#METABOLOMICS WORKBENCH juliehaines_20251202_062515 DATATRACK_ID:6799 STUDY_ID:ST004412 ANALYSIS_ID:AN007379 PROJECT_ID:PR002788
VERSION             	1
CREATED_ON             	December 2, 2025, 6:57 am
#PROJECT
PR:PROJECT_TITLE                 	Altered Hepatic Metabolism in Down Syndrome
PR:PROJECT_SUMMARY               	Trisomy 21 (T21) gives rise to Down syndrome (DS), the most commonly occurring
PR:PROJECT_SUMMARY               	chromosomal abnormality in humans. T21 affects nearly every organ and tissue
PR:PROJECT_SUMMARY               	system in the body, predisposing individuals with DS to congenital heart
PR:PROJECT_SUMMARY               	defects, autoimmunity, and Alzheimer’s disease, among other co-occurring
PR:PROJECT_SUMMARY               	conditions. Here, using multi-omic analysis of plasma from more than 400 people,
PR:PROJECT_SUMMARY               	we report broad metabolic changes in the population with DS typified by
PR:PROJECT_SUMMARY               	increased bile acid levels and protein signatures of liver dysfunction. In a
PR:PROJECT_SUMMARY               	mouse model of DS, we demonstrate conservation of perturbed bile acid metabolism
PR:PROJECT_SUMMARY               	accompanied by liver pathology. Bulk RNA-sequencing revealed widespread impacts
PR:PROJECT_SUMMARY               	of the Dp16 model on hepatic metabolism and inflammation, while single-cell
PR:PROJECT_SUMMARY               	transcriptomics highlighted cell types associated with these observations.
PR:PROJECT_SUMMARY               	Modulation of dietary fat profoundly impacted gene expression, bile acids, and
PR:PROJECT_SUMMARY               	liver pathology. Overall, these data represent evidence for altered hepatic
PR:PROJECT_SUMMARY               	metabolism in DS that could be modulated by diet.
PR:INSTITUTE                     	University of Colorado Anschutz Medical Campus
PR:LABORATORY                    	Lab of Angelo D'Alessandro in collaboration with labs of Kelly Sullivan and
PR:LABORATORY                    	Joaquin Espinosa
PR:LAST_NAME                     	Haines
PR:FIRST_NAME                    	Julie
PR:ADDRESS                       	12801 E 17th Ave, Room 1303, Aurora, Colorado, 80045, USA
PR:EMAIL                         	julie.haines@cuanschutz.edu
PR:PHONE                         	3037243339
#STUDY
ST:STUDY_TITLE                   	Plasma lipidomics characterization of mouse models of Down syndrome Dp16 and
ST:STUDY_TITLE                   	Dp16-2xIfnrs versus WT mice
ST:STUDY_SUMMARY                 	Lipidomics of plasma at baseline from adult mice comparing WT, the Dp16 Down
ST:STUDY_SUMMARY                 	syndrome mouse model, and Dp16-2xIfnrs, where genome editing has been utilized
ST:STUDY_SUMMARY                 	to correct the dosage of the Ifnr locus within a mouse model of DS.
ST:INSTITUTE                     	University of Colorado Anschutz Medical Campus
ST:LAST_NAME                     	Haines
ST:FIRST_NAME                    	Julie
ST:ADDRESS                       	12801 E 17th Ave, Room 1303, Aurora, Colorado, 80045, USA
ST:EMAIL                         	julie.haines@cuanschutz.edu
ST:PHONE                         	3037243339
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Mus musculus
SU:GENDER                        	Male and female
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data
SUBJECT_SAMPLE_FACTORS           	-	F2-51-02-	Chromosome 21 status:Dp16 | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-02.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-03-	Chromosome 21 status:Dp16 | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-03.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-04-	Chromosome 21 status:Dp16 | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-04.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-05-	Chromosome 21 status:Dp16 | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-05.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-06-	Chromosome 21 status:Dp16 | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-06.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-07-	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-07.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-08-	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-08.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-09-	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-09.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-10-	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-10.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-11-	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-11.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-12-	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-12.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-13-	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-13.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-14-	Chromosome 21 status:Dp16-2xIfnrs | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-14.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-15-	Chromosome 21 status:Dp16-2xIfnrs | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-15.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-16-	Chromosome 21 status:Dp16-2xIfnrs | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-16.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-17-	Chromosome 21 status:Dp16-2xIfnrs | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-17.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-18-	Chromosome 21 status:Dp16-2xIfnrs | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-18.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-19-	Chromosome 21 status:Dp16-2xIfnrs | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-19.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-20-	Chromosome 21 status:Dp16-2xIfnrs | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-20.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-21-	Chromosome 21 status:Dp16-2xIfnrs | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-21.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-22-	Chromosome 21 status:Dp16-2xIfnrs | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-22.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-23-	Chromosome 21 status:Dp16-2xIfnrs | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-23.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-24-	Chromosome 21 status:WT | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-24.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-25-	Chromosome 21 status:WT | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-25.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-26-	Chromosome 21 status:WT | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-26.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-27-	Chromosome 21 status:WT | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-27.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-28-	Chromosome 21 status:WT | Sex:Female | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-28.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-29-	Chromosome 21 status:WT | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-29.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-30-	Chromosome 21 status:WT | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-30.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-31-	Chromosome 21 status:WT | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-31.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-32-	Chromosome 21 status:WT | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-32.raw
SUBJECT_SAMPLE_FACTORS           	-	F2-51-33-	Chromosome 21 status:WT | Sex:Male | Sample source:plasma	RAW_FILE_NAME(raw file name)=F2-51-33.raw
#COLLECTION
CO:COLLECTION_SUMMARY            	Blood was collected from WT, Dp16, or Dp16-2xIfnrs mice via a cardiac puncture
CO:COLLECTION_SUMMARY            	post euthanasia into lithium heparin tubes (Sarstedt). Plasma was isolated from
CO:COLLECTION_SUMMARY            	whole blood via centrifugation for 15 minutes at 700g, then the supernatant was
CO:COLLECTION_SUMMARY            	isolated and spun again for 15 minutes at 2100g.
CO:SAMPLE_TYPE                   	Blood (plasma)
CO:STORAGE_CONDITIONS            	-80℃
#TREATMENT
TR:TREATMENT_SUMMARY             	No treatments were performed for this lipidomics study. The Dp16-2xIfnrs mouse
TR:TREATMENT_SUMMARY             	model was previously described in PMID 37277650.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Plasma specimens were thawed on ice then a 10 uL aliquot was diluted with 240 uL
SP:SAMPLEPREP_SUMMARY            	cold methanol. Samples were vortexed for 30 minutes at 4 degrees. Insoluble
SP:SAMPLEPREP_SUMMARY            	material was then pelleted by centrifugation (18,000 g, 10 min) then
SP:SAMPLEPREP_SUMMARY            	supernatants were diluted 1:1 with 5 mM ammonium acetate.
SP:PROCESSING_STORAGE_CONDITIONS 	4℃
SP:EXTRACT_STORAGE               	-80℃
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	Positive C18 global lipidomics
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
CH:INSTRUMENT_NAME               	Thermo Vanquish
CH:COLUMN_NAME                   	Waters ACQUITY UPLC HSS T3 (150 x 2.1mm,1.8um)
CH:SOLVENT_A                     	75% water/25% acetonitrile; 5 mM ammonium acetate
CH:SOLVENT_B                     	90% isopropanol/10% acetonitrile; 5 mM ammonium acetate
CH:FLOW_GRADIENT                 	0–10 min 30–100% B and 0.325 mL/min; 10–12 min 100% B and 0.325 mL/min;
CH:FLOW_GRADIENT                 	12–12.5 min 100–30% B and 0.4 mL/min; 12.5–14.9 min 30% B and 0.4 mL/min;
CH:FLOW_GRADIENT                 	14.9–15 min 30% B and 0.325 mL/min
CH:FLOW_RATE                     	0.3-0.4 ml/min
CH:COLUMN_TEMPERATURE            	45
CH:SAMPLE_INJECTION              	10 uL
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Thermo Q Exactive Orbitrap
MS:INSTRUMENT_TYPE               	Orbitrap
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	POSITIVE
MS:MS_COMMENTS                   	The Q Exactive was run independently in positive and negative ion mode, scanning
MS:MS_COMMENTS                   	using full MS from 125-1500 m/z at 70,000 resolution and top 10 data-dependent
MS:MS_COMMENTS                   	MS2 at 17,500 resolution. Electrospray ionization was achieved with 45 Arb
MS:MS_COMMENTS                   	sheath gas, 25 Arb auxiliary gas, and 4 kV spray voltage. Calibration was
MS:MS_COMMENTS                   	performed prior to the run using the PierceTM Positive and Negative Ion
MS:MS_COMMENTS                   	Calibration Solutions (Thermo Fisher Scientific). Run order of samples was
MS:MS_COMMENTS                   	randomized and technical replicates were injected after every 4 samples to
MS:MS_COMMENTS                   	assess quality control.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	peak area
MS_METABOLITE_DATA_START
Samples	F2-51-02-	F2-51-03-	F2-51-04-	F2-51-05-	F2-51-06-	F2-51-07-	F2-51-08-	F2-51-09-	F2-51-10-	F2-51-11-	F2-51-12-	F2-51-13-	F2-51-14-	F2-51-15-	F2-51-16-	F2-51-17-	F2-51-18-	F2-51-19-	F2-51-20-	F2-51-21-	F2-51-22-	F2-51-23-	F2-51-24-	F2-51-25-	F2-51-26-	F2-51-27-	F2-51-28-	F2-51-29-	F2-51-30-	F2-51-31-	F2-51-32-	F2-51-33-
Factors	Chromosome 21 status:Dp16 | Sex:Female | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Female | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Female | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Female | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Female | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16 | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16-2xIfnrs | Sex:Female | Sample source:plasma	Chromosome 21 status:Dp16-2xIfnrs | Sex:Female | Sample source:plasma	Chromosome 21 status:Dp16-2xIfnrs | Sex:Female | Sample source:plasma	Chromosome 21 status:Dp16-2xIfnrs | Sex:Female | Sample source:plasma	Chromosome 21 status:Dp16-2xIfnrs | Sex:Female | Sample source:plasma	Chromosome 21 status:Dp16-2xIfnrs | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16-2xIfnrs | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16-2xIfnrs | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16-2xIfnrs | Sex:Male | Sample source:plasma	Chromosome 21 status:Dp16-2xIfnrs | Sex:Male | Sample source:plasma	Chromosome 21 status:WT | Sex:Female | Sample source:plasma	Chromosome 21 status:WT | Sex:Female | Sample source:plasma	Chromosome 21 status:WT | Sex:Female | Sample source:plasma	Chromosome 21 status:WT | Sex:Female | Sample source:plasma	Chromosome 21 status:WT | Sex:Female | Sample source:plasma	Chromosome 21 status:WT | Sex:Male | Sample source:plasma	Chromosome 21 status:WT | Sex:Male | Sample source:plasma	Chromosome 21 status:WT | Sex:Male | Sample source:plasma	Chromosome 21 status:WT | Sex:Male | Sample source:plasma	Chromosome 21 status:WT | Sex:Male | Sample source:plasma
AcCa 8:1	19074	28270	42489	38955	63610	32222	25859	29079	37872	28853	35308	31552	50395	45087	43955	28113	48165	26106	32322	33880	34994	40958	20521	32477	44993	48578	35422	29671	24104	20720	35647	25642
AcCa 8:0	20589	51439	85093	129461	106976	45027	40915	56982	65794	75213	112119	48058	111849	98386	100944	44610	132043	41992	78351	66801	52880	116717	26563	51582	74671	85702	65430	60175	45155	44932	67847	44672
AcCa 6:0	32070	256533	337929	378442	411035	218402	204129	257239	442408	306209	395911	192553	381732	426057	411179	182134	476608	198169	512316	387508	306405	372334	216075	289755	250458	332047	247960	343329	189352	251891	310139	136267
AcCa 5:0-OH	260177	673869	402626	626917	757027	589301	464156	508019	639736	536139	539907	596801	485340	336569	411568	492403	674560	631044	408448	638257	592111	741978	441929	476331	689581	446216	470729	443932	543038	306519	692435	306408
AcCa 5:0	105540	118499	262314	231582	258718	195861	182135	197417	234492	214641	205459	178736	137088	189729	193924	108886	174239	125292	210185	239758	317388	227121	217765	147154	110555	187446	117445	178401	172046	108297	144764	114795
AcCa 4:0-OH	212781	822830	2422594	1726176	1023544	901771	601432	746762	852846	1754813	1778867	993094	3291118	1386588	2387563	1291045	2514808	994411	1049540	1161521	955846	2261980	426671	576214	1541898	1255545	1042241	1141908	1053300	987427	1577200	576846
AcCa 4:0	352866	2078853	2000278	2422292	1716381	1588068	1956988	1738706	2818043	2037632	2030104	1976888	2216866	2342304	2193789	1383813	2311631	2454572	2592358	2437292	1960241	1529158	1959491	1671343	1861326	2424237	2196577	2780207	1095416	1947555	1625003	1261532
AcCa 3:0	1611570	3250547	6030948	5473398	4510418	3821764	5108039	3940368	4629576	3231186	5065082	3706817	2763473	3403300	4169049	2963104	4522698	5233710	3883208	6832582	5297984	5321408	4380984	3118550	3284047	3009867	2902742	3943004	3798811	2626873	3345221	1942394
AcCa 20:4	168469	191490	292344	294307	283397	191235	136633	211785	137289	143500	187915	171876	369181	277140	280031	176302	326249	140117	172678	196226	153727	222241	114057	237063	191636	388316	199426	180537	139861	94103	244704	162431
AcCa 2:0	33700000	64100000	127000000	91900000	93300000	46200000	47600000	106000000	84600000	151000000	91900000	79200000	103000000	110000000	139000000	96000000	101000000	68500000	54600000	92800000	60200000	139000000	44100000	61500000	106000000	127000000	130000000	62200000	80500000	58900000	99200000	41900000
AcCa 18:2	287166	425859	846314	700295	841759	703792	480765	860748	606097	554786	825820	640980	1151509	721122	831880	468172	886024	535117	617598	733368	675998	1063594	222286	585507	526747	787230	478815	558044	567159	330415	671590	695654
AcCa 16:1	38561	56099	202311	262196	190458	90574	62413	117553	141106	154653	174182	115126	187098	284956	211203	136325	243562	75384	132113	136034	110407	254544	19698	74067	120683	139446	123443	157413	99495	81184	224201	101398
AcCa 16:0	708956	868571	1512248	1247188	1255680	1105690	826136	1378108	1218818	1184060	1108562	927485	1501306	1626716	1287039	982728	1303977	795825	1139251	1246751	970631	1823464	578696	824539	1028236	1655954	798744	1442190	1020351	752320	1733376	1214259
AcCa 14:1	70983	113484	161361	254470	243785	69624	63230	130826	78889	122742	197125	79877	275886	245735	250614	155226	270005	83123	82057	108077	88195	215385	34806	147349	158584	204371	157064	111715	100218	79553	135371	99765
AcCa 14:0	77551	124232	291533	281072	253169	123933	93692	198299	162209	171810	206592	135182	376927	267213	298331	165193	302097	100519	169625	177633	130404	289927	69422	96968	171577	197482	161975	189501	125190	87266	211865	157890
AcCa 12:1	29241	58550	48955	69353	95536	12244	12968	17897	14977	24377	36307	17083	76003	57173	72555	56267	92111	11285	14268	16187	13976	43541	42698	53229	64097	63061	75032	16256	16960	14368	21560	12657
AcCa 12:0	26067	43845	81057	112935	102562	34296	28131	58773	45884	68964	81973	40357	127239	98961	117169	46878	141917	34559	59683	54106	49933	90412	17615	45083	69338	80298	58669	55299	43726	29979	58554	48329
AcCa 10:1	21384	28878	41051	36944	55102	94165	34242	32982	99629	36382	70829	69922	61970	32168	43281	25643	55814	52050	65825	98448	125408	61664	17817	33456	42809	41988	35172	15273	20639	14681	23849	19228
AcCa 10:0	31363	70007	134908	203029	149411	67408	54156	78429	63933	141449	171861	72150	129530	186362	134003	83590	237454	57066	90535	86538	90053	233255	22257	84015	134789	147054	92634	83546	82615	71391	123943	76456
Sphingosine	49122	29109	52169	61332	61179	47679	54366	35395	35443	47204	46359	29999	47605	50759	46552	44429	47901	42691	39455	61952	54374	53194	36812	43793	44129	49501	42319	45199	46571	32186	62408	46299
Sphinganine	20255	77401	98210	31223	39633	40627	41824	155873	221137	45844	23137	110684	78035	112904	45991	26135	49738	38419	182509	148695	125732	43439	43126	28687	41400	86554	44145	185381	97497	20786	112375	160201
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	KEGG ID	Pathway/class	m/z	r.t.
AcCa 8:1	ac111	Carnitine and fatty acid metabolism	286.2013	1.39
AcCa 8:0	HMDB00791	Carnitine and fatty acid metabolism	288.2168	1.63
AcCa 6:0	HMDB00756	Carnitine and fatty acid metabolism	260.1857	1.25
AcCa 5:0-OH	ac107	Carnitine and fatty acid metabolism	262.1647	0.98
AcCa 5:0	C20826	Carnitine and fatty acid metabolism	246.1700	1.23
AcCa 4:0-OH	HMDB13127	Carnitine and fatty acid metabolism	248.1491	0.97
AcCa 4:0	C02862	Carnitine and fatty acid metabolism	232.1540	0.98
AcCa 3:0	C03017	Carnitine and fatty acid metabolism	218.1386	0.98
AcCa 20:4	ac125	Carnitine and fatty acid metabolism	448.3410	5.52
AcCa 2:0	C02571	Carnitine and fatty acid metabolism	204.1229	0.97
AcCa 18:2	HMDB01064	Carnitine and fatty acid metabolism	424.3428	5.51
AcCa 16:1	HMDB06317	Carnitine and fatty acid metabolism	398.3260	5.22
AcCa 16:0	C02990	Carnitine and fatty acid metabolism	400.3426	5.95
AcCa 14:1	HMDB13329	Carnitine and fatty acid metabolism	370.2948	4.19
AcCa 14:0	HMDB05066	Carnitine and fatty acid metabolism	372.3123	4.83
AcCa 12:1	HMDB13326	Carnitine and fatty acid metabolism	342.2637	3.03
AcCa 12:0	HMDB02250	Carnitine and fatty acid metabolism	344.2794	3.63
AcCa 10:1	CID57357170	Carnitine and fatty acid metabolism	314.2324	1.89
AcCa 10:0	HMDB00651	Carnitine and fatty acid metabolism	316.2481	2.47
Sphingosine	C00319	Oxylipins	300.2892	7.06
Sphinganine	C00836	Oxylipins	302.3049	6.55
METABOLITES_END
#END