	OJHJKEBRZSDTTL-VHWCKNCUSA-N	[M+Hac-H]-	870.6251	6.09
PC (38:4) A	PSVRFUPOQYJOOZ-QNPWAGBNSA-N	[M+Hac-H]-	868.6097	5.81
PC (38:5) A	YLWBKBDNHWQEFU-YJXJLLHLSA-N	[M+Hac-H]-	866.593	5.18
PC (38:5) B	YLWBKBDNHWQEFU-YJXJLLHLSA-N	[M+Hac-H]-	866.5924	5.38
PC (38:6)	PLZBTDKJYHXIEW-DZUXOTHRSA-N	[M+Cl]-	840.5335	4.99
PC (40:5) A	LJFKFKIYUJNFPZ-ZLFSCUDPSA-N	[M+Hac-H]-	894.6233	5.83
PC (40:5) B	LJFKFKIYUJNFPZ-ZLFSCUDPSA-N	[M+Hac-H]-	894.6237	6.08
PC (40:6) B	FYVNIFOYDIIODX-KNKJIUSSSA-N	[M+Hac-H]-	892.6085	5.63
PC (40:7)	BPUROMFCPFGBOT-ZEGPSQTJSA-N	[M+Hac-H]-	890.5917	5.04
PC (p-34:0) or PC (o-34:1)	QCGUXAIDEOWPBV-SNKLRXETSA-N	[M+Hac-H]-	804.6139	6.17
PC (p-34:1) or PC (o-34:2) A	MBRHHFWRXQYYAN-RTVLTNFHSA-N	[M+Hac-H]-	802.5975	5.64
PC (p-34:1) or PC (o-34:2) B	MBRHHFWRXQYYAN-RTVLTNFHSA-N	[M+Hac-H]-	802.5979	6.06
PC (p-34:2) or PC (o-34:3)	QLEHHUPUHJPURI-PWYDUFMYSA-N	[M+Hac-H]-	800.5823	5.52
PC (p-36:1) or PC (o-36:2)	ZOTYCHIFTCFAHC-KOUVQCMKSA-N	[M+Hac-H]-	830.629	6.3
PC (p-36:2) or PC (o-36:3)	DIHWZUCEXWUHOD-IIVNATNGSA-N	[M+Hac-H]-	828.6119	5.67
PC (p-36:3) or PC (o-36:4)	SOUZQPFUXRVDGK-KCTKZSJBSA-N	[M+Hac-H]-	826.5983	5.53
PC (p-36:4) or PC (o-36:5)	IOYKZPNDXIIXLN-LOQSCQKMSA-N	[M+Hac-H]-	824.5822	5.42
PC (p-38:4) or PC (o-38:5) A	DBQMOXDLWKVKKG-REWQMPQJSA-N	[M+Hac-H]-	852.6134	5.57
PC (p-38:4) or PC (o-38:5) B	DBQMOXDLWKVKKG-REWQMPQJSA-N	[M+Hac-H]-	852.613	6.09
PC (p-38:5) or PC (o-38:6)	ATTCDOPAYPGSLE-LQULQHAGSA-N	[M+Hac-H]-	850.5961	5.29
PC (p-40:3) or PC (o-40:4)	RDNHPNJCALITSY-MBZSPAKGSA-N?	[M+Hac-H]-	882.6608	6.69
PC (p-40:4) or PC (o-40:5)	AGKCACWGAXVMPI-BVWWTNGZSA-N	[M+Hac-H]-	880.6422	6.05
PC 32:0e; PC 16:0e/16:0;	WOTHHEHCEYHCFE-UHFFFAOYNA-N	[M+Hac-H]-	778.597	6.11
PC 32:1e; PC 16:0e/16:1;	HJVQHTGUAIETCQ-ZPHPHTNENA-N	[M+Hac-H]-	776.5814	5.47
PC 34:0e; PC 18:0e/16:0;	GTFLTTXDLGEBAI-UHFFFAOYNA-N	[M+Hac-H]-	806.6287	6.8
PC 36:1e; PC 18:0e/18:1;	JDBBQTCNJFZWPL-LNVKXUELNA-N	[M+Hac-H]-	832.6456	6.86
PC 38:2e; PC 16:0e/22:2;	XEARCBSNHUZUFX-DYMXKLMANA-N	[M+Hac-H]-	858.6653	7.03
PC 38:4e; PC 18:0e/20:4;	PTKWWHCMNOQBSL-WKUHSSGJNA-N	[M+Hac-H]-	854.6289	6.21
PE (34:1)	FHQVHHIBKUMWTI-OTMQOFQLSA-N	[M-H]-	716.5251	5.89
PE (34:2)	HBZNVZIRJWODIB-NHCUFCNUSA-N	[M-H]-	714.5096	5.36
PE (36:1)	JQKOHRZNEOQNJE-ZZEZOPTASA-N	[M-H]-	744.5564	5.75
PE (36:2)	MWRBNPKJOOWZPW-CLFAGFIQSA-N	[M-H]-	742.5413	6
PE (36:3)	DOILLFCKSSPXMF-ZKZIFNJMSA-N	[M-H]-	740.5251	5.44
PE (36:4)	DUQDVNACTOXOJA-KTKXOIIHSA-N	[M-H]-	738.5095	5.28
PE (38:2)	CLPMAPXZURYSNH-CNBLIUODSA-N	[M-H]-	770.5714	5.94
PE (38:4) A	ANRKEHNWXKCXDB-BHFWLYLHSA-N	[M-H]-	766.5405	5.14
PE (38:4) B	ANRKEHNWXKCXDB-BHFWLYLHSA-N	[M-H]-	766.5419	5.93
PE (38:6)	VRBJSZDBPQLNEM-PFTGJCAASA-N	[M-H]-	762.5097	5.09
PE (40:6)	FEABWDMFZNBFCT-KUVQHVNNSA-N	[M-H]-	790.5405	4.98
PE (p-34:1) or PE (o-34:2)	ZOSSFCIAXYNTHL-CSTBBDSDSA-N	[M-H]-	700.5302	6.23
PE (p-34:2) or PE (o-34:3)	LALFTIIBOJSVNP-OBEJFMRTSA-N	[M-H]-	698.5148	5.71
PE (p-36:1) or PE (o-36:2)	OBAAWAYLQLYWNN-KHFVPPDWSA-N	[M-H]-	728.5615	6.91
PE (p-36:2) or PE (o-36:3)	XVXISDREVDGQPX-PISDLAQISA-N	[M-H]-	726.5464	6.4
PE (p-36:4) or PE (o-36:5)	UUYSKERSKRMYME-MAIXUNBTSA-N	[M-H]-	722.5155	5.57
PE (p-38:2) or PE (o-38:3)	LZGIKQZCPKHHMV-NANSGXCVSA-N?	[M-H]-	754.5771	6.94
PE (p-38:3) or PE (o-38:4)	YHSWSUHZIXJBHZ-OWTAGOBYSA-N	[M-H]-	752.5613	6.48
PE (p-38:4) or PE (o-38:5)	URPXXNCTXCOATD-FXMFQVEGSA-N	[M-H]-	750.5469	6.25
PE (p-38:5) or PE (o-38:6)	KCNBSSYOJRUKOM-JALPNNRCSA-N	[M-H]-	748.5309	5.61
PE (p-38:6) or PE (o-38:7)	WVGALBKSWOUIEZ-XNHMFJFDSA-N	[M-H]-	746.5148	5.37
PE (p-40:4) or PE (o-40:5)	OQKUDRFZPJFLJQ-KMUIXOOCSA-N	[M-H]-	778.5783	6.93
PE (p-40:5) or PE (o-40:6)	DZPHTQGGRSWHLG-USOCFQKQSA-N	[M-H]-	776.5615	6.26
PE (p-40:6) or PE (o-40:7)	FIJFPUAJUDAZEY-MNDXXDKYSA-N	[M-H]-	774.546	6.01
PE (p-40:7) or PE (o-40:8)	UKPNUUDYLNCIOE-IZHHWLPXSA-N	[M-H]-	772.53	5.43
PE 32:2e; PE 16:1e/16:1;	LXPNPYVUDOMVDN-VMNXYWKNNA-N	[M-H]-	672.499	5.49
PE 34:1e; PE 18:1e/16:0;	KJDVLWWPMOBWGU-ZCXUNETKNA-N	[M-H]-	702.5449	6.79
PE 35:2e;	JVHDZTSXUITLTB-YGGBKCGDNA-N	[M-H]-	714.5449	6.5
PE 36:3e; PE 18:2e/18:1;	KTJAFMBXBPVGGI-LTEAFHAINA-N	[M-H]-	726.5463	6.22
PE 36:4e; PE 16:1e/20:3;	SGQXZIZOYWUPOW-OZFAJUOSNA-N	[M-H]-	724.5303	5.78
PE 36:5; PE 16:0-20:5;	KHLRCNXJXSYNCK-LPHKCNJWNA-N	[M-H]-	736.4925	4.8
PE 36:6e; PE 16:1e/20:5;	YMKZESHNWGNAIE-VNTVABMMNA-N	[M-H]-	720.4992	5.07
PE 38:2; PE 18:0-20:2;	WYDGEVICLIVPEG-OHNCOSGTNA-N	[M-H]-	770.5718	6.75
PE 38:2; PE 18:1-20:1;	UITCASPZWUAJBW-HWSICPKZNA-N	[M-H]-	770.5717	6.53
PE 38:2e; PE 16:1e/22:1;	CPCDMYAHSAXVCA-KXYOHKLBNA-N	[M-H]-	756.5925	7.54
PE 38:3; PE 18:0-20:3;	MSYFXMJDQLPRGO-JTBMWNAQNA-N	[M-H]-	768.5558	6.39
PE 38:3; PE 18:1-20:2;	CMHAYOZHFZADHZ-GYQRTUFANA-N	[M-H]-	768.5558	6.23
PE 38:4e; PE 18:0e/20:4;	RXEVLILBESBJQS-ZKVKLVECNA-N	[M-H]-	752.5608	6.37
PE 38:5; PE 18:0-20:5;	MOJMRZJNAPRFBD-GLWDABGQNA-N	[M-H]-	764.525	5.47
PE 38:5; PE 18:1-20:4;	ZYMZKMQPPJPQHY-HAGCXRLMNA-N	[M-H]-	764.5253	5.32
PE 38:5e; PE 16:0e/22:5;	CFQRNKTWTBEFHB-SZRPQGNZNA-N	[M-H]-	750.5442	5.72
PE 38:5e; PE 16:1e/22:4;	OZSVECGNTALICE-GKPKDRHFNA-N	[M-H]-	750.5458	6.05
PE 38:7e; PE 18:2e/20:5;	MJNUFJMYDPWHNM-NECXFRBLNA-N	[M-H]-	746.514	5.15
PE 40:1; PE 22:0-18:1;	FWHVZNCIAUKGET-NKFKGCMQNA-N	[M-H]-	800.6181	7.8
PE 40:2; PE 18:0-22:2;	JQVOEQRCENYJCX-OHNCOSGTNA-N	[M-H]-	798.6026	7.24
PE 40:2e; PE 18:1e/22:1;	HEDSFDSIUIEEHL-CLFAGFIQNA-N	[M-H]-	784.6233	8.11
PE 40:3; PE 18:1-22:2;	JCOVYOJDJNKLNY-SIUUASEZNA-N	[M-H]-	796.5868	6.67
PE 40:3e; PE 18:1e/22:2;	OZPXBYKABZTJOY-LTEAFHAINA-N	[M-H]-	782.6076	7.6
PE 40:4; PE 18:0-22:4;	TVACGFJBGVEGCR-PYQGTGCGNA-N	[M-H]-	794.5716	6.41
PE 40:4e; PE 18:2e/22:2;	JWICLJISDBHCTF-MAZCIEHSNA-N	[M-H]-	780.5914	6.98
PE 40:5; PE 18:0-22:5;	KYERVKWKQQBRQB-NIZIMQIGNA-N	[M-H]-	792.5563	5.95
PE 40:5e; PE 18:1e/22:4;	AXKTVZFNYZPELI-GAXXYEEVNA-N	[M-H]-	778.5779	6.73
PE 40:6; PE 18:0-22:6;	XYYHNDVKALDFHQ-HSBBONCLNA-N	[M-H]-	790.5408	5.75
PE 40:7e; PE 18:2e/22:5;	ZGFRFFVTVBULAT-WHFSXHQCNA-N	[M-H]-	774.5458	5.6
PE 42:3e;	ATVZPAYHGJTUCZ-ZAFPMACDNA-N	[M-H]-	810.6384	8.09
PG 32:0;	BIABMEZBCHDPBV-UHFFFAOYNA-N	[M-H]-	721.5026	4.23
PG 32:1; PG 14:0-18:1;	GKSUEOBCMJKHAW-MSUUIHNZNA-N	[M-H]-	719.4869	3.85
PG 34:1; PG 16:0-18:1;	PAZGBAOHGQRCBP-ZCXUNETKNA-N	[M-H]-	747.5203	4.67
PG 34:2; PG 16:1-18:1;	VCYYBLIRAQBPTM-LJSPAGPLNA-N	[M-H]-	745.5028	3.92
PG 36:1; PG 18:0-18:1;	ZEFGRNLJASLRBZ-ZZEZOPTANA-N	[M-H]-	775.5521	5.24
PG 36:2; PG 18:1-18:1;	DSNRWDQKZIEDDB-CLFAGFIQNA-N	[M-H]-	773.5355	4.35
PG 36:3; PG 18:1-18:2;	FSVTVWTVWNNIQX-RQOIEFAZNA-N	[M-H]-	771.518	4.07
PG 38:2; PG 18:1-20:1;	IMCUMKCJDBGHKN-HWSICPKZNA-N	[M-H]-	801.5665	4.96
PG 38:3; PG 18:1-20:2;	QYNYDIBIMCZYDQ-GYQRTUFANA-N	[M-H]-	799.5498	4.55
PG 38:4; PG 18:1-20:3;	FGLCTGHXZAQEIH-ZYKQNZMBNA-N	[M-H]-	797.5331	4.04
PG 38:6; PG 16:0-22:6;	HUFCXYMYEWLLHT-LGFBOSHVNA-N	[M-H]-	793.5026	3.81
PG 40:3; PG 18:1-22:2;	JCMCUKHBCGGBIL-SIUUASEZNA-N	[M-H]-	827.5815	4.97
PG 40:7; PG 18:1-22:6;	FZJRPYWBMGYDIA-HILQMKNTNA-N	[M-H]-	819.5189	3.86
PI 32:0; PI 16:0-16:0;	IBUKXRINTKQBRQ-UHFFFAOYNA-N	[M-H]-	809.5193	4.51
PI 32:1; PI 16:0-16:1;	QAWXBJDYTIBLRK-PEZBUJJGNA-N	[M-H]-	807.5039	4.09
PI 34:0; PI 16:0-18:0;	NEXFZIYXCPIHEF-UHFFFAOYNA-N	[M-H]-	837.5519	5.01
PI 34:1; PI 16:0-18:1;	PDLAMJKMOKWLAJ-ZCXUNETKNA-N	[M-H]-	835.5359	4.58
PI 34:2; PI 16:1-18:1;	GXAHXPDRXNWFIX-LJSPAGPLNA-N	[M-H]-	833.5203	4.18
PI 36:0; PI 18:0-18:0;	FQZQXPXKJFOAGE-UHFFFAOYNA-N	[M-H]-	865.5814	5.62
PI 36:1; (PI 18:0-18:1) A;	YOBFISPJJWPPTK-ZZEZOPTANA-N	[M-H]-	863.567	5.14
PI 36:1; (PI 18:0-18:1) B;	YOBFISPJJWPPTK-ZZEZOPTANA-N	[M-H]-	863.5672	5.23
PI 36:2; PI 18:0-18:2;	KZVRAFHIKMDULK-MLWYYCKJNA-N	[M-H]-	861.552	4.74
PI 36:2; PI 18:1-18:1;	LALGUHSIWLNTNW-CLFAGFIQNA-N	[M-H]-	861.5518	4.59
PI 36:3; PI 18:1-18:2;	MXJMOLQIXMJUEL-RQOIEFAZNA-N	[M-H]-	859.5352	4.3
PI 36:4; PI 16:0-20:4;	VWRYMIZQLPXULA-JAXHXWBXNA-N	[M-H]-	857.5203	4.13
PI 37:2; PI 18:0-19:2;	RMTABVXUXDYFEA-RYKNKZFFNA-N	[M-H]-	875.5668	5.01
PI 38:1; PI 18:0-20:1;	LTAQEXVIISNEHI-ZPHPHTNENA-N	[M-H]-	891.598	5.65
PI 38:2; PI 18:0-20:2;	RZFIPFIGUWXYNB-OHNCOSGTNA-N	[M-H]-	889.583	5.3
PI 38:3; PI 18:0-20:3;	GGSSNEAFVQRIHU-JTBMWNAQNA-N	[M-H]-	887.5674	5
PI 38:3; PI 18:1-20:2;	YDQKOXBNLGWHTC-GYQRTUFANA-N	[M-H]-	887.5673	4.87
PI 38:4; PI 18:0-20:4;	OJESNYFIPWSOPO-ZKVKLVECNA-N	[M-H]-	885.5525	4.64
PI 38:4; PI 18:1-20:3;	CXNBRAHXDUJOGO-ZYKQNZMBNA-N	[M-H]-	885.5492	4.36
PI 38:5; PI (18:1-20:4) A;	XGZVRASBCZTHNO-HAGCXRLMNA-N	[M-H]-	883.5356	4.18
PI 38:5; PI (18:1-20:4) B;	XGZVRASBCZTHNO-HAGCXRLMNA-N	[M-H]-	883.5353	4.26
PI 40:1; PI 18:0-22:1;	WMWWIUFCIQYQIF-ZPHPHTNENA-N	[M-H]-	919.6284	6.26
PI 40:2; PI 18:0-22:2;	VIFLBOZTTASJKF-OHNCOSGTNA-N	[M-H]-	917.614	5.8
PI 40:3; PI 18:1-22:2;	IWPRKEUZMKOLQC-SIUUASEZNA-N	[M-H]-	915.5978	5.27
PI 40:4; PI 18:0-22:4;	VTYLJIRGLIZEIC-PYQGTGCGNA-N	[M-H]-	913.5822	5.02
PI 40:5; PI 18:0-22:5;	QLABQLNIHHHJCI-NIZIMQIGNA-N	[M-H]-	911.5665	4.67
PI 40:6; PI 18:0-22:6;	DJVOKHFQPGWUPK-HSBBONCLNA-N	[M-H]-	909.5506	4.51
PI 42:2; PI 18:0-24:2;	ODAYJEMQMQJPSD-VQTQWEQBNA-N	[M-H]-	945.6436	6.28
PS 34:1; PS 16:0-18:1;	OIWCYIUQAVBPGV-ZCXUNETKNA-N	[M-H]-	760.5145	4.66
PS 36:1; PS 18:0-18:1;	AJFWREUFUPEYII-ZZEZOPTANA-N	[M-H]-	788.5457	5.25
PS 36:2; PS 18:1-18:1;	WTBFLCSPLLEDEM-CLFAGFIQNA-N	[M-H]-	786.5294	4.73
PS 38:4; PS 18:0-20:4;	IULWELDCBXQXED-ZKVKLVECNA-N	[M-H]-	810.5298	4.76
SM (d34:0)	QHZIGNLCLJPLCU-QPPIDDCLSA-N	[M+Hac-H]-	763.5969	5.18
SM (d34:1)	RWKUXQNLWDTSLO-GWQJGLRPSA-N	[M+Hac-H]-	761.5844	4.92
SM (d34:2)	YLWSJLLZUHSIEA-CKSUKHGVSA-N	[M+Cl]-	735.5227	4.41
SM (d36:1)	LKQLRGMMMAHREN-YJFXYUILSA-N	[M+Hac-H]-	789.6144	5.64
SM (d36:2)	NBEADXWAAWCCDG-QDDWGVBQSA-N	[M+Hac-H]-	787.5983	5.05
SM (d36:3)	YMTVMVYOUDDTQJ-UOMMIRHQSA-N	[M+Hac-H]-	785.5826	4.57
SM (d38:2)	MDRFMTLYKHBJTF-NQYLGBTJSA-N	[M+Hac-H]-	815.6294	5.74
SM (d40:3)	FMJPKVXVBYILLP-FTRJIJDXSA-N	[M+Hac-H]-	841.6439	5.76
SM (d42:2) B	DACOGJMBYLZYDH-GXJPFUDISA-N	[M+Hac-H]-	871.6935	7.01
SM (d42:3)	TXFLWJQVQCDUDZ-BRUGZULGSA-N	[M+Hac-H]-	869.6771	6.42
SM (d44:2)	YXEXWUZHFGYOHJ-UOJCCMJYSA-N?	[M+Hac-H]-	899.7222	7.65
SM d38:1; SM d14:1/24:0;	XEJKSGIGYKZCAF-JMUUFCRMNA-N	[M+Hac-H]-	817.6453	6.34
SM d40:1; SM d14:1/26:0;	TZUYSEPWXQAPDF-BSKJHSHCNA-N	[M+Cl]-	821.6334	7.04
SM d40:2; SM d14:2/26:0;	UDQOOWDOKYIZIL-OQEKBAOYNA-N	[M+Hac-H]-	843.6611	6.42
SM d41:1; SM d14:1/27:0;	FRHHYMDJAIMVLJ-NHFVQZBWNA-N	[M+Hac-H]-	859.6925	7.39
SM d41:2; SM d14:2/27:0;	CMFBHPBTIPJQCF-BOWZUKSANA-N	[M+Hac-H]-	857.677	6.82
SM d42:1; SM d14:1/28:0;	IWPXHASLYUFFJF-OGSMZCTINA-N	[M+Cl]-	849.6627	7.72
SM d43:1; SM d14:1/29:0;	ULARPQXVRGTQDC-OHYVAXEENA-N	[M+Hac-H]-	887.7227	8.03
SM d43:2; SM d14:2/29:0;	VDHDLIORVGQGHF-NPERDHNFNA-N	[M+Hac-H]-	885.7062	7.26
METABOLITES_END
#END