#METABOLOMICS WORKBENCH Helena_Zacharias_20240809_053452 DATATRACK_ID:5091 STUDY_ID:ST003477 ANALYSIS_ID:AN005712 PROJECT_ID:PR002136
VERSION             	1
CREATED_ON             	September 9, 2024, 11:30 am
#PROJECT
PR:PROJECT_TITLE                 	MetaboSERV - a platform for selecting, exchanging, and visualizing metabolomics
PR:PROJECT_TITLE                 	data with controlled data access
PR:PROJECT_TYPE                  	Research Publication, Software development
PR:PROJECT_SUMMARY               	The growing number of metabolomics studies, based on high-dimensional data
PR:PROJECT_SUMMARY               	measured by hyphenated mass spectrometry (MS) and/or nuclear magnetic resonance
PR:PROJECT_SUMMARY               	(NMR) spectroscopy, has sparked the creation of several public metabolomics data
PR:PROJECT_SUMMARY               	repositories. Each repository emphasizes different aspects regarding data
PR:PROJECT_SUMMARY               	selection and representation, but most offer only limited options for
PR:PROJECT_SUMMARY               	privacy-preserving data sharing. We present MetaboSERV, an open-source,
PR:PROJECT_SUMMARY               	browser-based metabolomics platform dedicated to the selection, integration and
PR:PROJECT_SUMMARY               	sharing of quantitative metabolomics data and metadata with controlled data
PR:PROJECT_SUMMARY               	access. MetaboSERV aims to aid researchers in analyzing their results by
PR:PROJECT_SUMMARY               	facilitating means to browse, visualize and compare data across available data
PR:PROJECT_SUMMARY               	sets. It provides different access control functionalities, creating an
PR:PROJECT_SUMMARY               	environment in which data can be shared safely in a privacy-preserving manner to
PR:PROJECT_SUMMARY               	support collaborative and interdisciplinary research. Furthermore, it is
PR:PROJECT_SUMMARY               	designed to be extensible and adaptable to existing data management
PR:PROJECT_SUMMARY               	infrastructures through the creation of self-managed MetaboSERV instances, for
PR:PROJECT_SUMMARY               	which we provide the source code and a set of pre-built Docker images.
PR:INSTITUTE                     	Hannover Medical School
PR:DEPARTMENT                    	Peter L. Reichertz Institute for Medical Informatics
PR:LAST_NAME                     	Zacharias
PR:FIRST_NAME                    	Helena
PR:ADDRESS                       	Carl-Neuberg-Str. 1, 30625 Hannover, Germany
PR:EMAIL                         	zacharias.helena@mh-hannover.de
PR:PHONE                         	+49 511/532-30881
PR:FUNDING_SOURCE                	Bundesministerium für Bildung und Forschung (BMBF), e:Med initiative
PR:CONTRIBUTORS                  	Tim Tucholski, Angela Maennel, Yacoub Abelard Njipouombe Nsangou, Sven
PR:CONTRIBUTORS                  	Schuchardt, Matthias Gruber, Fabian Kellermeier, Katja Dettmer, Peter J. Oefner,
PR:CONTRIBUTORS                  	Wolfram Gronwald, Michael Altenbuchinger, Jürgen Dönitz and Helena U.
PR:CONTRIBUTORS                  	Zacharias
#STUDY
ST:STUDY_TITLE                   	Biocrates Test
ST:STUDY_SUMMARY                 	We assessed technical replicates of NIST Standard Reference Material (SRM 1950)
ST:STUDY_SUMMARY                 	human plasma specimens on different Biocrates MxP Quant 500 kit well-plates. In
ST:STUDY_SUMMARY                 	total, 9 different technical replicates on 9 different Biocrates MxP Quant 500
ST:STUDY_SUMMARY                 	kit well-plates were measured. The resulting data is used as a showcase to
ST:STUDY_SUMMARY                 	demonstrate the utility of our MetaboSERV platform for selecting, exchanging,
ST:STUDY_SUMMARY                 	and visualizing metabolomics data with controlled data access.
ST:INSTITUTE                     	Hannover Medical School
ST:DEPARTMENT                    	Peter L. Reichertz Institute for Medical Informatics
ST:LAST_NAME                     	Zacharias
ST:FIRST_NAME                    	Helena
ST:ADDRESS                       	Carl-Neuberg-Str. 1, 30625 Hannover, Germany
ST:EMAIL                         	zacharias.helena@mh-hannover.de
ST:PHONE                         	+49 511/532-30881
#SUBJECT
SU:SUBJECT_TYPE                  	Human
SU:SUBJECT_SPECIES               	Homo sapiens
SU:TAXONOMY_ID                   	9606
#FACTORS
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data
SUBJECT_SAMPLE_FACTORS           	-	plate_1	Biocrates Plate:1 | Sample source:NIST Standard Reference Material (SRM 1950)	
SUBJECT_SAMPLE_FACTORS           	-	plate_2	Biocrates Plate:2 | Sample source:NIST Standard Reference Material (SRM 1950)	
SUBJECT_SAMPLE_FACTORS           	-	plate_3	Biocrates Plate:3 | Sample source:NIST Standard Reference Material (SRM 1950)	
SUBJECT_SAMPLE_FACTORS           	-	plate_4	Biocrates Plate:4 | Sample source:NIST Standard Reference Material (SRM 1950)	
SUBJECT_SAMPLE_FACTORS           	-	plate_5	Biocrates Plate:5 | Sample source:NIST Standard Reference Material (SRM 1950)	
SUBJECT_SAMPLE_FACTORS           	-	plate_6	Biocrates Plate:6 | Sample source:NIST Standard Reference Material (SRM 1950)	
SUBJECT_SAMPLE_FACTORS           	-	plate_7	Biocrates Plate:7 | Sample source:NIST Standard Reference Material (SRM 1950)	
SUBJECT_SAMPLE_FACTORS           	-	plate_8	Biocrates Plate:8 | Sample source:NIST Standard Reference Material (SRM 1950)	
SUBJECT_SAMPLE_FACTORS           	-	plate_9	Biocrates Plate:9 | Sample source:NIST Standard Reference Material (SRM 1950)	
#COLLECTION
CO:COLLECTION_SUMMARY            	NIST Standard Reference Material (SRM 1950)
CO:SAMPLE_TYPE                   	Blood (plasma)
#TREATMENT
TR:TREATMENT_SUMMARY             	no specific treatment
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Samples were analyzed using the MxP® Quant 500 kit according to the kit
SP:SAMPLEPREP_SUMMARY            	protocol. A sample volume of 10 µL was used. It was directly added to a 96-well
SP:SAMPLEPREP_SUMMARY            	kit plate followed by a derivatization solution. The analytes were eluted from
SP:SAMPLEPREP_SUMMARY            	the plate with an extraction solvent. The extracts were split for LC and FIA
SP:SAMPLEPREP_SUMMARY            	analysis and diluted accordingly using either water for LC-MS/MS or a FIA
SP:SAMPLEPREP_SUMMARY            	solvent for FIA-MS/MS.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	UHPLC
CH:CHROMATOGRAPHY_TYPE           	Other
CH:INSTRUMENT_NAME               	ExionLC 30AD (Sciex)
CH:COLUMN_NAME                   	MxP Quant 500 column system (Biocrates)
CH:SOLVENT_A                     	100% water; 0.2% formic acid
CH:SOLVENT_B                     	100% acetonitrile; 0.2% formic acid
CH:FLOW_GRADIENT                 	Flow Gradient LC1: 0% B (0.25 min) --> 12% B (1.25 min) --> 17.5% B (1.2 min)
CH:FLOW_GRADIENT                 	--> 50% B (1.3 min) --> 100% B (0.5 min) --> stay at 100% B (0.5 min) --> 0% B
CH:FLOW_GRADIENT                 	(0.1 min) --> stay at 0% B (0.7 min), total 5.8 min Flow Gradient LC2: 0% B
CH:FLOW_GRADIENT                 	(0.25 min) --> 25% B (0.25 min) --> 50% B (1.5 min) --> 75% B (1.0 min) --> 100%
CH:FLOW_GRADIENT                 	B (0.5 min) --> stay at 100% B (1.5 min) --> 0% B (0.1 min) --> stay at 0% B
CH:FLOW_GRADIENT                 	(0.7 min), total 5.8 min
CH:FLOW_RATE                     	0.8 mL/min, increased to 1.0 mL/min from minute 4.7 to 5.1
CH:COLUMN_TEMPERATURE            	50°C
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	ABI Sciex 6500+
MS:INSTRUMENT_TYPE               	Triple quadrupole
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	UNSPECIFIED
MS:MS_COMMENTS                   	Samples were analyzed with four methods employing HPLC separation (LC) or flow
MS:MS_COMMENTS                   	injection analysis (FIA). LC1 used ionization in positive mode and scheduled MRM
MS:MS_COMMENTS                   	detection (125 transitions). LC2 used ionization in negative mode and scheduled
MS:MS_COMMENTS                   	MRM detection (69 transitions). Both FIA methods used ionization in positive
MS:MS_COMMENTS                   	mode and MRM detection (165 and 382 transitions). Data were analyzed employing
MS:MS_COMMENTS                   	the Biocrates MetIDQ software.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	µM
MS_METABOLITE_DATA_START
Samples	plate_1	plate_2	plate_3	plate_4	plate_5	plate_6	plate_7	plate_8	plate_9
Factors	Biocrates Plate:1 | Sample source:NIST Standard Reference Material (SRM 1950)	Biocrates Plate:2 | Sample source:NIST Standard Reference Material (SRM 1950)	Biocrates Plate:3 | Sample source:NIST Standard Reference Material (SRM 1950)	Biocrates Plate:4 | Sample source:NIST Standard Reference Material (SRM 1950)	Biocrates Plate:5 | Sample source:NIST Standard Reference Material (SRM 1950)	Biocrates Plate:6 | Sample source:NIST Standard Reference Material (SRM 1950)	Biocrates Plate:7 | Sample source:NIST Standard Reference Material (SRM 1950)	Biocrates Plate:8 | Sample source:NIST Standard Reference Material (SRM 1950)	Biocrates Plate:9 | Sample source:NIST Standard Reference Material (SRM 1950)
C0	23.4	23.8	33.2	33.1	27.6	31.5	22	34.7	30
C2	4.86	5.02	4.92	4.59	4.45	4.38	5.26	4.63	4.86
C3	0.274	0.248	0.29	0.306	0.266	0.25	0.443	0.305	0.255
C3-DC.(C4-OH)	0.054	0.064	0.064	0.055	0.065	0.05	0.068	0.064	0.072
C3-OH	NA	NA	NA	0.004	0	0	0.148	0.008	0.242
C3:1	NA	NA	NA	0.048	0.006	0.021	0.364	0.039	0.04
C4	0.139	0.154	0.138	0.14	0.123	0.122	0.267	0.16	0.138
C4:1	NA	NA	NA	0.012	0.017	0.016	0.109	0.007	0.019
C5	0.102	0.093	0.088	0.088	0.078	0.089	0.146	0.103	0.075
C5-DC.(C6-OH)	NA	NA	NA	NA	NA	NA	0.115	NA	0.042
C5-M-DC	NA	NA	NA	NA	NA	NA	0.091	NA	0.024
C5-OH.(C3-DC-M)	NA	NA	NA	NA	NA	NA	0.131	NA	0.06
C5:1	NA	NA	NA	NA	NA	NA	0.124	NA	0.024
C5:1-DC	NA	NA	NA	NA	NA	NA	0.039	NA	0.006
C6.(C4:1-DC)	NA	NA	NA	NA	NA	NA	0.219	0.082	0.055
C6:1	NA	NA	NA	NA	NA	NA	0.099	0.026	0.001
C7-DC	NA	NA	NA	NA	0.033	0.024	0.108	NA	NA
C8	NA	NA	NA	NA	NA	NA	0.33	NA	NA
C9	NA	NA	NA	NA	NA	0.002	NA	NA	NA
C10	NA	NA	NA	0.222	0.152	0.155	NA	0.149	NA
C10:1	NA	NA	NA	NA	NA	NA	NA	NA	NA
C10:2	NA	NA	NA	NA	NA	NA	NA	NA	NA
C12	0.067	NA	NA	0.098	0.065	NA	NA	NA	NA
C12-DC	NA	NA	NA	NA	NA	NA	NA	NA	NA
C12:1	NA	NA	NA	NA	NA	NA	NA	NA	NA
C14	NA	NA	NA	NA	NA	NA	NA	NA	NA
C14:1	0.055	0.047	0.052	0.055	0.085	0.046	NA	0.048	0.042
C14:1-OH	NA	NA	NA	NA	NA	NA	NA	NA	NA
C14:2	NA	NA	NA	NA	0.059	NA	NA	NA	NA
C14:2-OH	NA	NA	NA	NA	NA	0.012	NA	NA	NA
C16	0.075	0.1	0.084	0.06	0.057	0.068	0.202	0.09	0.089
C16-OH	NA	NA	NA	NA	NA	NA	0.031	NA	NA
C16:1	NA	NA	NA	NA	NA	NA	NA	NA	NA
C16:1-OH	NA	NA	NA	0.025	NA	NA	NA	NA	NA
C16:2	NA	NA	NA	NA	NA	NA	NA	NA	NA
C16:2-OH	NA	NA	NA	NA	NA	NA	NA	NA	NA
C18	0.043	0.046	NA	0.032	0.044	NA	NA	0.071	NA
C18:1	0.097	0.109	0.061	0.103	0.073	0.095	NA	0.086	NA
C18:1-OH	NA	NA	NA	NA	0.057	NA	NA	NA	NA
C18:2	0.05	0.037	0.03	NA	0.039	NA	0.089	0.037	0.04
Trigonelline	0.72	0.834	0.66	0.719	0.654	0.693	0.715	0.702	0.674
TMAO	4.13	4.07	3.79	4.03	3.52	3.4	4.65	3.47	3.85
Ala	313	296	316	326	276	293	358	314	316
Arg	89.2	83.8	88.7	91.2	75.5	81.3	98.9	94.2	87
Asn	40	39.1	39.2	40.1	34.3	35.2	41.7	38.7	41
Asp	7.9	8.21	7.12	7.43	6.08	6.67	7.7	6.23	6.91
Cys	36.1	43.2	38.6	34.7	32.4	35.2	41.3	38.7	38.3
Gln	503	502	533	520	458	462	587	512	521
Glu	68.9	70.2	73.2	76.9	71.3	71.6	81.5	74.5	74.8
Gly	263	265	257	265	239	249	287	273	247
His	74	69.6	70.2	72.2	64.1	67.8	83.2	77.5	69
Ile	62.2	65.6	60.1	66.1	57.4	63.4	71.4	65	68.4
Leu	103	101	102	101	88.9	101	116	108	98.1
Lys	147	136	148	136	132	129	157	144	143
Met	23	24	22.9	22.5	19.8	19.9	24.6	25.1	23.2
Phe	53.3	54.7	52.5	53.4	46.7	49.8	56.5	57.5	54
Pro	183	189	181	183	163	171	207	192	178
Ser	94.2	86.6	89.6	85.4	78.2	83.9	103	92.8	90.7
Thr	115	112	110	109	101	111	127	113	107
Trp	46.8	48.9	41.7	44.7	42.5	44.2	51.1	45.7	43.5
Tyr	58.2	59.9	54.3	57.5	50.4	55.2	65.4	61.6	56.2
Val	167	163	163	172	149	162	181	174	166
1-Met-His	3.31	3.45	3.34	3.72	3.17	3.38	3.87	3.48	3.41
3-Met-His	4.24	3.96	4.1	3.94	3.65	3.96	4.36	4.24	3.91
5-AVA	0.058	0.055	0.057	0.056	0.053	0.054	0.071	0.059	0.056
AABA	10.8	10.8	10.6	10.8	9.83	9.37	13.2	11.3	10.9
Ac-Orn	NA	NA	NA	NA	NA	NA	NA	NA	NA
ADMA	0.468	0.491	0.431	0.397	0.35	0.372	0.414	0.439	0.389
alpha-AAA	0.77	0.729	0.69	0.707	0.453	0.51	0.681	0.548	0.627
Anserine	0.013	0.009	NA	NA	NA	0.002	0.005	NA	0.006
BABA	0.035	0.042	NA	0.034	NA	NA	0.047	NA	NA
Betaine	27	30.7	30.3	31.4	29.2	32.2	35.8	33.9	31.9
c4-OH-Pro	0.307	NA	NA	NA	NA	NA	NA	NA	NA
Carnosine	NA	NA	NA	NA	NA	NA	NA	NA	NA
Cit	30.2	30.5	30.1	31	27.6	28.7	32.6	31.1	30.3
Creatinine	59.7	61	59.4	59	50	53.6	67.3	58.9	59.7
Cystine	5.44	5.24	3.32	5.75	2.35	5.32	9.51	2.62	3.14
DOPA	0.25	0.262	NA	NA	NA	NA	NA	NA	NA
HArg	2.13	2.19	2.23	2.29	1.87	2.13	2.39	2.42	2.2
HCys	6.63	7.6	6.1	5.98	5.45	6.23	7.07	7.15	7.59
Kynurenine	1.97	1.92	1.51	1.44	1.33	1.47	1.69	1.69	1.46
Met-SO	0.822	0.859	0.437	0.715	0.51	0.528	0.767	0.72	0.832
Nitro-Tyr	NA	0.221	NA	NA	NA	NA	NA	NA	NA
Orn	70.2	73.8	76.2	75.1	58.8	67.1	79.9	75	69
PAG	NA	0.01	0.005	NA	NA	NA	0.014	NA	NA
PheAlaBetaine	NA	NA	NA	NA	NA	NA	NA	NA	NA
ProBetaine	3.37	3.45	3.39	3.49	2.96	3.19	3.8	3.74	3.47
Sarcosine	1.58	1.94	1.27	1.18	1.11	1.19	1.41	1.31	1.23
SDMA	0.435	0.43	0.426	0.413	0.369	0.384	0.438	0.464	0.438
t4-OH-Pro	13.1	13.3	12	12.9	11.7	11.9	14.6	13.4	14
Taurine	36.3	36	34.5	34.9	30.6	32.9	37.2	37.1	33.6
TrpBetaine	0.509	0.526	0.503	0.481	0.45	0.493	0.568	0.493	0.497
CA	0.128	0.11	0.108	0.113	0.101	0.103	0.124	0.117	0.115
CDCA	0.251	0.272	0.23	0.383	0.219	0.257	0.151	0.16	0.246
DCA	0.355	0.365	0.311	0.376	0.309	0.53	0.218	0.245	0.343
GCA	0.224	0.242	0.227	0.222	0.197	0.22	0.237	0.227	0.221
GCDCA	0.693	0.689	0.706	0.662	0.608	0.717	0.57	0.612	0.661
GDCA	0.386	0.365	0.434	0.357	0.352	0.387	0.296	0.306	0.374
GLCA	0.021	0.023	0.021	0.022	0.02	0.022	0.023	0.023	0.022
GLCAS	0.295	0.3	0.279	0.188	0.307	0.258	0.358	0.221	0.328
GUDCA	0.147	0.168	0.157	0.15	0.152	0.142	0.159	0.15	0.162
TCA	0.028	0.027	0.023	0.029	0.024	0.025	0.026	0.029	0.027
TCDCA	0.084	0.093	0.075	0.088	0.072	0.08	0.09	0.081	0.081
TDCA	0.051	0.05	0.045	0.047	0.04	0.045	0.044	0.041	0.044
TLCA	0.002	0.003	0.003	0.001	NA	0.002	0.001	0.002	0.002
TMCA	NA	NA	NA	NA	NA	0.004	NA	NA	NA
beta-Ala	1.92	1.8	1.75	1.91	1.73	1.71	2.12	1.95	1.9
Dopamine	0.481	0.525	NA	NA	NA	NA	NA	NA	NA
GABA	0.12	0.128	0.135	0.129	0.129	0.123	0.141	0.147	0.139
Histamine	NA	NA	NA	NA	NA	NA	NA	NA	0.042
PEA	NA	NA	NA	NA	NA	NA	NA	NA	NA
Putrescine	0.122	0.087	0.063	NA	0.049	0.071	NA	NA	0.068
Serotonin	0.065	0.062	NA	NA	NA	0.027	NA	NA	NA
Spermidine	NA	NA	NA	NA	NA	NA	NA	NA	NA
Spermine	NA	NA	NA	NA	NA	NA	NA	NA	NA
AconAcid	2.08	1.22	2.2	1.68	1.78	2.29	2.16	1.75	1.43
DiCA(12:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DiCA(14:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
HipAcid	3.01	2.72	2.91	2.83	2.42	2.96	3.2	3	2.69
Lac	3440	3538	3444	3503	3183	3384	3882	3637	3322
OH-GlutAcid	NA	NA	NA	NA	NA	NA	NA	NA	NA
Suc	NA	NA	NA	NA	NA	NA	NA	NA	NA
Cer(d16:1/18:0)	0.058	0.071	0.035	NA	0.065	0.055	NA	NA	NA
Cer(d16:1/20:0)	0.057	0.048	0.079	0.029	0.029	0.039	NA	0.031	NA
Cer(d16:1/22:0)	0.22	0.2	0.3	0.292	0.169	0.134	0.136	0.303	0.181
Cer(d16:1/23:0)	0.076	0.079	0.081	0.041	0.039	0.103	NA	0.096	NA
Cer(d16:1/24:0)	0.147	0.101	0.108	0.139	0.125	0.087	0.097	0.118	0.118
Cer(d18:1/14:0)	NA	0.032	0.052	0.042	0.065	0.057	NA	NA	0.054
Cer(d18:1/16:0)	0.41	0.397	0.342	0.395	0.295	0.359	0.516	0.35	0.374
Cer(d18:1/18:0(OH))	0.34	NA	NA	NA	NA	0.19	NA	0.174	0.105
Cer(d18:1/18:0)	0.146	0.143	0.141	0.128	0.108	0.11	0.182	0.132	0.171
Cer(d18:1/18:1)	NA	NA	NA	0.024	NA	0.03	NA	NA	0.026
Cer(d18:1/20:0(OH))	0.455	0.405	0.216	0.297	0.276	0.371	NA	0.303	0.551
Cer(d18:1/20:0)	0.11	0.117	0.155	0.118	0.056	0.121	0.081	0.119	0.127
Cer(d18:1/22:0)	0.73	0.673	0.597	0.573	0.514	0.556	0.749	0.706	0.755
Cer(d18:1/23:0)	0.711	0.837	0.649	0.664	0.431	0.635	0.711	0.685	0.758
Cer(d18:1/24:0)	1.78	2.03	1.62	1.83	1.35	1.61	1.97	2.1	1.92
Cer(d18:1/24:1)	0.879	0.942	0.774	0.877	0.679	0.826	0.555	0.925	0.889
Cer(d18:1/25:0)	0.258	0.316	0.262	0.327	0.241	0.275	0.261	0.328	0.472
Cer(d18:1/26:0)	0.138	0.075	0.039	0.047	0.026	0.05	0.095	0.05	NA
Cer(d18:1/26:1)	0.01	0.025	0.039	0.026	0.012	0.01	NA	0.021	NA
Cer(d18:2/14:0)	NA	0.008	0.007	NA	NA	NA	NA	NA	NA
Cer(d18:2/16:0)	0.083	0.088	0.071	0.058	0.096	0.096	0.06	0.11	0.072
Cer(d18:2/18:0)	0.054	0.085	0.059	0.064	0.042	0.089	NA	0.048	0.041
Cer(d18:2/18:1)	NA	0.016	NA	NA	NA	NA	NA	0.022	0.015
Cer(d18:2/20:0)	0.063	0.039	0.063	0.04	0.069	0.066	0.054	0.037	0.076
Cer(d18:2/22:0)	0.173	0.203	0.159	0.263	0.147	0.254	0.102	0.177	0.156
Cer(d18:2/23:0)	0.091	0.102	0.077	0.076	0.077	0.098	0.077	0.086	0.075
Cer(d18:2/24:0)	0.356	0.386	0.383	0.294	0.312	0.339	0.338	0.409	0.403
Cer(d18:2/24:1)	0.158	0.155	0.154	0.227	0.071	0.108	0.203	0.14	0.144
CE(14:0)	12.7	14.6	11.8	14.3	8.69	7.09	30.8	8.12	4
CE(14:1)	0.208	0.2	0.144	0.154	0.19	0.176	NA	0.122	0.092
CE(15:0)	4.53	4.2	4.14	3.34	0.724	1.45	2.57	2.26	1.45
CE(15:1)	NA	NA	NA	0.682	0.175	0.752	NA	NA	NA
CE(16:0)	217	179	146	96.7	107	102	338	89.5	152
CE(16:1)	63.9	73.4	62.5	65.9	51.7	54.3	70.1	70.2	46.5
CE(17:0)	3.44	3.81	4.02	4.22	3.93	2.23	4.78	3	5.07
CE(17:1)	3.55	3.77	3.45	3.78	2.72	4.07	2.94	2.74	1.92
CE(18:0)	14.4	11.9	14.1	11.6	9.52	6.91	20.4	5.85	12.1
CE(18:1)	256	314	307	257	196	231	166	289	161
CE(18:2)	1045	1209	1172	1047	785	991	1020	1195	721
CE(18:3)	45.7	47.4	39.9	43.7	35.2	46.3	61	47.6	33.4
CE(20:0)	2.19	1.94	3.52	3.55	NA	15.3	5.24	5.35	NA
CE(20:1)	0.723	0.578	0.96	1.33	NA	3.05	2.03	1.33	0.916
CE(20:3)	20.8	25.8	18.3	20.4	14.1	18.4	16.9	22.4	11.1
CE(20:4)	195	225	220	197	162	180	136	219	126
CE(20:5)	31.1	34.8	35.1	29.4	25.4	29	27.6	33.1	22.9
CE(22:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
CE(22:1)	NA	NA	NA	NA	0.247	0.44	NA	NA	NA
CE(22:2)	0.085	0.102	0.181	0.216	0.085	0.362	NA	0.239	NA
CE(22:5)	2.62	2.21	2.97	2.71	1.98	2.87	1.72	1.83	1.32
CE(22:6)	21.3	23	24.8	20.3	16.8	21.3	28.8	18.8	12.8
p-Cresol-SO4	41.1	39	38.3	29.6	31.7	32.8	34.7	39.2	37.1
DG(14:0_14:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(14:0_18:1)	NA	NA	NA	NA	0.578	NA	NA	NA	NA
DG(14:0_18:2)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(14:0_20:0)	NA	NA	NA	NA	NA	0.035	NA	NA	NA
DG(14:1_18:1)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(14:1_20:2)	NA	NA	NA	NA	NA	NA	NA	NA	0.059
DG(16:0_16:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(16:0_16:1)	0.536	0.775	0.755	1.1	0.87	0.659	NA	0.407	0.483
DG(16:0_18:1)	3.34	3.81	3.54	3.75	2.36	2.95	4.99	3.26	3.21
DG(16:0_18:2)	2.2	2.69	2.38	2.34	1.54	1.94	3.58	2.18	2.16
DG(16:0_20:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(16:0_20:3)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(16:0_20:4)	NA	0.098	NA	NA	NA	NA	NA	NA	0.114
DG(16:1_18:0)	NA	0.109	NA	NA	0.042	0.037	NA	NA	NA
DG(16:1_18:1)	NA	NA	NA	NA	0.753	0.942	NA	NA	NA
DG(16:1_18:2)	0.801	1.07	0.717	0.708	0.621	0.654	NA	1.06	0.808
DG(16:1_20:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(17:0_17:1)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(17:0_18:1)	0.445	0.625	NA	0.398	0.453	0.554	NA	NA	NA
DG(18:0_20:0)	NA	NA	NA	NA	0.01	0.008	NA	NA	NA
DG(18:0_20:4)	NA	NA	NA	NA	0.07	NA	NA	NA	NA
DG(18:1_18:1)	2.7	2.65	2.82	2.63	1.7	2.48	3.96	2.9	2.68
DG(18:1_18:2)	6.62	7.28	6.22	6.88	4.1	6.92	9.73	7.5	6.15
DG(18:1_18:3)	0.366	0.29	NA	NA	0.229	0.216	NA	NA	NA
DG(18:1_18:4)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(18:1_20:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(18:1_20:1)	0.018	0.012	0.009	0.013	0.014	0.019	NA	0.015	NA
DG(18:1_20:2)	NA	NA	NA	NA	0.107	NA	NA	NA	NA
DG(18:1_20:3)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(18:1_20:4)	NA	NA	NA	NA	0.054	NA	NA	0.075	NA
DG(18:1_22:5)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(18:1_22:6)	NA	NA	0.081	NA	0.143	0.215	NA	NA	NA
DG(18:2_18:2)	4.18	4.23	3.49	3.7	3.28	4.21	4.29	3.49	4.28
DG(18:2_18:3)	0.423	NA	0.263	0.342	0.225	0.136	NA	0.312	0.213
DG(18:2_18:4)	NA	NA	NA	NA	NA	0.091	NA	NA	NA
DG(18:2_20:0)	NA	NA	NA	NA	NA	NA	NA	NA	0.079
DG(18:2_20:4)	0.139	0.156	NA	NA	0.165	NA	NA	NA	0.099
DG(18:3_18:3)	NA	NA	NA	NA	0.096	NA	NA	NA	0.106
DG(18:3_20:2)	NA	NA	NA	NA	NA	0.115	NA	NA	NA
DG(21:0_22:6)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG(22:1_22:2)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG-O(14:0_18:2)	NA	NA	NA	NA	NA	NA	NA	NA	NA
DG-O(16:0_18:1)	NA	NA	NA	NA	0.07	NA	NA	NA	NA
DG-O(16:0_20:4)	NA	0.01	NA	NA	NA	NA	NA	NA	NA
Cer(d18:0/18:0(OH))	NA	NA	NA	NA	0.277	NA	0.209	NA	NA
Cer(d18:0/18:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
Cer(d18:0/20:0)	NA	NA	NA	NA	NA	NA	NA	NA	0.115
Cer(d18:0/22:0)	NA	NA	0.15	NA	0.186	NA	NA	NA	NA
Cer(d18:0/24:0)	0.209	0.278	0.227	0.222	0.168	NA	NA	0.149	0.232
Cer(d18:0/24:1)	NA	0.148	0.16	0.184	0.199	NA	NA	NA	0.164
Cer(d18:0/26:1(OH))	NA	NA	NA	NA	0.141	0.351	NA	NA	NA
Cer(d18:0/26:1)	NA	NA	NA	NA	NA	NA	NA	NA	NA
AA	6.33	4.81	8.44	6.34	3.63	3.25	3.73	4.85	6.7
DHA	2.35	3.66	4.48	3.87	3.29	1.92	3.73	3.17	3.39
EPA	0.331	0.37	0.413	0.416	0.313	0.207	0.361	0.499	0.6
FA(12:0)	8.12	9.59	NA	NA	NA	NA	NA	NA	NA
FA(14:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
FA(16:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
FA(18:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
FA(18:1)	133	NA	167	NA	154	176	181	166	132
FA(18:2)	45	37.2	43.9	33.5	31	41.2	46.4	38.1	48.1
FA(20:1)	NA	NA	1.22	2.07	0.999	2.09	2	1.8	1.4
FA(20:2)	NA	1.27	1.38	1.4	1.26	1.78	0.971	1.48	1.36
FA(20:3)	0.747	0.665	0.81	0.578	0.434	0.69	1.07	1.08	0.743
lysoPC.a.C14:0	7.02	7.2	6.72	6.84	6.12	6.11	7.9	7.02	6.78
lysoPC.a.C16:0	102	99.4	117	100	86.4	88.9	100	108	106
lysoPC.a.C16:1	3.55	3.4	3.78	3.56	2.87	3.04	4.02	3.69	3.49
lysoPC.a.C17:0	1.61	1.59	2.06	1.6	1.45	1.47	4.38	1.71	1.81
lysoPC.a.C18:0	29.5	30.9	35.4	39.2	26.6	26.8	31.1	33.4	34.2
lysoPC.a.C18:1	22.6	21.5	26.7	25.9	18.8	18.8	18.7	23.9	22.1
lysoPC.a.C18:2	31.7	31.1	37.9	32.6	26.7	27	27	31.8	32.2
lysoPC.a.C20:3	1.99	2.08	2.33	2.25	1.87	1.88	NA	2.14	2.14
lysoPC.a.C20:4	6.95	6.96	7.39	7.62	6.09	5.98	6.28	7.75	6.95
lysoPC.a.C24:0	0.173	0.172	0.151	0.136	0.105	0.125	0.292	0.134	0.267
lysoPC.a.C26:0	0.23	0.179	0.219	0.222	0.187	0.17	0.364	0.082	0.308
lysoPC.a.C26:1	0.159	0.157	0.215	0.244	0.215	0.124	0.163	0.14	0.247
lysoPC.a.C28:0	NA	NA	NA	0.121	NA	NA	0.274	0.122	0.164
lysoPC.a.C28:1	0.254	0.256	0.296	0.331	0.288	0.292	0.288	0.252	0.439
PC.aa.C24:0	0.12	0.105	0.136	0.132	0.056	0.06	2.07	0.12	0.367
PC.aa.C26:0	NA	NA	NA	NA	NA	NA	0.832	NA	1.12
PC.aa.C28:1	2.11	2.2	2.02	2.11	1.94	2.03	6	2.1	2.27
PC.aa.C30:0	2.77	2.7	3.06	2.81	2.52	2.72	5.83	2.56	2.92
PC.aa.C30:2	0.001	0	0	0.001	0	0.001	0.003	0	0
PC.aa.C32:0	10.3	9.39	9.43	9.67	9.13	8.69	11.9	9.84	10.2
PC.aa.C32:1	14.2	14.3	13.5	12.7	13	12.2	13.5	13	14.1
PC.aa.C32:2	2.56	2.44	2.43	2.08	2.6	1.94	2.71	2.35	2.52
PC.aa.C32:3	0.593	0.566	0.552	0.583	0.547	0.476	1.17	0.539	0.566
PC.aa.C34:1	152	144	145	131	139	129	134	135	146
PC.aa.C34:2	285	279	263	251	260	257	253	282	299
PC.aa.C34:3	12.6	12.1	11.6	9.99	11.4	10.7	10.8	12	12.7
PC.aa.C34:4	1.32	1.24	1.2	1.2	1.25	1.11	1.38	1.2	1.25
PC.aa.C36:0	0.754	0.676	0.679	1.16	0.542	0.722	10.7	0.498	0.942
PC.aa.C36:1	32.9	31.3	38.8	30.8	28.3	29.7	34	30.9	31.5
PC.aa.C36:2	173	171	175	155	155	151	147	169	178
PC.aa.C36:3	103	102	106	106	95.5	89.5	90	105	104
PC.aa.C36:4	142	137	129	136	122	124	128	138	146
PC.aa.C36:5	11.1	10.5	10.4	10.3	9.6	9.18	9.98	10.5	10.9
PC.aa.C36:6	0.449	0.402	0.364	0.351	0.397	0.339	1.56	0.381	0.374
PC.aa.C38:0	1.5	1.48	1.51	1.43	1.43	1.39	9.38	1.46	1.56
PC.aa.C38:1	0.431	0.156	0.391	0.19	0.047	0.047	3.23	0.05	0.088
PC.aa.C38:3	33.7	29.8	37	28.6	29.1	28.2	31.6	29.4	32.9
PC.aa.C38:4	83.1	76.2	87.7	74.2	72	71.2	79.5	75.1	80.9
PC.aa.C38:5	37.2	38.3	40.5	37.2	32.6	34	35.7	36.9	37.4
PC.aa.C38:6	34.4	34.5	36.1	35.5	30.9	30.4	35.7	36	35.6
PC.aa.C40:1	NA	NA	NA	NA	NA	NA	2.4	NA	NA
PC.aa.C40:2	0.208	0.208	0.231	0.139	0.181	0.182	2.55	0.157	0.209
PC.aa.C40:3	0.335	0.304	0.327	0.3	0.307	0.276	2.11	0.246	0.356
PC.aa.C40:4	2.77	2.72	2.79	2.55	2.35	2.6	3.91	2.69	2.98
PC.aa.C40:5	6.51	6.19	5.8	5.44	5.81	5.49	7.63	6.17	6.63
PC.aa.C40:6	12.3	11.8	11.9	11.5	10.9	10.3	16.2	12.5	12.7
PC.aa.C42:0	0.339	0.312	0.328	0.278	0.253	0.306	0.412	0.309	0.415
PC.aa.C42:1	0.205	0.165	0.151	0.151	0.141	0.195	0.422	0.186	0.263
PC.aa.C42:2	0.155	0.149	0.156	0.122	0.13	0.138	0.871	0.132	0.168
PC.aa.C42:4	0.126	0.139	0.114	0.127	0.115	0.134	1.01	0.1	0.143
PC.aa.C42:5	0.184	0.183	0.182	0.163	0.16	0.176	1.2	0.201	0.252
PC.aa.C42:6	0.269	0.238	0.262	0.256	0.243	0.239	NA	0.213	0.25
PC.ae.C30:0	0.204	0.229	0.216	0.206	0.213	0.176	0.209	0.218	0.242
PC.ae.C30:1	0.139	0.08	0.083	0.216	0.182	0.146	0.177	0.136	0.367
PC.ae.C30:2	0.053	0.081	0.078	0.079	0.076	0.077	0.071	0.061	0.101
PC.ae.C32:1	2.11	1.87	2.03	2.11	1.79	1.69	3.2	1.98	2.26
PC.ae.C32:2	0.615	0.551	0.635	0.603	0.506	0.481	1.7	0.508	0.671
PC.ae.C34:0	0.982	0.903	0.948	0.897	0.926	0.832	3.53	0.852	0.944
PC.ae.C34:1	6.23	6.1	5.86	5.97	6.01	5.52	6.5	5.77	6.4
PC.ae.C34:2	7.6	7.61	7.43	7.55	6.99	6.93	7.12	7.26	8.32
PC.ae.C34:3	5.85	5.4	5.53	5.38	5.39	4.98	5.62	5.56	5.9
PC.ae.C36:0	0.534	0.624	0.6	0.784	0.66	0.621	14.9	0.569	1.08
PC.ae.C36:1	4.71	4.57	4.55	4.18	4.14	4.18	20	4.34	5.7
PC.ae.C36:2	8.55	8.61	7.95	7.63	7.31	7.76	9	7.89	8.73
PC.ae.C36:3	5.56	5.32	5.06	5.11	4.82	4.82	5.51	5.18	5.67
PC.ae.C36:4	13.3	12.7	12.2	12.5	11.7	11.4	11.5	13.1	13.1
PC.ae.C36:5	8.51	8.02	8.24	7.35	7.3	7.21	8.75	7.79	8.08
PC.ae.C38:0	1.06	0.97	1.07	1.01	0.95	0.958	7.07	0.997	1.12
PC.ae.C38:1	0.325	0.225	0.336	0.451	0.104	0.402	10.8	0.25	0.912
PC.ae.C38:2	1.22	1.18	1.3	1.18	1.26	1.21	7.94	1.27	1.78
PC.ae.C38:3	2.61	2.71	2.8	2.64	2.35	2.47	8.06	2.69	3.36
PC.ae.C38:4	9.63	8.79	9.92	8.26	8.14	7.68	8.99	8.32	9.5
PC.ae.C38:5	13	12.8	14.8	12.7	11.7	11.1	12.1	13	13.6
PC.ae.C38:6	4.41	4.52	4.96	4.75	4.28	4.13	6.43	4.41	4.93
PC.ae.C40:1	0.786	0.841	0.647	0.677	0.724	0.688	4.06	0.689	0.674
PC.ae.C40:2	1.09	1	1.01	1.12	0.907	0.889	3.79	1.03	1.15
PC.ae.C40:3	0.829	0.828	0.86	1.15	0.715	0.839	5.37	0.996	1.56
PC.ae.C40:4	1.78	1.6	1.58	1.97	1.5	1.67	3.87	1.78	2.22
PC.ae.C40:5	2.68	2.56	2.57	2.59	2.19	2.22	6.11	2.69	2.94
PC.ae.C40:6	2.41	2.29	2.36	2.38	2.03	1.96	4.88	2.45	2.51
PC.ae.C42:0	NA	NA	NA	NA	NA	NA	NA	NA	NA
PC.ae.C42:1	0.292	0.265	0.293	0.272	0.266	0.257	0.313	0.28	0.337
PC.ae.C42:2	0.346	0.296	0.339	0.307	0.309	0.318	1.24	0.312	0.403
PC.ae.C42:3	0.494	0.475	0.437	0.438	0.436	0.416	1.54	0.474	0.638
PC.ae.C42:4	0.629	0.555	0.604	0.6	0.558	0.666	1.88	0.635	0.753
PC.ae.C42:5	1.51	1.51	1.45	1.34	1.32	1.53	3.37	1.57	1.75
PC.ae.C44:3	0.102	0.122	0.108	0.091	0.087	0.085	0.111	0.088	0.152
PC.ae.C44:4	0.254	0.232	0.172	0.25	0.212	0.267	0.913	0.185	0.273
PC.ae.C44:5	1.04	0.91	0.925	0.797	0.793	0.817	2.39	0.999	0.967
PC.ae.C44:6	0.806	0.798	0.779	0.646	0.727	0.785	0.777	0.788	0.997
Hex2Cer(d18:1/14:0)	0.169	0.251	0.208	0.206	0.12	0.314	0.186	0.22	0.207
Hex2Cer(d18:1/16:0)	2.28	2.81	2.29	2.4	2.18	2.3	3.29	2.4	2.36
Hex2Cer(d18:1/18:0)	0.161	0.145	0.138	0.155	0.149	0.165	0.232	0.155	0.192
Hex2Cer(d18:1/20:0)	0.068	0.122	0.113	0.074	0.085	0.111	0.066	0.095	0.103
Hex2Cer(d18:1/22:0)	0.239	0.209	0.153	0.191	0.165	0.192	0.139	0.096	0.133
Hex2Cer(d18:1/24:0)	0.176	0.168	0.203	0.149	0.153	0.18	0.385	0.155	0.222
Hex2Cer(d18:1/24:1)	0.337	0.429	0.347	0.399	0.239	0.31	0.284	0.402	0.299
Hex2Cer(d18:1/26:0)	0.004	0.007	NA	NA	0.013	NA	NA	NA	NA
Hex2Cer(d18:1/26:1)	0.008	0.009	0.002	NA	NA	0.012	NA	0.003	0.006
Hex3Cer(d18:1/16:0)	1.34	1.17	1.23	1.38	1.03	1.15	2.25	1.2	1.29
Hex3Cer(d18:1/18:0)	0.092	0.12	0.08	0.05	0.098	0.15	0.106	0.196	0.222
Hex3Cer(d18:1/24:1)	0.571	0.591	0.621	0.483	0.371	0.427	1.07	0.426	0.513
Hex3Cer(d18:1/26:1)	0.043	NA	0.055	NA	NA	NA	NA	0.508	NA
Hex3Cer(d18:1_20:0)	0.01	0.007	0.004	0.01	0.007	0.015	NA	0.004	0.009
Hex3Cer(d18:1_22:0)	0.126	0.164	0.144	0.101	0.181	0.135	NA	0.15	0.116
HexCer(d16:1/22:0)	0.026	0.031	0.022	0.031	0.015	0.022	0.017	0.029	0.025
HexCer(d16:1/24:0)	0.026	0.026	0.024	0.015	0.016	0.026	0.023	0.015	0.027
HexCer(d18:1/14:0)	NA	NA	NA	0.02	0.019	NA	NA	0.096	NA
HexCer(d18:1/16:0)	0.884	0.953	0.854	0.947	0.87	0.926	1.96	1.03	0.73
HexCer(d18:1/18:0)	0.138	0.14	0.118	0.196	0.135	0.181	0.237	0.23	0.154
HexCer(d18:1/18:1)	0.067	0.081	0.057	0.084	0.051	NA	NA	NA	NA
HexCer(d18:1/20:0)	0.223	0.276	0.208	0.257	0.154	0.278	NA	0.29	0.184
HexCer(d18:1/22:0)	2.42	2.61	2.33	2.48	2.1	2.4	6.11	2.52	2.67
HexCer(d18:1/23:0)	1.05	1.17	1.2	0.866	1.01	1.15	2.42	1.34	1.17
HexCer(d18:1/24:0)	1.25	1.31	1.33	1.13	1.1	1.33	1.62	1.25	1.65
HexCer(d18:1/24:1)	2.9	3.4	2.95	2.34	2.55	3.29	4.75	3.14	3.23
HexCer(d18:1/26:0)	0.059	0.063	0.05	0.043	0.051	0.045	NA	0.088	0.03
HexCer(d18:1/26:1)	0.065	0.097	0.094	NA	0.05	NA	0.489	0.043	0.109
HexCer(d18:2/16:0)	0.012	NA	0.011	NA	NA	0.01	NA	0.012	0.011
HexCer(d18:2/18:0)	0.011	0.02	NA	0.025	NA	0.035	NA	0.031	NA
HexCer(d18:2/20:0)	0.01	0.016	0.011	0.014	0.011	0.007	NA	0.006	0.033
HexCer(d18:2/22:0)	0.365	0.618	0.393	0.362	0.293	0.373	0.856	0.447	0.432
HexCer(d18:2/23:0)	0.207	0.191	0.242	0.152	0.195	0.2	0.19	0.253	0.224
HexCer(d18:2/24:0)	0.561	0.565	0.578	0.567	0.504	0.608	0.367	0.674	0.42
AbsAcid	NA	NA	0.019	0.022	NA	0.023	NA	NA	NA
Cortisol	0.211	0.189	0.166	0.189	0.146	0.173	0.206	0.179	0.172
Cortisone	NA	0.053	NA	NA	NA	NA	NA	NA	NA
DHEAS	2.43	2.42	2.26	2.47	2.16	2.15	2.66	2.56	2.42
3-IAA	1.98	2.05	1.84	1.88	1.75	1.69	2.07	1.8	2
3-IPA	0.433	0.433	0.438	0.407	0.413	0.388	0.465	0.454	0.426
Ind-SO4	3.66	4.77	4.15	8.16	4.22	4.21	3.51	4.73	4.44
Indole	NA	NA	NA	NA	NA	NA	NA	NA	NA
Hypoxanthine	2.58	3.63	3.36	3.72	3.91	3.63	4.64	4.52	4.26
Xanthine	0.443	0.481	0.456	0.479	0.396	0.429	0.529	0.489	0.42
SM.(OH).C14:1	3.14	3.3	3.2	3.21	2.97	2.91	3.9	3.29	3.2
SM.(OH).C16:1	1.92	1.93	1.79	2.02	1.64	1.69	3.92	1.91	1.77
SM.(OH).C22:1	7.13	6.85	6.66	6.48	6.01	6.7	9.2	6.75	6.95
SM.(OH).C22:2	4.81	4.93	4.87	4.34	4.14	4.78	5.16	4.73	5.1
SM.(OH).C24:1	0.639	0.634	0.588	0.622	0.453	0.581	3.18	0.551	0.707
SM.C16:0	72.9	75.4	79.4	75.7	64.3	69.4	91	73.4	72.4
SM.C16:1	10.3	10.4	10.6	10.8	9.28	9.31	12.2	10.2	10.5
SM.C18:0	13.7	13.6	12.2	14.2	12.2	12.8	15.6	13.6	13.8
SM.C18:1	7.6	7	7.1	7.39	6.36	7.07	8.3	7.44	7.33
SM.C20:2	0.309	0.321	0.284	0.327	0.266	0.373	0.423	0.389	0.31
SM.C22:3	NA	NA	0.009	0.025	0.074	0.046	0.196	0.001	NA
SM.C24:0	12.7	11.9	11.7	13.2	10.4	12.1	15.3	12.2	12.8
SM.C24:1	24.1	26.4	25.7	25.5	21.1	23.9	30.2	24.5	23.8
SM.C26:0	0.077	0.088	0.055	0.12	0.063	0.081	0.18	0.083	0.105
SM.C26:1	0.174	0.189	0.17	0.155	0.141	0.192	0.319	0.211	0.198
H1	4246	4178	4391	4030	3359	3217	4755	4457	4160
TG(14:0_32:2)	1.97	2.09	2.71	1.29	1.61	1.38	0.946	1.56	1.38
TG(14:0_34:0)	2.76	3	3.38	3.19	2.88	2.05	3.72	2.8	2.15
TG(14:0_34:1)	15.9	19.3	24.9	17	14.1	14.3	14.4	15.7	13.3
TG(14:0_34:2)	10.3	11.7	18.7	13.3	10.1	10.7	15.1	12	11.6
TG(14:0_34:3)	2.37	2.82	3.87	2.73	2.34	2.58	2.97	2.75	1.56
TG(14:0_35:1)	0.399	0.559	0.354	0.315	NA	0.295	NA	0.407	0.547
TG(14:0_35:2)	0.6	0.608	0.564	NA	0.754	0.306	NA	NA	0.485
TG(14:0_36:1)	3.26	3.91	4.43	3.91	2.74	2.64	2.54	3.12	3.5
TG(14:0_36:2)	13.3	15.1	24.4	13.5	12.4	13.3	18.1	14.9	13.7
TG(14:0_36:3)	14	14.6	18.2	14.8	12.2	13.3	22.9	13.9	11.8
TG(14:0_36:4)	4.9	5.54	5.74	4.84	4.16	4.44	9.2	5.06	4.45
TG(14:0_38:4)	0.606	0.543	0.609	0.63	0.375	0.547	0.423	0.36	0.359
TG(14:0_38:5)	0.687	0.545	0.643	0.439	0.389	0.516	0.357	0.444	0.386
TG(14:0_39:3)	0.025	NA	NA	NA	0.013	NA	NA	NA	NA
TG(16:0_28:1)	1.78	1.71	3.06	1.77	1.41	1.8	1.08	1.66	0.57
TG(16:0_28:2)	0.707	0.767	0.925	0.827	0.506	0.764	0.355	0.702	0.918
TG(16:0_30:2)	2.28	2.27	3.55	2.14	1.73	1.66	2.23	1.98	1.35
TG(16:0_32:0)	24.4	25.2	29	24.9	22.1	22.5	22.6	20.5	13.5
TG(16:0_32:1)	38.8	38.7	47.9	38.8	34.5	31.5	59.3	38.7	27.5
TG(16:0_32:2)	15.6	16.3	20.1	18.6	14.2	14	24.8	16.7	13.3
TG(16:0_32:3)	2.38	2.34	3.19	2.46	1.89	2.27	2.77	2.59	2.04
TG(16:0_33:1)	3.27	3.82	3.95	3.32	3.03	3.35	3.39	2.82	3.52
TG(16:0_33:2)	1.79	2.18	2.73	2.23	1.71	1.9	2.08	1.12	1.6
TG(16:0_34:0)	17.2	21.6	23.9	18.4	16	17.8	23.4	18.3	9.26
TG(16:0_34:1)	116	131	171	121	101	111	207	114	89.6
TG(16:0_34:2)	108	117	161	107	105	102	185	113	86.9
TG(16:0_34:3)	29.7	34.4	42.3	30.9	26.1	26.6	37.4	35.3	28.3
TG(16:0_34:4)	2.72	3.27	3.21	3.08	3.04	2.46	2.72	2.63	2.95
TG(16:0_35:1)	2.69	3.49	4.07	2.77	2.72	3.27	4.39	1.93	2.2
TG(16:0_35:2)	4.22	4.78	5.92	3.96	4.24	4.25	6.28	3.86	3.44
TG(16:0_35:3)	1.84	2.13	2.55	1.67	1.76	2	2.58	1.63	1.85
TG(16:0_36:2)	182	208	263	189	159	163	205	182	163
TG(16:0_36:3)	185	209	274	195	174	174	326	217	170
TG(16:0_36:4)	74.3	75.1	82.6	70.4	59.6	64.1	126	79.2	66.2
TG(16:0_36:5)	8.48	8.76	9.01	8.08	7.45	7.85	14.9	8.69	7.6
TG(16:0_36:6)	0.951	0.858	1.07	0.671	0.558	0.705	0.928	0.895	0.896
TG(16:0_37:3)	0.433	0.497	0.964	0.375	0.422	0.831	0.4	0.54	0.375
TG(16:0_38:1)	0.619	0.701	0.998	0.84	0.515	1.45	0.297	0.706	0.426
TG(16:0_38:2)	2.27	2.05	2.33	2.44	1.83	2.51	1.98	1.78	1.76
TG(16:0_38:3)	4.13	4.34	5.38	3.58	3.8	3.47	4.18	3.1	3.87
TG(16:0_38:4)	5.23	5.82	7.97	5.37	4.89	4.91	6.29	5.65	4.13
TG(16:0_38:5)	5.6	6.71	8.01	6.26	4.2	5.61	7.46	6.13	4.19
TG(16:0_38:6)	3.06	3.25	3.65	3	2.59	2.74	8.47	3.15	2.44
TG(16:0_38:7)	0.537	0.698	0.573	0.592	0.307	0.387	1.16	0.509	0.328
TG(16:0_40:6)	3.05	3.02	3.26	2.72	2.08	2.25	3.28	2.66	2.35
TG(16:0_40:7)	2.06	2.3	2.21	2.27	1.59	2.07	1.29	1.65	1.6
TG(16:0_40:8)	0.723	0.777	0.918	0.798	0.484	0.56	0.44	0.554	0.68
TG(16:1_28:0)	0.608	0.606	0.738	0.528	1.01	0.584	0.608	0.452	0.396
TG(16:1_30:1)	1.66	1.99	2.09	1.24	1.6	1.82	1.12	1.54	0.648
TG(16:1_32:0)	9.32	9.8	12.6	9.81	8.83	8.7	13.1	9.06	7.03
TG(16:1_32:1)	12.4	12.6	16	11.8	11.4	11.4	12.5	11.8	8.97
TG(16:1_32:2)	3.5	3.52	4.04	3.29	2.65	3.15	1.34	3.11	3.17
TG(16:1_33:1)	1.13	1.42	1.11	1.2	0.969	0.942	NA	0.471	NA
TG(16:1_34:0)	7.21	6.46	8.91	6.8	5.54	6.15	4.45	7.58	5.7
TG(16:1_34:1)	45.3	50.1	65.8	44.4	43.5	47	46.8	48.8	42.1
TG(16:1_34:2)	28.4	33.1	41.8	29.4	25.2	27.7	27.9	31.6	28
TG(16:1_34:3)	6.37	6.19	7.55	5.53	5.07	5.39	8.08	5.93	5.07
TG(16:1_36:1)	5.29	5.59	6.93	4.63	4.45	5.53	7.48	5.23	4.51
TG(16:1_36:2)	25.2	28.7	39.3	24.3	24	22.2	35	27.7	24.6
TG(16:1_36:3)	23.9	26.1	34.3	23.7	21.5	22.1	29.5	26.6	22.2
TG(16:1_36:4)	8.49	9.22	12	8.73	8.09	7.29	11.4	9.3	9.17
TG(16:1_36:5)	1.51	1.43	2	1.33	1.19	0.893	2.03	1.44	1.3
TG(16:1_38:3)	0.56	0.685	1.26	0.823	0.689	0.619	0.787	0.679	0.573
TG(16:1_38:4)	1.05	0.899	1.19	0.932	1.09	0.745	1.45	1.12	1.06
TG(16:1_38:5)	1.12	1.16	1.4	1	0.883	0.812	1.47	1.23	0.931
TG(17:0_32:1)	0.853	0.911	1	0.743	0.464	0.804	0.349	0.39	0.588
TG(17:0_34:1)	2.58	2.97	3.13	2.27	2.63	2.07	4.31	3.19	1.39
TG(17:0_34:2)	2	2.24	2.75	2.01	1.65	2.05	2.9	2.4	1.65
TG(17:0_34:3)	0.553	0.496	0.643	0.495	0.338	0.676	0.47	0.334	0.519
TG(17:0_36:3)	2.57	3.36	3.9	2.71	2.2	2.29	4.6	3.26	2.71
TG(17:0_36:4)	1.33	1.18	1.59	1.26	0.97	0.997	1.28	1.1	0.83
TG(17:1_32:1)	0.833	1.13	0.724	0.786	0.59	0.662	NA	1.02	0.45
TG(17:1_34:1)	3.53	3.88	4.71	2.64	2.84	3.01	2.01	2.45	2.68
TG(17:1_34:2)	1.94	2.42	3	2.39	2.41	1.97	2.24	2.06	2.24
TG(17:1_34:3)	0.658	0.642	0.582	0.576	0.548	0.665	0.427	0.391	0.563
TG(17:1_36:3)	1.54	1.76	2.24	1.81	1.03	1.28	3.19	1.81	1.41
TG(17:1_36:4)	0.614	0.551	0.897	0.859	0.652	0.699	0.682	0.935	0.693
TG(17:1_36:5)	0.176	0.196	0.255	0.236	0.095	0.379	NA	NA	0.14
TG(17:1_38:5)	0.007	0.007	0.005	NA	0.012	0.007	NA	0.007	0.009
TG(17:1_38:6)	0.01	0.019	0.015	0.014	0.012	0.01	NA	NA	0.012
TG(17:1_38:7)	0.03	NA	NA	0.034	0.033	NA	NA	NA	0.026
TG(17:2_34:2)	0.298	0.487	NA	0.396	0.326	0.303	NA	0.248	NA
TG(17:2_34:3)	0.149	0.187	0.225	0.27	0.497	0.311	0.598	NA	0.168
TG(17:2_36:2)	0.23	0.439	0.407	0.256	NA	0.317	NA	0.262	0.466
TG(17:2_36:3)	0.23	0.262	0.436	0.401	0.361	0.313	NA	0.474	NA
TG(17:2_36:4)	0.522	0.386	0.574	0.32	0.438	0.562	0.513	0.483	0.23
TG(17:2_38:5)	0.191	0.193	0.142	0.195	0.113	0.166	NA	0.238	NA
TG(17:2_38:6)	NA	0.389	0.242	NA	0.138	0.268	NA	NA	NA
TG(17:2_38:7)	0.071	NA	0.075	NA	0.027	0.066	NA	NA	0.059
TG(18:0_30:0)	1.42	1.44	3.24	2.02	1.3	1.22	1	1.47	0.824
TG(18:0_30:1)	1.04	0.814	1.18	1.1	1.35	0.727	0.336	0.966	0.83
TG(18:0_32:0)	4.84	5.32	4.77	3.87	4.46	4.23	3.47	5.15	3.36
TG(18:0_32:1)	5.02	4.82	5.71	5.43	5.08	5.36	2.43	6.15	3.86
TG(18:0_32:2)	1.68	1.85	2.18	2.13	1.44	1.75	2.37	1.84	1.6
TG(18:0_34:2)	13.6	14.3	18.7	13.4	10.2	12.1	17.8	13.3	11
TG(18:0_34:3)	2.43	2.7	4.16	2.75	2.32	2.84	3.64	2.68	2.2
TG(18:0_36:1)	3.76	3.97	5.07	2.97	3.32	2.28	6.31	3.23	1.56
TG(18:0_36:2)	13.8	17.3	18.5	14.8	13.1	14.5	17	13.3	10.5
TG(18:0_36:3)	16.2	16.5	21.7	15.9	13.4	13.7	22.3	16.6	13.2
TG(18:0_36:4)	6.8	8.09	10.6	7.43	5.82	6.83	7.38	8.45	6.41
TG(18:0_36:5)	1.13	1.14	1.77	0.956	0.94	0.727	1.46	0.794	0.912
TG(18:0_38:6)	1.02	1.16	1.58	1.03	1.18	0.941	0.967	1.1	0.711
TG(18:0_38:7)	0.209	0.323	0.204	0.17	0.61	0.381	NA	NA	0.297
TG(18:1_26:0)	1.19	1.46	1.35	1.35	1.43	1.25	0.896	1.17	0.908
TG(18:1_28:1)	1.61	1.92	2.14	2.03	1.93	1.77	1.51	1.64	1.15
TG(18:1_30:0)	20.2	21.9	28.3	21.4	18.7	17.5	33.5	19	16.9
TG(18:1_30:1)	10.6	11.9	16.5	13.1	10.4	10.2	15.9	9.75	10.5
TG(18:1_30:2)	2.61	2.24	2.86	2.46	1.84	2.8	2.52	2.21	2.25
TG(18:1_31:0)	2.41	2.68	2.71	2.49	2.37	1.59	NA	1.96	2.07
TG(18:1_32:0)	67.5	74.6	97.7	63.8	60.7	64.3	115	68.2	57.3
TG(18:1_32:1)	79.6	83.1	120	72.4	69	78.8	138	82	67
TG(18:1_32:2)	20.8	21.6	27.4	17.1	18.8	18.9	29.7	21.4	19.7
TG(18:1_32:3)	2.52	2.35	2.98	2.17	2.07	2.5	3.17	2.4	2.05
TG(18:1_33:0)	2.99	2.97	3.4	2.76	2.72	2.45	2.99	3.37	2.24
TG(18:1_33:1)	7.59	8.36	11.7	6.85	6.05	8.51	8.25	7.39	6.33
TG(18:1_33:2)	2.88	3.11	3.74	2.81	2.04	2.7	2.82	2.72	2.33
TG(18:1_33:3)	0.512	0.45	0.524	0.398	0.404	0.56	0.328	0.321	0.426
TG(18:1_34:1)	317	349	447	294	270	306	454	305	257
TG(18:1_34:2)	204	228	268	190	183	201	296	218	187
TG(18:1_34:3)	33.6	36.1	43.3	32.7	29.5	36.1	36.2	34.9	26.4
TG(18:1_34:4)	3.09	3.5	3.42	3.41	3.04	2.44	3.27	3.49	2.72
TG(18:1_35:2)	4.91	5.37	5.95	4.5	3.89	4.43	7.98	3.57	4.15
TG(18:1_35:3)	1.37	1.49	1.79	1.39	1.48	1.51	1.47	1.27	1.46
TG(18:1_36:0)	3.85	3.82	4.15	3.72	3.07	3.57	3.43	3.32	2.83
TG(18:1_36:1)	34.1	36.5	32.6	28.1	25.7	32.9	45.8	31.1	24
TG(18:1_36:2)	110	115	183	95.6	84.7	86.7	128	112	88
TG(18:1_36:3)	103	104	122	93.3	86.7	85.4	114	99.7	85.2
TG(18:1_36:4)	35.1	37.3	48.8	33.5	27.6	29.6	35.3	39.2	27.1
TG(18:1_36:5)	6.87	6.29	9.15	5.8	4.97	6.09	8.74	6.76	5.55
TG(18:1_36:6)	0.704	0.687	1	0.785	0.506	0.556	0.643	0.814	0.386
TG(18:1_38:5)	5.48	6.51	7.17	4.87	5.06	4.66	6.46	5.94	3.82
TG(18:1_38:6)	2.65	2.68	2.93	2.67	1.75	2.54	2.79	2.34	2.28
TG(18:1_38:7)	0.798	0.732	0.636	0.657	0.779	0.954	0.399	0.711	0.231
TG(18:2_28:0)	1.91	2.32	2.62	2.31	1.75	1.27	1.07	2.15	1.85
TG(18:2_30:0)	10.1	10.3	13.1	11.4	8.02	8.76	12.7	10.3	8.1
TG(18:2_30:1)	5.11	5.23	7.49	5.7	4.42	5.83	4.6	5.31	4.77
TG(18:2_31:0)	NA	0.753	0.935	NA	NA	NA	NA	0.974	NA
TG(18:2_32:0)	42	39	51.9	36.9	34.9	40.8	48.3	40.3	32.8
TG(18:2_32:1)	39.7	41.4	47.9	39.4	32.5	42.8	46.5	43.2	35
TG(18:2_32:2)	10.3	10.5	13.1	10.5	8.64	9.62	10.7	11.2	8.92
TG(18:2_33:0)	1.55	2.02	2.46	2.1	1.52	1.99	1.33	2.13	1.39
TG(18:2_33:1)	4.09	4.21	4.1	4.71	3.46	4.09	4.98	3.49	3.58
TG(18:2_33:2)	1.49	1.55	1.8	2.05	1.48	1.65	1.66	1.55	1.68
TG(18:2_34:0)	25.1	25.7	30.5	25.5	20.1	24.9	28.8	25.9	19.8
TG(18:2_34:1)	190	194	238	202	147	177	195	192	154
TG(18:2_34:2)	117	121	154	123	101	111	140	123	103
TG(18:2_34:3)	18.2	18.7	21.3	19.3	15	16.2	16.6	19.3	15.1
TG(18:2_34:4)	1.96	1.71	1.92	1.43	1.44	1.86	1.13	1.73	1.66
TG(18:2_35:1)	3.26	3.17	4.2	3.09	2.39	3.51	4.93	3.24	2.21
TG(18:2_35:2)	2.48	2.78	3.91	2.74	2.28	2.53	3.55	2.49	2.03
TG(18:2_35:3)	0.978	1.03	1.3	0.989	0.529	0.887	0.822	0.911	0.587
TG(18:2_36:0)	2.45	2.49	2.41	2.25	2.02	1.88	3.21	2.38	2.14
TG(18:2_36:1)	18	20.3	20.9	17.2	16.1	16.4	20.6	20.3	16
TG(18:2_36:2)	58	60.8	76.5	49.5	45.7	51.4	72.2	63.4	46.7
TG(18:2_36:3)	47.5	49.4	66.8	41.7	38.6	41.9	58.3	55.8	40.5
TG(18:2_36:4)	19.3	19.3	24.5	17.6	15.7	16.8	32.5	21.5	16.6
TG(18:2_36:5)	3.11	3.46	3.61	2.76	2.42	3.25	5.89	3.68	3.35
TG(18:2_38:4)	3.01	2.93	3.13	2.56	2.39	2.2	2.52	3.12	2.37
TG(18:2_38:5)	3.34	3.49	3.86	3.02	2.7	2.53	3.5	3.47	3.32
TG(18:2_38:6)	1.5	1.55	1.61	1.4	1.33	0.939	1.59	1.59	1.38
TG(18:3_30:0)	1.32	1.13	1.83	1.22	0.872	0.799	NA	0.993	1.18
TG(18:3_32:0)	3.88	4.44	5.01	4.41	3.66	3.51	5.32	3.81	3.52
TG(18:3_32:1)	4.5	4.1	5.62	4.99	3.76	3.81	7.21	4.36	3.77
TG(18:3_33:2)	0.072	0.078	0.083	0.093	0.066	0.096	0.052	0.063	0.08
TG(18:3_34:0)	2.81	2.68	3.49	2.37	2.44	2.28	NA	1.9	2
TG(18:3_34:1)	19.6	19.2	24.3	18.5	17.4	17.5	27.1	19.9	16.7
TG(18:3_34:2)	12	12	14.3	11.9	9.3	10.8	14.2	11.4	10.7
TG(18:3_34:3)	1.76	2.28	2.23	1.6	1.83	1.67	1.99	2.06	1.96
TG(18:3_35:2)	0.367	0.507	0.532	0.368	0.226	0.405	NA	0.516	0.377
TG(18:3_36:1)	1.9	2.26	3.26	2.11	1.51	1.86	4.04	2.07	1.58
TG(18:3_36:2)	7.07	7.55	10.4	6.57	6.2	6.51	8.54	7.64	6.01
TG(18:3_36:3)	6.19	7.06	8.73	6.85	4.85	5.47	6.26	7.08	4.86
TG(18:3_36:4)	2.46	2.46	2.76	2.32	1.92	2.03	2.81	2.82	1.85
TG(18:3_38:5)	0.561	0.574	0.41	0.57	0.406	0.338	0.455	NA	0.577
TG(18:3_38:6)	0.249	0.323	0.356	0.238	0.212	0.229	NA	NA	0.216
TG(20:0_32:3)	0.543	0.376	0.652	0.39	0.633	0.402	0.786	0.336	0.597
TG(20:0_32:4)	0.446	0.492	0.398	0.6	0.527	0.48	0.42	0.578	0.434
TG(20:0_34:1)	NA	NA	0.319	NA	0.896	3.52	NA	NA	NA
TG(20:1_24:3)	NA	NA	NA	NA	NA	NA	NA	NA	NA
TG(20:1_26:1)	NA	NA	NA	NA	NA	NA	NA	NA	NA
TG(20:1_30:1)	0.213	0.195	0.211	NA	0.131	0.16	0.267	NA	0.127
TG(20:1_31:0)	NA	NA	NA	NA	NA	NA	NA	NA	NA
TG(20:1_32:1)	0.649	0.963	0.768	0.658	0.629	0.975	0.64	0.536	0.496
TG(20:1_32:2)	0.429	0.403	0.45	0.358	0.277	0.362	NA	NA	NA
TG(20:1_32:3)	0.269	0.299	0.163	NA	0.128	0.199	0.267	NA	0.214
TG(20:1_34:0)	0.286	0.341	0.328	0.235	0.294	0.365	NA	0.277	0.224
TG(20:1_34:1)	2.16	1.87	3.36	1.92	1.62	1.95	3.49	1.75	1.38
TG(20:1_34:2)	1.71	1.8	1.92	1.45	1.04	0.962	2.75	1.31	1.04
TG(20:1_34:3)	0.293	0.319	0.233	0.396	0.294	0.244	NA	NA	0.253
TG(20:2_32:0)	0.701	0.733	0.721	0.666	0.564	0.678	0.79	0.764	0.614
TG(20:2_32:1)	0.901	1.19	1.96	0.868	0.677	0.791	1.08	0.87	0.916
TG(20:2_34:1)	2.94	2.94	3.33	2.35	2.16	2.41	2.72	2.14	2
TG(20:2_34:2)	2.06	2.12	1.95	1.48	1.88	1.82	1.95	1.91	1.55
TG(20:2_34:3)	0.397	0.558	0.657	0.461	0.551	0.383	NA	NA	0.255
TG(20:2_34:4)	0.032	0.074	NA	NA	NA	0.085	NA	NA	0.025
TG(20:2_36:5)	0.077	0.113	0.098	NA	0.093	0.071	0.073	0.073	0.065
TG(20:3_32:0)	1.14	1.1	1.37	1.15	1.32	1.28	1.07	1.2	1.13
TG(20:3_32:1)	1.51	1.45	1.43	2.18	1.26	1.33	0.779	1.18	1.23
TG(20:3_32:2)	0.516	0.564	0.595	0.387	0.574	0.452	NA	0.358	0.636
TG(20:3_34:0)	0.666	0.707	0.632	0.891	0.621	0.739	NA	0.434	0.442
TG(20:3_34:1)	4.93	5.06	7.21	4.72	4.34	4.25	8.93	5.84	4.87
TG(20:3_34:2)	4.02	3.96	4.98	3.39	3.54	3.52	4.75	3.26	2.74
TG(20:3_34:3)	0.676	0.964	0.662	0.626	0.648	0.512	0.986	0.62	0.936
TG(20:3_36:3)	1.55	1.92	1.82	1.78	1.42	1.38	3.49	1.71	1.32
TG(20:3_36:4)	0.84	0.835	0.785	0.839	0.475	0.611	1.06	0.873	0.99
TG(20:3_36:5)	0.267	0.314	0.399	0.279	0.182	0.33	0.211	0.159	0.363
TG(20:4_30:0)	1.02	0.975	1.35	0.95	0.569	1.1	1.06	0.998	1.09
TG(20:4_32:0)	3.23	3.81	5.19	3.62	3.59	3.15	6.16	4.2	2.57
TG(20:4_32:1)	3.27	4.25	4.91	3.8	2.5	3.06	6.66	3.69	2.74
TG(20:4_32:2)	0.98	0.841	1.17	1.03	0.912	0.871	0.742	1.34	0.883
TG(20:4_33:2)	0.242	0.256	0.327	0.176	0.13	0.252	NA	0.161	0.173
TG(20:4_34:0)	2.28	2.29	2.64	1.64	1.79	1.44	2.41	2.34	1.6
TG(20:4_34:1)	14.8	15.7	19	12.6	11	10.9	19.8	14.2	10.5
TG(20:4_34:2)	10.2	10.1	10.7	10.6	9.54	8.88	10.4	9.15	8.11
TG(20:4_34:3)	1.61	1.49	1.92	1.61	1.27	1.62	0.715	1.7	1.5
TG(20:4_35:3)	0.068	0.075	0.051	0.073	0.062	NA	NA	NA	0.162
TG(20:4_36:2)	7.69	7.85	9.83	7.28	6.39	6.71	8.89	8.12	5.74
TG(20:4_36:3)	6.05	5.34	7.54	5.49	4.06	4.05	10.4	7.45	4.73
TG(20:4_36:4)	2.65	2.59	3.53	2.42	1.78	2.33	3.71	2.7	1.9
TG(20:4_36:5)	0.667	0.616	0.572	0.674	0.334	0.709	0.936	0.697	0.477
TG(20:5_34:0)	0.339	0.366	0.296	0.291	0.162	0.115	NA	NA	0.51
TG(20:5_34:1)	2.06	1.84	2.53	1.86	1.63	1.86	3.44	2.05	1.79
TG(20:5_34:2)	1.25	1.69	1.44	1.31	1.25	1.14	0.776	1.21	1.2
TG(20:5_36:2)	1.04	0.927	1.03	1.05	0.746	0.854	NA	0.81	0.503
TG(20:5_36:3)	0.847	0.873	0.99	0.968	1.02	0.632	0.892	0.704	0.812
TG(22:0_32:4)	NA	0.026	0.03	NA	0.015	NA	NA	NA	NA
TG(22:1_32:5)	0.015	0.018	0.027	NA	0.017	NA	NA	NA	0.017
TG(22:2_32:4)	0.023	0.098	0.193	NA	0.012	0.014	NA	NA	NA
TG(22:3_30:2)	NA	NA	0.022	NA	0.014	NA	NA	NA	NA
TG(22:4_32:0)	0.373	0.532	0.654	0.422	0.291	0.38	NA	0.535	0.428
TG(22:4_32:2)	0.148	0.212	0.173	0.059	0.115	0.162	NA	NA	0.329
TG(22:4_34:2)	1.38	1.43	1.74	1.21	0.98	0.966	1.16	1.29	1.21
TG(22:5_32:0)	1.02	0.896	1.18	0.74	0.814	0.741	0.853	1.01	0.76
TG(22:5_32:1)	0.845	0.954	2.09	0.906	1.07	0.722	1.4	0.941	0.543
TG(22:5_34:1)	3.97	5.03	6.19	3.84	3.64	3.62	6.83	4.33	3.46
TG(22:5_34:2)	3.04	3.06	4.29	2.75	2.29	2.78	2.92	3.05	2.66
TG(22:5_34:3)	0.435	0.59	0.782	0.495	0.421	0.549	0.238	0.476	0.515
TG(22:6_32:0)	1.03	0.83	1.61	1.09	0.691	0.907	1.32	1.01	0.597
TG(22:6_32:1)	1.05	1.18	1.09	0.829	0.808	1.21	1.08	1.02	0.904
TG(22:6_34:1)	3.79	4.37	4.83	2.99	3.6	3.37	3.24	3.36	3.14
TG(22:6_34:2)	2.74	3.5	3.17	2.4	2.13	2.39	2.09	2.99	1.68
TG(22:6_34:3)	0.664	0.597	0.49	0.325	0.541	0.423	0.368	0.458	0.447
Choline	7.11	8.18	7.37	8.02	7.88	7.52	9.11	8.49	8.28
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	Full name	Metabolite class	Method
Trigonelline	Trigonelline	Alkaloids	LCMS positive mode
TMAO	Trimethylamine N-oxide	Amine Oxides	LCMS positive mode
Ala	Alanine	Aminoacids	LCMS positive mode
Arg	Arginine	Aminoacids	LCMS positive mode
Asn	Asparagine	Aminoacids	LCMS positive mode
Asp	Aspartate	Aminoacids	LCMS positive mode
Cys	Cysteine	Aminoacids	LCMS positive mode
Glu	Glutamate	Aminoacids	LCMS positive mode
Gln	Glutamine	Aminoacids	LCMS positive mode
Gly	Glycine	Aminoacids	LCMS positive mode
His	Histidine	Aminoacids	LCMS positive mode
Ile	Isoleucine	Aminoacids	LCMS positive mode
Leu	Leucine	Aminoacids	LCMS positive mode
Lys	Lysine	Aminoacids	LCMS positive mode
Met	Methionine	Aminoacids	LCMS positive mode
Phe	Phenylalanine	Aminoacids	LCMS positive mode
Pro	Proline	Aminoacids	LCMS positive mode
Ser	Serine	Aminoacids	LCMS positive mode
Thr	Threonine	Aminoacids	LCMS positive mode
Trp	Tryptophan	Aminoacids	LCMS positive mode
Tyr	Tyrosine	Aminoacids	LCMS positive mode
Val	Valine	Aminoacids	LCMS positive mode
1-Met-His	1-Methylhistidine	Aminoacids Related	LCMS positive mode
3-Met-His	3-Methylhistidine	Aminoacids Related	LCMS positive mode
5-AVA	5-Aminovaleric acid	Aminoacids Related	LCMS positive mode
Ac-Orn	Acetylornithine	Aminoacids Related	LCMS positive mode
Anserine	Anserine	Aminoacids Related	LCMS positive mode
ADMA	Asymmetric dimethylarginine	Aminoacids Related	LCMS positive mode
Betaine	Betaine	Aminoacids Related	LCMS positive mode
Carnosine	Carnosine	Aminoacids Related	LCMS positive mode
c4-OH-Pro	cis-4-Hydroxyproline	Aminoacids Related	LCMS positive mode
Cit	Citrulline	Aminoacids Related	LCMS positive mode
Creatinine	Creatinine	Aminoacids Related	LCMS positive mode
Cystine	Cystine	Aminoacids Related	LCMS positive mode
DOPA	Dihydroxyphenylalanine	Aminoacids Related	LCMS positive mode
HArg	Homoarginine	Aminoacids Related	LCMS positive mode
HCys	Homocysteine	Aminoacids Related	LCMS positive mode
Kynurenine	Kynurenine	Aminoacids Related	LCMS positive mode
Met-SO	Methionine sulfoxide	Aminoacids Related	LCMS positive mode
Nitro-Tyr	Nitrotyrosine	Aminoacids Related	LCMS positive mode
Orn	Ornithine	Aminoacids Related	LCMS positive mode
PAG	Phenylacetylglycine	Aminoacids Related	LCMS positive mode
PheAlaBetaine	Phenylalanine betaine	Aminoacids Related	LCMS positive mode
ProBetaine	Proline betaine	Aminoacids Related	LCMS positive mode
Sarcosine	Sarcosine	Aminoacids Related	LCMS positive mode
SDMA	Symmetric dimethylarginine	Aminoacids Related	LCMS positive mode
Taurine	Taurine	Aminoacids Related	LCMS positive mode
t4-OH-Pro	trans-4-Hydroxyproline	Aminoacids Related	LCMS positive mode
TrpBetaine	Tryptophan betaine	Aminoacids Related	LCMS positive mode
alpha-AAA	α-Aminoadipic acid	Aminoacids Related	LCMS positive mode
AABA	α-Aminobutyric acid	Aminoacids Related	LCMS positive mode
BABA	β-Aminobutyric acid	Aminoacids Related	LCMS positive mode
Dopamine	Dopamine	Biogenic Amines	LCMS positive mode
Histamine	Histamine	Biogenic Amines	LCMS positive mode
PEA	Phenylethylamin	Biogenic Amines	LCMS positive mode
Putrescine	Putrescine	Biogenic Amines	LCMS positive mode
Serotonin	Serotonin	Biogenic Amines	LCMS positive mode
Spermidine	Spermidine	Biogenic Amines	LCMS positive mode
Spermine	Spermine	Biogenic Amines	LCMS positive mode
beta-Ala	β-Alanine	Biogenic Amines	LCMS positive mode
GABA	γ-Aminobutyric acid	Biogenic Amines	LCMS positive mode
HipAcid	Hippuric acid	Carboxylic Acids	LCMS positive mode
Cortisol	Cortisol	Hormones	LCMS positive mode
Cortisone	Cortisone	Hormones	LCMS positive mode
3-IAA	3-Indoleacetic acid	Indoles Derivatives	LCMS positive mode
3-IPA	3-Indolepropionic acid	Indoles Derivatives	LCMS positive mode
Indole	Indole	Indoles Derivatives	LCMS positive mode
Hypoxanthine	Hypoxanthine	Nucleobases Related	LCMS positive mode
Xanthine	Xanthine	Nucleobases Related	LCMS positive mode
Choline	Choline	Vitamins & Cofactors	LCMS positive mode
CDCA	Chenodeoxycholic acid	Bile Acids	LCMS negative mode
CA	Cholic acid	Bile Acids	LCMS negative mode
DCA	Deoxycholic acid	Bile Acids	LCMS negative mode
GCDCA	Glycochenodeoxycholic acid	Bile Acids	LCMS negative mode
GCA	Glycocholic acid	Bile Acids	LCMS negative mode
GDCA	Glycodeoxycholic acid	Bile Acids	LCMS negative mode
GLCA	Glycolithocholic acid	Bile Acids	LCMS negative mode
GLCAS	Glycolithocholic acid sulfate	Bile Acids	LCMS negative mode
GUDCA	Glycoursodeoxycholic acid	Bile Acids	LCMS negative mode
TCDCA	Taurochenodeoxycholic acid	Bile Acids	LCMS negative mode
TCA	Taurocholic acid	Bile Acids	LCMS negative mode
TDCA	Taurodeoxycholic acid	Bile Acids	LCMS negative mode
TLCA	Taurolithocholic acid	Bile Acids	LCMS negative mode
TMCA	Tauromurocholic acid	Bile Acids	LCMS negative mode
OH-GlutAcid	3-Hydroxyglutaric acid	Carboxylic Acids	LCMS negative mode
AconAcid	Aconitic acid	Carboxylic Acids	LCMS negative mode
DiCA(12:0)	Dodecanedioic acid	Carboxylic Acids	LCMS negative mode
Lac	Lactic acid	Carboxylic Acids	LCMS negative mode
Suc	Succinic acid	Carboxylic Acids	LCMS negative mode
DiCA(14:0)	Tetradecanedioic acid	Carboxylic Acids	LCMS negative mode
p-Cresol-SO4	p-Cresol sulfate	Cresols	LCMS negative mode
AA	Arachidonic acid (FA(20:4ω6))	Fatty Acids	LCMS negative mode
DHA	Docosahexaenoid acid (FA(22:6ω3))	Fatty Acids	LCMS negative mode
FA(20:2)	Eicosadienoic acid	Fatty Acids	LCMS negative mode
EPA	Eicosapentaenoic acid (FA(20:5ω3))	Fatty Acids	LCMS negative mode
FA(20:3)	Eicosatrienoic acid	Fatty Acids	LCMS negative mode
FA(20:1)	Eicosenoic acid	Fatty Acids	LCMS negative mode
FA(12:0)	Lauric acid	Fatty Acids	LCMS negative mode
FA(14:0)	Myristic acid	Fatty Acids	LCMS negative mode
FA(18:2)	Octadecadienoic acid	Fatty Acids	LCMS negative mode
FA(18:1)	Octadecenoic acid	Fatty Acids	LCMS negative mode
FA(16:0)	Palmitic acid	Fatty Acids	LCMS negative mode
FA(18:0)	Stearic acid	Fatty Acids	LCMS negative mode
AbsAcid	Abscisic acid	Hormones	LCMS negative mode
DHEAS	Dehydroepiandrosterone sulfate	Hormones	LCMS negative mode
Ind-SO4	Indoxyl sulfate	Indoles Derivatives	LCMS negative mode
C0	Carnitine	Acylcarnitines	Flow injection analysis
C2	Acetylcarnitine	Acylcarnitines	Flow injection analysis
C3	Propionylcarnitine	Acylcarnitines	Flow injection analysis
C3:1	Propenoylcarnitine	Acylcarnitines	Flow injection analysis
C3-DC.(C4-OH)	Malonylcarnitine (Hydroxybutyrylcarnitine)	Acylcarnitines	Flow injection analysis
C3-OH	Hydroxypropionylcarnitine	Acylcarnitines	Flow injection analysis
C4	Butyrylcarnitine	Acylcarnitines	Flow injection analysis
C4:1	Butenylcarnitine	Acylcarnitines	Flow injection analysis
C5	Valerylcarnitine	Acylcarnitines	Flow injection analysis
C5:1	Tiglylcarnitine	Acylcarnitines	Flow injection analysis
C5:1-DC	Glutaconylcarnitine	Acylcarnitines	Flow injection analysis
C5-DC.(C6-OH)	Glutarylcarnitine (Hydroxyhexanoylcarnitine)	Acylcarnitines	Flow injection analysis
C5-M-DC	Methylglutarylcarnitine	Acylcarnitines	Flow injection analysis
C5-OH.(C3-DC-M)	Hydroxyvalerylcarnitine (Methylmalonylcarnitine)	Acylcarnitines	Flow injection analysis
C6.(C4:1-DC)	Hexanoylcarnitine (Fumarylcarnitine)	Acylcarnitines	Flow injection analysis
C6:1	Hexenoylcarnitine	Acylcarnitines	Flow injection analysis
C7-DC	Pimeloylcarnitine	Acylcarnitines	Flow injection analysis
C8	Octanoylcarnitine	Acylcarnitines	Flow injection analysis
C9	Nonaylcarnitine	Acylcarnitines	Flow injection analysis
C10	Decanoylcarnitine	Acylcarnitines	Flow injection analysis
C10:1	Decenoylcarnitine	Acylcarnitines	Flow injection analysis
C10:2	Decadienoylcarnitine	Acylcarnitines	Flow injection analysis
C12	Dodecanoylcarnitine	Acylcarnitines	Flow injection analysis
C12:1	Dodecenoylcarnitine	Acylcarnitines	Flow injection analysis
C12-DC	Dodecanedioylcarnitine	Acylcarnitines	Flow injection analysis
C14	Tetradecanoylcarnitine	Acylcarnitines	Flow injection analysis
C14:1	Tetradecenoylcarnitine	Acylcarnitines	Flow injection analysis
C14:1-OH	Hydroxytetradecenoylcarnitine	Acylcarnitines	Flow injection analysis
C14:2	Tetradecadienoylcarnitine	Acylcarnitines	Flow injection analysis
C14:2-OH	Hydroxytetradecadienoylcarnitine	Acylcarnitines	Flow injection analysis
C16	Hexadecanoylcarnitine	Acylcarnitines	Flow injection analysis
C16:1	Hexadecenoylcarnitine	Acylcarnitines	Flow injection analysis
C16:1-OH	Hydroxyhexadecenoylcarnitine	Acylcarnitines	Flow injection analysis
C16:2	Hexadecadienoylcarnitine	Acylcarnitines	Flow injection analysis
C16:2-OH	Hydroxyhexadecadienoylcarnitine	Acylcarnitines	Flow injection analysis
C16-OH	Hydroxyhexadecanoylcarnitine	Acylcarnitines	Flow injection analysis
C18	Octadecanoylcarnitine	Acylcarnitines	Flow injection analysis
C18:1	Octadecenoylcarnitine	Acylcarnitines	Flow injection analysis
C18:1-OH	Hydroxyoctadecenoylcarnitine	Acylcarnitines	Flow injection analysis
C18:2	Octadecadienylcarnitine	Acylcarnitines	Flow injection analysis
Cer(d16:1/18:0)	Cer(d16:1/18:0)	Ceramides	Flow injection analysis
Cer(d16:1/20:0)	Cer(d16:1/20:0)	Ceramides	Flow injection analysis
Cer(d16:1/22:0)	Cer(d16:1/22:0)	Ceramides	Flow injection analysis
Cer(d16:1/23:0)	Cer(d16:1/23:0)	Ceramides	Flow injection analysis
Cer(d16:1/24:0)	Cer(d16:1/24:0)	Ceramides	Flow injection analysis
Cer(d18:1/14:0)	Cer(d18:1/14:0)	Ceramides	Flow injection analysis
Cer(d18:1/16:0)	Cer(d18:1/16:0)	Ceramides	Flow injection analysis
Cer(d18:1/18:0(OH))	Cer(d18:1/18:0(OH))	Ceramides	Flow injection analysis
Cer(d18:1/18:0)	Cer(d18:1/18:0)	Ceramides	Flow injection analysis
Cer(d18:1/18:1)	Cer(d18:1/18:1)	Ceramides	Flow injection analysis
Cer(d18:1/20:0(OH))	Cer(d18:1/20:0(OH))	Ceramides	Flow injection analysis
Cer(d18:1/20:0)	Cer(d18:1/20:0)	Ceramides	Flow injection analysis
Cer(d18:1/22:0)	Cer(d18:1/22:0)	Ceramides	Flow injection analysis
Cer(d18:1/23:0)	Cer(d18:1/23:0)	Ceramides	Flow injection analysis
Cer(d18:1/24:0)	Cer(d18:1/24:0)	Ceramides	Flow injection analysis
Cer(d18:1/24:1)	Cer(d18:1/24:1)	Ceramides	Flow injection analysis
Cer(d18:1/25:0)	Cer(d18:1/25:0)	Ceramides	Flow injection analysis
Cer(d18:1/26:0)	Cer(d18:1/26:0)	Ceramides	Flow injection analysis
Cer(d18:1/26:1)	Cer(d18:1/26:1)	Ceramides	Flow injection analysis
Cer(d18:2/14:0)	Cer(d18:2/14:0)	Ceramides	Flow injection analysis
Cer(d18:2/16:0)	Cer(d18:2/16:0)	Ceramides	Flow injection analysis
Cer(d18:2/18:0)	Cer(d18:2/18:0)	Ceramides	Flow injection analysis
Cer(d18:2/18:1)	Cer(d18:2/18:1)	Ceramides	Flow injection analysis
Cer(d18:2/20:0)	Cer(d18:2/20:0)	Ceramides	Flow injection analysis
Cer(d18:2/22:0)	Cer(d18:2/22:0)	Ceramides	Flow injection analysis
Cer(d18:2/23:0)	Cer(d18:2/23:0)	Ceramides	Flow injection analysis
Cer(d18:2/24:0)	Cer(d18:2/24:0)	Ceramides	Flow injection analysis
Cer(d18:2/24:1)	Cer(d18:2/24:1)	Ceramides	Flow injection analysis
CE(14:0)	CE(14:0)	Cholesterol Esters	Flow injection analysis
CE(14:1)	CE(14:1)	Cholesterol Esters	Flow injection analysis
CE(15:0)	CE(15:0)	Cholesterol Esters	Flow injection analysis
CE(15:1)	CE(15:1)	Cholesterol Esters	Flow injection analysis
CE(16:0)	CE(16:0)	Cholesterol Esters	Flow injection analysis
CE(16:1)	CE(16:1)	Cholesterol Esters	Flow injection analysis
CE(17:0)	CE(17:0)	Cholesterol Esters	Flow injection analysis
CE(17:1)	CE(17:1)	Cholesterol Esters	Flow injection analysis
CE(18:0)	CE(18:0)	Cholesterol Esters	Flow injection analysis
CE(18:1)	CE(18:1)	Cholesterol Esters	Flow injection analysis
CE(18:2)	CE(18:2)	Cholesterol Esters	Flow injection analysis
CE(18:3)	CE(18:3)	Cholesterol Esters	Flow injection analysis
CE(20:0)	CE(20:0)	Cholesterol Esters	Flow injection analysis
CE(20:1)	CE(20:1)	Cholesterol Esters	Flow injection analysis
CE(20:3)	CE(20:3)	Cholesterol Esters	Flow injection analysis
CE(20:4)	CE(20:4)	Cholesterol Esters	Flow injection analysis
CE(20:5)	CE(20:5)	Cholesterol Esters	Flow injection analysis
CE(22:0)	CE(22:0)	Cholesterol Esters	Flow injection analysis
CE(22:1)	CE(22:1)	Cholesterol Esters	Flow injection analysis
CE(22:2)	CE(22:2)	Cholesterol Esters	Flow injection analysis
CE(22:5)	CE(22:5)	Cholesterol Esters	Flow injection analysis
CE(22:6)	CE(22:6)	Cholesterol Esters	Flow injection analysis
DG(14:0_14:0)	DG(14:0_14:0)	Diacylglycerols	Flow injection analysis
DG(14:0_18:1)	DG(14:0_18:1)	Diacylglycerols	Flow injection analysis
DG(14:0_18:2)	DG(14:0_18:2)	Diacylglycerols	Flow injection analysis
DG(14:0_20:0)	DG(14:0_20:0)	Diacylglycerols	Flow injection analysis
DG(14:1_18:1)	DG(14:1_18:1)	Diacylglycerols	Flow injection analysis
DG(14:1_20:2)	DG(14:1_20:2)	Diacylglycerols	Flow injection analysis
DG(16:0_16:0)	DG(16:0_16:0)	Diacylglycerols	Flow injection analysis
DG(16:0_16:1)	DG(16:0_16:1)	Diacylglycerols	Flow injection analysis
DG(16:0_18:1)	DG(16:0_18:1)	Diacylglycerols	Flow injection analysis
DG(16:0_18:2)	DG(16:0_18:2)	Diacylglycerols	Flow injection analysis
DG(16:0_20:0)	DG(16:0_20:0)	Diacylglycerols	Flow injection analysis
DG(16:0_20:3)	DG(16:0_20:3)	Diacylglycerols	Flow injection analysis
DG(16:0_20:4)	DG(16:0_20:4)	Diacylglycerols	Flow injection analysis
DG(16:1_18:0)	DG(16:1_18:0)	Diacylglycerols	Flow injection analysis
DG(16:1_18:1)	DG(16:1_18:1)	Diacylglycerols	Flow injection analysis
DG(16:1_18:2)	DG(16:1_18:2)	Diacylglycerols	Flow injection analysis
DG(16:1_20:0)	DG(16:1_20:0)	Diacylglycerols	Flow injection analysis
DG(17:0_17:1)	DG(17:0_17:1)	Diacylglycerols	Flow injection analysis
DG(17:0_18:1)	DG(17:0_18:1)	Diacylglycerols	Flow injection analysis
DG(18:0_20:0)	DG(18:0_20:0)	Diacylglycerols	Flow injection analysis
DG(18:0_20:4)	DG(18:0_20:4)	Diacylglycerols	Flow injection analysis
DG(18:1_18:1)	DG(18:1_18:1)	Diacylglycerols	Flow injection analysis
DG(18:1_18:2)	DG(18:1_18:2)	Diacylglycerols	Flow injection analysis
DG(18:1_18:3)	DG(18:1_18:3)	Diacylglycerols	Flow injection analysis
DG(18:1_18:4)	DG(18:1_18:4)	Diacylglycerols	Flow injection analysis
DG(18:1_20:0)	DG(18:1_20:0)	Diacylglycerols	Flow injection analysis
DG(18:1_20:1)	DG(18:1_20:1)	Diacylglycerols	Flow injection analysis
DG(18:1_20:2)	DG(18:1_20:2)	Diacylglycerols	Flow injection analysis
DG(18:1_20:3)	DG(18:1_20:3)	Diacylglycerols	Flow injection analysis
DG(18:1_20:4)	DG(18:1_20:4)	Diacylglycerols	Flow injection analysis
DG(18:1_22:5)	DG(18:1_22:5)	Diacylglycerols	Flow injection analysis
DG(18:1_22:6)	DG(18:1_22:6)	Diacylglycerols	Flow injection analysis
DG(18:2_18:2)	DG(18:2_18:2)	Diacylglycerols	Flow injection analysis
DG(18:2_18:3)	DG(18:2_18:3)	Diacylglycerols	Flow injection analysis
DG(18:2_18:4)	DG(18:2_18:4)	Diacylglycerols	Flow injection analysis
DG(18:2_20:0)	DG(18:2_20:0)	Diacylglycerols	Flow injection analysis
DG(18:2_20:4)	DG(18:2_20:4)	Diacylglycerols	Flow injection analysis
DG(18:3_18:3)	DG(18:3_18:3)	Diacylglycerols	Flow injection analysis
DG(18:3_20:2)	DG(18:3_20:2)	Diacylglycerols	Flow injection analysis
DG(21:0_22:6)	DG(21:0_22:6)	Diacylglycerols	Flow injection analysis
DG(22:1_22:2)	DG(22:1_22:2)	Diacylglycerols	Flow injection analysis
DG-O(14:0_18:2)	DG-O(14:0_18:2)	Diacylglycerols	Flow injection analysis
DG-O(16:0_18:1)	DG-O(16:0_18:1)	Diacylglycerols	Flow injection analysis
DG-O(16:0_20:4)	DG-O(16:0_20:4)	Diacylglycerols	Flow injection analysis
Cer(d18:0/18:0(OH))	Cer(d18:0/18:0(OH))	Dihydroceramides	Flow injection analysis
Cer(d18:0/18:0)	Cer(d18:0/18:0)	Dihydroceramides	Flow injection analysis
Cer(d18:0/20:0)	Cer(d18:0/20:0)	Dihydroceramides	Flow injection analysis
Cer(d18:0/22:0)	Cer(d18:0/22:0)	Dihydroceramides	Flow injection analysis
Cer(d18:0/24:0)	Cer(d18:0/24:0)	Dihydroceramides	Flow injection analysis
Cer(d18:0/24:1)	Cer(d18:0/24:1)	Dihydroceramides	Flow injection analysis
Cer(d18:0/26:1(OH))	Cer(d18:0/26:1(OH))	Dihydroceramides	Flow injection analysis
Cer(d18:0/26:1)	Cer(d18:0/26:1)	Dihydroceramides	Flow injection analysis
lysoPC.a.C14:0	lysoPC a C14:0	Glycerophospholipids	Flow injection analysis
lysoPC.a.C16:0	lysoPC a C16:0	Glycerophospholipids	Flow injection analysis
lysoPC.a.C16:1	lysoPC a C16:1	Glycerophospholipids	Flow injection analysis
lysoPC.a.C17:0	lysoPC a C17:0	Glycerophospholipids	Flow injection analysis
lysoPC.a.C18:0	lysoPC a C18:0	Glycerophospholipids	Flow injection analysis
lysoPC.a.C18:1	lysoPC a C18:1	Glycerophospholipids	Flow injection analysis
lysoPC.a.C18:2	lysoPC a C18:2	Glycerophospholipids	Flow injection analysis
lysoPC.a.C20:3	lysoPC a C20:3	Glycerophospholipids	Flow injection analysis
lysoPC.a.C20:4	lysoPC a C20:4	Glycerophospholipids	Flow injection analysis
lysoPC.a.C24:0	lysoPC a C24:0	Glycerophospholipids	Flow injection analysis
lysoPC.a.C26:0	lysoPC a C26:0	Glycerophospholipids	Flow injection analysis
lysoPC.a.C26:1	lysoPC a C26:1	Glycerophospholipids	Flow injection analysis
lysoPC.a.C28:0	lysoPC a C28:0	Glycerophospholipids	Flow injection analysis
lysoPC.a.C28:1	lysoPC a C28:1	Glycerophospholipids	Flow injection analysis
PC.aa.C24:0	PC aa C24:0	Glycerophospholipids	Flow injection analysis
PC.aa.C26:0	PC aa C26:0	Glycerophospholipids	Flow injection analysis
PC.aa.C28:1	PC aa C28:1	Glycerophospholipids	Flow injection analysis
PC.aa.C30:0	PC aa C30:0	Glycerophospholipids	Flow injection analysis
PC.aa.C30:2	PC aa C30:2	Glycerophospholipids	Flow injection analysis
PC.aa.C32:0	PC aa C32:0	Glycerophospholipids	Flow injection analysis
PC.aa.C32:1	PC aa C32:1	Glycerophospholipids	Flow injection analysis
PC.aa.C32:2	PC aa C32:2	Glycerophospholipids	Flow injection analysis
PC.aa.C32:3	PC aa C32:3	Glycerophospholipids	Flow injection analysis
PC.aa.C34:1	PC aa C34:1	Glycerophospholipids	Flow injection analysis
PC.aa.C34:2	PC aa C34:2	Glycerophospholipids	Flow injection analysis
PC.aa.C34:3	PC aa C34:3	Glycerophospholipids	Flow injection analysis
PC.aa.C34:4	PC aa C34:4	Glycerophospholipids	Flow injection analysis
PC.aa.C36:0	PC aa C36:0	Glycerophospholipids	Flow injection analysis
PC.aa.C36:1	PC aa C36:1	Glycerophospholipids	Flow injection analysis
PC.aa.C36:2	PC aa C36:2	Glycerophospholipids	Flow injection analysis
PC.aa.C36:3	PC aa C36:3	Glycerophospholipids	Flow injection analysis
PC.aa.C36:4	PC aa C36:4	Glycerophospholipids	Flow injection analysis
PC.aa.C36:5	PC aa C36:5	Glycerophospholipids	Flow injection analysis
PC.aa.C36:6	PC aa C36:6	Glycerophospholipids	Flow injection analysis
PC.aa.C38:0	PC aa C38:0	Glycerophospholipids	Flow injection analysis
PC.aa.C38:1	PC aa C38:1	Glycerophospholipids	Flow injection analysis
PC.aa.C38:3	PC aa C38:3	Glycerophospholipids	Flow injection analysis
PC.aa.C38:4	PC aa C38:4	Glycerophospholipids	Flow injection analysis
PC.aa.C38:5	PC aa C38:5	Glycerophospholipids	Flow injection analysis
PC.aa.C38:6	PC aa C38:6	Glycerophospholipids	Flow injection analysis
PC.aa.C40:1	PC aa C40:1	Glycerophospholipids	Flow injection analysis
PC.aa.C40:2	PC aa C40:2	Glycerophospholipids	Flow injection analysis
PC.aa.C40:3	PC aa C40:3	Glycerophospholipids	Flow injection analysis
PC.aa.C40:4	PC aa C40:4	Glycerophospholipids	Flow injection analysis
PC.aa.C40:5	PC aa C40:5	Glycerophospholipids	Flow injection analysis
PC.aa.C40:6	PC aa C40:6	Glycerophospholipids	Flow injection analysis
PC.aa.C42:0	PC aa C42:0	Glycerophospholipids	Flow injection analysis
PC.aa.C42:1	PC aa C42:1	Glycerophospholipids	Flow injection analysis
PC.aa.C42:2	PC aa C42:2	Glycerophospholipids	Flow injection analysis
PC.aa.C42:4	PC aa C42:4	Glycerophospholipids	Flow injection analysis
PC.aa.C42:5	PC aa C42:5	Glycerophospholipids	Flow injection analysis
PC.aa.C42:6	PC aa C42:6	Glycerophospholipids	Flow injection analysis
PC.ae.C30:0	PC ae C30:0	Glycerophospholipids	Flow injection analysis
PC.ae.C30:1	PC ae C30:1	Glycerophospholipids	Flow injection analysis
PC.ae.C30:2	PC ae C30:2	Glycerophospholipids	Flow injection analysis
PC.ae.C32:1	PC ae C32:1	Glycerophospholipids	Flow injection analysis
PC.ae.C32:2	PC ae C32:2	Glycerophospholipids	Flow injection analysis
PC.ae.C34:0	PC ae C34:0	Glycerophospholipids	Flow injection analysis
PC.ae.C34:1	PC ae C34:1	Glycerophospholipids	Flow injection analysis
PC.ae.C34:2	PC ae C34:2	Glycerophospholipids	Flow injection analysis
PC.ae.C34:3	PC ae C34:3	Glycerophospholipids	Flow injection analysis
PC.ae.C36:0	PC ae C36:0	Glycerophospholipids	Flow injection analysis
PC.ae.C36:1	PC ae C36:1	Glycerophospholipids	Flow injection analysis
PC.ae.C36:2	PC ae C36:2	Glycerophospholipids	Flow injection analysis
PC.ae.C36:3	PC ae C36:3	Glycerophospholipids	Flow injection analysis
PC.ae.C36:4	PC ae C36:4	Glycerophospholipids	Flow injection analysis
PC.ae.C36:5	PC ae C36:5	Glycerophospholipids	Flow injection analysis
PC.ae.C38:0	PC ae C38:0	Glycerophospholipids	Flow injection analysis
PC.ae.C38:1	PC ae C38:1	Glycerophospholipids	Flow injection analysis
PC.ae.C38:2	PC ae C38:2	Glycerophospholipids	Flow injection analysis
PC.ae.C38:3	PC ae C38:3	Glycerophospholipids	Flow injection analysis
PC.ae.C38:4	PC ae C38:4	Glycerophospholipids	Flow injection analysis
PC.ae.C38:5	PC ae C38:5	Glycerophospholipids	Flow injection analysis
PC.ae.C38:6	PC ae C38:6	Glycerophospholipids	Flow injection analysis
PC.ae.C40:1	PC ae C40:1	Glycerophospholipids	Flow injection analysis
PC.ae.C40:2	PC ae C40:2	Glycerophospholipids	Flow injection analysis
PC.ae.C40:3	PC ae C40:3	Glycerophospholipids	Flow injection analysis
PC.ae.C40:4	PC ae C40:4	Glycerophospholipids	Flow injection analysis
PC.ae.C40:5	PC ae C40:5	Glycerophospholipids	Flow injection analysis
PC.ae.C40:6	PC ae C40:6	Glycerophospholipids	Flow injection analysis
PC.ae.C42:0	PC ae C42:0	Glycerophospholipids	Flow injection analysis
PC.ae.C42:1	PC ae C42:1	Glycerophospholipids	Flow injection analysis
PC.ae.C42:2	PC ae C42:2	Glycerophospholipids	Flow injection analysis
PC.ae.C42:3	PC ae C42:3	Glycerophospholipids	Flow injection analysis
PC.ae.C42:4	PC ae C42:4	Glycerophospholipids	Flow injection analysis
PC.ae.C42:5	PC ae C42:5	Glycerophospholipids	Flow injection analysis
PC.ae.C44:3	PC ae C44:3	Glycerophospholipids	Flow injection analysis
PC.ae.C44:4	PC ae C44:4	Glycerophospholipids	Flow injection analysis
PC.ae.C44:5	PC ae C44:5	Glycerophospholipids	Flow injection analysis
PC.ae.C44:6	PC ae C44:6	Glycerophospholipids	Flow injection analysis
Hex2Cer(d18:1/14:0)	Hex2Cer(d18:1/14:0)	Glycosylceramides	Flow injection analysis
Hex2Cer(d18:1/16:0)	Hex2Cer(d18:1/16:0)	Glycosylceramides	Flow injection analysis
Hex2Cer(d18:1/18:0)	Hex2Cer(d18:1/18:0)	Glycosylceramides	Flow injection analysis
Hex2Cer(d18:1/20:0)	Hex2Cer(d18:1/20:0)	Glycosylceramides	Flow injection analysis
Hex2Cer(d18:1/22:0)	Hex2Cer(d18:1/22:0)	Glycosylceramides	Flow injection analysis
Hex2Cer(d18:1/24:0)	Hex2Cer(d18:1/24:0)	Glycosylceramides	Flow injection analysis
Hex2Cer(d18:1/24:1)	Hex2Cer(d18:1/24:1)	Glycosylceramides	Flow injection analysis
Hex2Cer(d18:1/26:0)	Hex2Cer(d18:1/26:0)	Glycosylceramides	Flow injection analysis
Hex2Cer(d18:1/26:1)	Hex2Cer(d18:1/26:1)	Glycosylceramides	Flow injection analysis
Hex3Cer(d18:1/16:0)	Hex3Cer(d18:1/16:0)	Glycosylceramides	Flow injection analysis
Hex3Cer(d18:1/18:0)	Hex3Cer(d18:1/18:0)	Glycosylceramides	Flow injection analysis
Hex3Cer(d18:1/24:1)	Hex3Cer(d18:1/24:1)	Glycosylceramides	Flow injection analysis
Hex3Cer(d18:1/26:1)	Hex3Cer(d18:1/26:1)	Glycosylceramides	Flow injection analysis
Hex3Cer(d18:1_20:0)	Hex3Cer(d18:1_20:0)	Glycosylceramides	Flow injection analysis
Hex3Cer(d18:1_22:0)	Hex3Cer(d18:1_22:0)	Glycosylceramides	Flow injection analysis
HexCer(d16:1/22:0)	HexCer(d16:1/22:0)	Glycosylceramides	Flow injection analysis
HexCer(d16:1/24:0)	HexCer(d16:1/24:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/14:0)	HexCer(d18:1/14:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/16:0)	HexCer(d18:1/16:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/18:0)	HexCer(d18:1/18:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/18:1)	HexCer(d18:1/18:1)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/20:0)	HexCer(d18:1/20:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/22:0)	HexCer(d18:1/22:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/23:0)	HexCer(d18:1/23:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/24:0)	HexCer(d18:1/24:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/24:1)	HexCer(d18:1/24:1)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/26:0)	HexCer(d18:1/26:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:1/26:1)	HexCer(d18:1/26:1)	Glycosylceramides	Flow injection analysis
HexCer(d18:2/16:0)	HexCer(d18:2/16:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:2/18:0)	HexCer(d18:2/18:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:2/20:0)	HexCer(d18:2/20:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:2/22:0)	HexCer(d18:2/22:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:2/23:0)	HexCer(d18:2/23:0)	Glycosylceramides	Flow injection analysis
HexCer(d18:2/24:0)	HexCer(d18:2/24:0)	Glycosylceramides	Flow injection analysis
SM.(OH).C14:1	SM (OH) C14:1	Sphingolipids	Flow injection analysis
SM.(OH).C16:1	SM (OH) C16:1	Sphingolipids	Flow injection analysis
SM.(OH).C22:1	SM (OH) C22:1	Sphingolipids	Flow injection analysis
SM.(OH).C22:2	SM (OH) C22:2	Sphingolipids	Flow injection analysis
SM.(OH).C24:1	SM (OH) C24:1	Sphingolipids	Flow injection analysis
SM.C16:0	SM C16:0	Sphingolipids	Flow injection analysis
SM.C16:1	SM C16:1	Sphingolipids	Flow injection analysis
SM.C18:0	SM C18:0	Sphingolipids	Flow injection analysis
SM.C18:1	SM C18:1	Sphingolipids	Flow injection analysis
SM.C20:2	SM C20:2	Sphingolipids	Flow injection analysis
SM.C22:3	SM C22:3	Sphingolipids	Flow injection analysis
SM.C24:0	SM C24:0	Sphingolipids	Flow injection analysis
SM.C24:1	SM C24:1	Sphingolipids	Flow injection analysis
SM.C26:0	SM C26:0	Sphingolipids	Flow injection analysis
SM.C26:1	SM C26:1	Sphingolipids	Flow injection analysis
H1	Hexoses (including glucose)	Sugars	Flow injection analysis
TG(14:0_32:2)	TG(14:0_32:2)	Triacylglycerols	Flow injection analysis
TG(14:0_34:0)	TG(14:0_34:0)	Triacylglycerols	Flow injection analysis
TG(14:0_34:1)	TG(14:0_34:1)	Triacylglycerols	Flow injection analysis
TG(14:0_34:2)	TG(14:0_34:2)	Triacylglycerols	Flow injection analysis
TG(14:0_34:3)	TG(14:0_34:3)	Triacylglycerols	Flow injection analysis
TG(14:0_35:1)	TG(14:0_35:1)	Triacylglycerols	Flow injection analysis
TG(14:0_35:2)	TG(14:0_35:2)	Triacylglycerols	Flow injection analysis
TG(14:0_36:1)	TG(14:0_36:1)	Triacylglycerols	Flow injection analysis
TG(14:0_36:2)	TG(14:0_36:2)	Triacylglycerols	Flow injection analysis
TG(14:0_36:3)	TG(14:0_36:3)	Triacylglycerols	Flow injection analysis
TG(14:0_36:4)	TG(14:0_36:4)	Triacylglycerols	Flow injection analysis
TG(14:0_38:4)	TG(14:0_38:4)	Triacylglycerols	Flow injection analysis
TG(14:0_38:5)	TG(14:0_38:5)	Triacylglycerols	Flow injection analysis
TG(14:0_39:3)	TG(14:0_39:3)	Triacylglycerols	Flow injection analysis
TG(16:0_28:1)	TG(16:0_28:1)	Triacylglycerols	Flow injection analysis
TG(16:0_28:2)	TG(16:0_28:2)	Triacylglycerols	Flow injection analysis
TG(16:0_30:2)	TG(16:0_30:2)	Triacylglycerols	Flow injection analysis
TG(16:0_32:0)	TG(16:0_32:0)	Triacylglycerols	Flow injection analysis
TG(16:0_32:1)	TG(16:0_32:1)	Triacylglycerols	Flow injection analysis
TG(16:0_32:2)	TG(16:0_32:2)	Triacylglycerols	Flow injection analysis
TG(16:0_32:3)	TG(16:0_32:3)	Triacylglycerols	Flow injection analysis
TG(16:0_33:1)	TG(16:0_33:1)	Triacylglycerols	Flow injection analysis
TG(16:0_33:2)	TG(16:0_33:2)	Triacylglycerols	Flow injection analysis
TG(16:0_34:0)	TG(16:0_34:0)	Triacylglycerols	Flow injection analysis
TG(16:0_34:1)	TG(16:0_34:1)	Triacylglycerols	Flow injection analysis
TG(16:0_34:2)	TG(16:0_34:2)	Triacylglycerols	Flow injection analysis
TG(16:0_34:3)	TG(16:0_34:3)	Triacylglycerols	Flow injection analysis
TG(16:0_34:4)	TG(16:0_34:4)	Triacylglycerols	Flow injection analysis
TG(16:0_35:1)	TG(16:0_35:1)	Triacylglycerols	Flow injection analysis
TG(16:0_35:2)	TG(16:0_35:2)	Triacylglycerols	Flow injection analysis
TG(16:0_35:3)	TG(16:0_35:3)	Triacylglycerols	Flow injection analysis
TG(16:0_36:2)	TG(16:0_36:2)	Triacylglycerols	Flow injection analysis
TG(16:0_36:3)	TG(16:0_36:3)	Triacylglycerols	Flow injection analysis
TG(16:0_36:4)	TG(16:0_36:4)	Triacylglycerols	Flow injection analysis
TG(16:0_36:5)	TG(16:0_36:5)	Triacylglycerols	Flow injection analysis
TG(16:0_36:6)	TG(16:0_36:6)	Triacylglycerols	Flow injection analysis
TG(16:0_37:3)	TG(16:0_37:3)	Triacylglycerols	Flow injection analysis
TG(16:0_38:1)	TG(16:0_38:1)	Triacylglycerols	Flow injection analysis
TG(16:0_38:2)	TG(16:0_38:2)	Triacylglycerols	Flow injection analysis
TG(16:0_38:3)	TG(16:0_38:3)	Triacylglycerols	Flow injection analysis
TG(16:0_38:4)	TG(16:0_38:4)	Triacylglycerols	Flow injection analysis
TG(16:0_38:5)	TG(16:0_38:5)	Triacylglycerols	Flow injection analysis
TG(16:0_38:6)	TG(16:0_38:6)	Triacylglycerols	Flow injection analysis
TG(16:0_38:7)	TG(16:0_38:7)	Triacylglycerols	Flow injection analysis
TG(16:0_40:6)	TG(16:0_40:6)	Triacylglycerols	Flow injection analysis
TG(16:0_40:7)	TG(16:0_40:7)	Triacylglycerols	Flow injection analysis
TG(16:0_40:8)	TG(16:0_40:8)	Triacylglycerols	Flow injection analysis
TG(16:1_28:0)	TG(16:1_28:0)	Triacylglycerols	Flow injection analysis
TG(16:1_30:1)	TG(16:1_30:1)	Triacylglycerols	Flow injection analysis
TG(16:1_32:0)	TG(16:1_32:0)	Triacylglycerols	Flow injection analysis
TG(16:1_32:1)	TG(16:1_32:1)	Triacylglycerols	Flow injection analysis
TG(16:1_32:2)	TG(16:1_32:2)	Triacylglycerols	Flow injection analysis
TG(16:1_33:1)	TG(16:1_33:1)	Triacylglycerols	Flow injection analysis
TG(16:1_34:0)	TG(16:1_34:0)	Triacylglycerols	Flow injection analysis
TG(16:1_34:1)	TG(16:1_34:1)	Triacylglycerols	Flow injection analysis
TG(16:1_34:2)	TG(16:1_34:2)	Triacylglycerols	Flow injection analysis
TG(16:1_34:3)	TG(16:1_34:3)	Triacylglycerols	Flow injection analysis
TG(16:1_36:1)	TG(16:1_36:1)	Triacylglycerols	Flow injection analysis
TG(16:1_36:2)	TG(16:1_36:2)	Triacylglycerols	Flow injection analysis
TG(16:1_36:3)	TG(16:1_36:3)	Triacylglycerols	Flow injection analysis
TG(16:1_36:4)	TG(16:1_36:4)	Triacylglycerols	Flow injection analysis
TG(16:1_36:5)	TG(16:1_36:5)	Triacylglycerols	Flow injection analysis
TG(16:1_38:3)	TG(16:1_38:3)	Triacylglycerols	Flow injection analysis
TG(16:1_38:4)	TG(16:1_38:4)	Triacylglycerols	Flow injection analysis
TG(16:1_38:5)	TG(16:1_38:5)	Triacylglycerols	Flow injection analysis
TG(17:0_32:1)	TG(17:0_32:1)	Triacylglycerols	Flow injection analysis
TG(17:0_34:1)	TG(17:0_34:1)	Triacylglycerols	Flow injection analysis
TG(17:0_34:2)	TG(17:0_34:2)	Triacylglycerols	Flow injection analysis
TG(17:0_34:3)	TG(17:0_34:3)	Triacylglycerols	Flow injection analysis
TG(17:0_36:3)	TG(17:0_36:3)	Triacylglycerols	Flow injection analysis
TG(17:0_36:4)	TG(17:0_36:4)	Triacylglycerols	Flow injection analysis
TG(17:1_32:1)	TG(17:1_32:1)	Triacylglycerols	Flow injection analysis
TG(17:1_34:1)	TG(17:1_34:1)	Triacylglycerols	Flow injection analysis
TG(17:1_34:2)	TG(17:1_34:2)	Triacylglycerols	Flow injection analysis
TG(17:1_34:3)	TG(17:1_34:3)	Triacylglycerols	Flow injection analysis
TG(17:1_36:3)	TG(17:1_36:3)	Triacylglycerols	Flow injection analysis
TG(17:1_36:4)	TG(17:1_36:4)	Triacylglycerols	Flow injection analysis
TG(17:1_36:5)	TG(17:1_36:5)	Triacylglycerols	Flow injection analysis
TG(17:1_38:5)	TG(17:1_38:5)	Triacylglycerols	Flow injection analysis
TG(17:1_38:6)	TG(17:1_38:6)	Triacylglycerols	Flow injection analysis
TG(17:1_38:7)	TG(17:1_38:7)	Triacylglycerols	Flow injection analysis
TG(17:2_34:2)	TG(17:2_34:2)	Triacylglycerols	Flow injection analysis
TG(17:2_34:3)	TG(17:2_34:3)	Triacylglycerols	Flow injection analysis
TG(17:2_36:2)	TG(17:2_36:2)	Triacylglycerols	Flow injection analysis
TG(17:2_36:3)	TG(17:2_36:3)	Triacylglycerols	Flow injection analysis
TG(17:2_36:4)	TG(17:2_36:4)	Triacylglycerols	Flow injection analysis
TG(17:2_38:5)	TG(17:2_38:5)	Triacylglycerols	Flow injection analysis
TG(17:2_38:6)	TG(17:2_38:6)	Triacylglycerols	Flow injection analysis
TG(17:2_38:7)	TG(17:2_38:7)	Triacylglycerols	Flow injection analysis
TG(18:0_30:0)	TG(18:0_30:0)	Triacylglycerols	Flow injection analysis
TG(18:0_30:1)	TG(18:0_30:1)	Triacylglycerols	Flow injection analysis
TG(18:0_32:0)	TG(18:0_32:0)	Triacylglycerols	Flow injection analysis
TG(18:0_32:1)	TG(18:0_32:1)	Triacylglycerols	Flow injection analysis
TG(18:0_32:2)	TG(18:0_32:2)	Triacylglycerols	Flow injection analysis
TG(18:0_34:2)	TG(18:0_34:2)	Triacylglycerols	Flow injection analysis
TG(18:0_34:3)	TG(18:0_34:3)	Triacylglycerols	Flow injection analysis
TG(18:0_36:1)	TG(18:0_36:1)	Triacylglycerols	Flow injection analysis
TG(18:0_36:2)	TG(18:0_36:2)	Triacylglycerols	Flow injection analysis
TG(18:0_36:3)	TG(18:0_36:3)	Triacylglycerols	Flow injection analysis
TG(18:0_36:4)	TG(18:0_36:4)	Triacylglycerols	Flow injection analysis
TG(18:0_36:5)	TG(18:0_36:5)	Triacylglycerols	Flow injection analysis
TG(18:0_38:6)	TG(18:0_38:6)	Triacylglycerols	Flow injection analysis
TG(18:0_38:7)	TG(18:0_38:7)	Triacylglycerols	Flow injection analysis
TG(18:1_26:0)	TG(18:1_26:0)	Triacylglycerols	Flow injection analysis
TG(18:1_28:1)	TG(18:1_28:1)	Triacylglycerols	Flow injection analysis
TG(18:1_30:0)	TG(18:1_30:0)	Triacylglycerols	Flow injection analysis
TG(18:1_30:1)	TG(18:1_30:1)	Triacylglycerols	Flow injection analysis
TG(18:1_30:2)	TG(18:1_30:2)	Triacylglycerols	Flow injection analysis
TG(18:1_31:0)	TG(18:1_31:0)	Triacylglycerols	Flow injection analysis
TG(18:1_32:0)	TG(18:1_32:0)	Triacylglycerols	Flow injection analysis
TG(18:1_32:1)	TG(18:1_32:1)	Triacylglycerols	Flow injection analysis
TG(18:1_32:2)	TG(18:1_32:2)	Triacylglycerols	Flow injection analysis
TG(18:1_32:3)	TG(18:1_32:3)	Triacylglycerols	Flow injection analysis
TG(18:1_33:0)	TG(18:1_33:0)	Triacylglycerols	Flow injection analysis
TG(18:1_33:1)	TG(18:1_33:1)	Triacylglycerols	Flow injection analysis
TG(18:1_33:2)	TG(18:1_33:2)	Triacylglycerols	Flow injection analysis
TG(18:1_33:3)	TG(18:1_33:3)	Triacylglycerols	Flow injection analysis
TG(18:1_34:1)	TG(18:1_34:1)	Triacylglycerols	Flow injection analysis
TG(18:1_34:2)	TG(18:1_34:2)	Triacylglycerols	Flow injection analysis
TG(18:1_34:3)	TG(18:1_34:3)	Triacylglycerols	Flow injection analysis
TG(18:1_34:4)	TG(18:1_34:4)	Triacylglycerols	Flow injection analysis
TG(18:1_35:2)	TG(18:1_35:2)	Triacylglycerols	Flow injection analysis
TG(18:1_35:3)	TG(18:1_35:3)	Triacylglycerols	Flow injection analysis
TG(18:1_36:0)	TG(18:1_36:0)	Triacylglycerols	Flow injection analysis
TG(18:1_36:1)	TG(18:1_36:1)	Triacylglycerols	Flow injection analysis
TG(18:1_36:2)	TG(18:1_36:2)	Triacylglycerols	Flow injection analysis
TG(18:1_36:3)	TG(18:1_36:3)	Triacylglycerols	Flow injection analysis
TG(18:1_36:4)	TG(18:1_36:4)	Triacylglycerols	Flow injection analysis
TG(18:1_36:5)	TG(18:1_36:5)	Triacylglycerols	Flow injection analysis
TG(18:1_36:6)	TG(18:1_36:6)	Triacylglycerols	Flow injection analysis
TG(18:1_38:5)	TG(18:1_38:5)	Triacylglycerols	Flow injection analysis
TG(18:1_38:6)	TG(18:1_38:6)	Triacylglycerols	Flow injection analysis
TG(18:1_38:7)	TG(18:1_38:7)	Triacylglycerols	Flow injection analysis
TG(18:2_28:0)	TG(18:2_28:0)	Triacylglycerols	Flow injection analysis
TG(18:2_30:0)	TG(18:2_30:0)	Triacylglycerols	Flow injection analysis
TG(18:2_30:1)	TG(18:2_30:1)	Triacylglycerols	Flow injection analysis
TG(18:2_31:0)	TG(18:2_31:0)	Triacylglycerols	Flow injection analysis
TG(18:2_32:0)	TG(18:2_32:0)	Triacylglycerols	Flow injection analysis
TG(18:2_32:1)	TG(18:2_32:1)	Triacylglycerols	Flow injection analysis
TG(18:2_32:2)	TG(18:2_32:2)	Triacylglycerols	Flow injection analysis
TG(18:2_33:0)	TG(18:2_33:0)	Triacylglycerols	Flow injection analysis
TG(18:2_33:1)	TG(18:2_33:1)	Triacylglycerols	Flow injection analysis
TG(18:2_33:2)	TG(18:2_33:2)	Triacylglycerols	Flow injection analysis
TG(18:2_34:0)	TG(18:2_34:0)	Triacylglycerols	Flow injection analysis
TG(18:2_34:1)	TG(18:2_34:1)	Triacylglycerols	Flow injection analysis
TG(18:2_34:2)	TG(18:2_34:2)	Triacylglycerols	Flow injection analysis
TG(18:2_34:3)	TG(18:2_34:3)	Triacylglycerols	Flow injection analysis
TG(18:2_34:4)	TG(18:2_34:4)	Triacylglycerols	Flow injection analysis
TG(18:2_35:1)	TG(18:2_35:1)	Triacylglycerols	Flow injection analysis
TG(18:2_35:2)	TG(18:2_35:2)	Triacylglycerols	Flow injection analysis
TG(18:2_35:3)	TG(18:2_35:3)	Triacylglycerols	Flow injection analysis
TG(18:2_36:0)	TG(18:2_36:0)	Triacylglycerols	Flow injection analysis
TG(18:2_36:1)	TG(18:2_36:1)	Triacylglycerols	Flow injection analysis
TG(18:2_36:2)	TG(18:2_36:2)	Triacylglycerols	Flow injection analysis
TG(18:2_36:3)	TG(18:2_36:3)	Triacylglycerols	Flow injection analysis
TG(18:2_36:4)	TG(18:2_36:4)	Triacylglycerols	Flow injection analysis
TG(18:2_36:5)	TG(18:2_36:5)	Triacylglycerols	Flow injection analysis
TG(18:2_38:4)	TG(18:2_38:4)	Triacylglycerols	Flow injection analysis
TG(18:2_38:5)	TG(18:2_38:5)	Triacylglycerols	Flow injection analysis
TG(18:2_38:6)	TG(18:2_38:6)	Triacylglycerols	Flow injection analysis
TG(18:3_30:0)	TG(18:3_30:0)	Triacylglycerols	Flow injection analysis
TG(18:3_32:0)	TG(18:3_32:0)	Triacylglycerols	Flow injection analysis
TG(18:3_32:1)	TG(18:3_32:1)	Triacylglycerols	Flow injection analysis
TG(18:3_33:2)	TG(18:3_33:2)	Triacylglycerols	Flow injection analysis
TG(18:3_34:0)	TG(18:3_34:0)	Triacylglycerols	Flow injection analysis
TG(18:3_34:1)	TG(18:3_34:1)	Triacylglycerols	Flow injection analysis
TG(18:3_34:2)	TG(18:3_34:2)	Triacylglycerols	Flow injection analysis
TG(18:3_34:3)	TG(18:3_34:3)	Triacylglycerols	Flow injection analysis
TG(18:3_35:2)	TG(18:3_35:2)	Triacylglycerols	Flow injection analysis
TG(18:3_36:1)	TG(18:3_36:1)	Triacylglycerols	Flow injection analysis
TG(18:3_36:2)	TG(18:3_36:2)	Triacylglycerols	Flow injection analysis
TG(18:3_36:3)	TG(18:3_36:3)	Triacylglycerols	Flow injection analysis
TG(18:3_36:4)	TG(18:3_36:4)	Triacylglycerols	Flow injection analysis
TG(18:3_38:5)	TG(18:3_38:5)	Triacylglycerols	Flow injection analysis
TG(18:3_38:6)	TG(18:3_38:6)	Triacylglycerols	Flow injection analysis
TG(20:0_32:3)	TG(20:0_32:3)	Triacylglycerols	Flow injection analysis
TG(20:0_32:4)	TG(20:0_32:4)	Triacylglycerols	Flow injection analysis
TG(20:0_34:1)	TG(20:0_34:1)	Triacylglycerols	Flow injection analysis
TG(20:1_24:3)	TG(20:1_24:3)	Triacylglycerols	Flow injection analysis
TG(20:1_26:1)	TG(20:1_26:1)	Triacylglycerols	Flow injection analysis
TG(20:1_30:1)	TG(20:1_30:1)	Triacylglycerols	Flow injection analysis
TG(20:1_31:0)	TG(20:1_31:0)	Triacylglycerols	Flow injection analysis
TG(20:1_32:1)	TG(20:1_32:1)	Triacylglycerols	Flow injection analysis
TG(20:1_32:2)	TG(20:1_32:2)	Triacylglycerols	Flow injection analysis
TG(20:1_32:3)	TG(20:1_32:3)	Triacylglycerols	Flow injection analysis
TG(20:1_34:0)	TG(20:1_34:0)	Triacylglycerols	Flow injection analysis
TG(20:1_34:1)	TG(20:1_34:1)	Triacylglycerols	Flow injection analysis
TG(20:1_34:2)	TG(20:1_34:2)	Triacylglycerols	Flow injection analysis
TG(20:1_34:3)	TG(20:1_34:3)	Triacylglycerols	Flow injection analysis
TG(20:2_32:0)	TG(20:2_32:0)	Triacylglycerols	Flow injection analysis
TG(20:2_32:1)	TG(20:2_32:1)	Triacylglycerols	Flow injection analysis
TG(20:2_34:1)	TG(20:2_34:1)	Triacylglycerols	Flow injection analysis
TG(20:2_34:2)	TG(20:2_34:2)	Triacylglycerols	Flow injection analysis
TG(20:2_34:3)	TG(20:2_34:3)	Triacylglycerols	Flow injection analysis
TG(20:2_34:4)	TG(20:2_34:4)	Triacylglycerols	Flow injection analysis
TG(20:2_36:5)	TG(20:2_36:5)	Triacylglycerols	Flow injection analysis
TG(20:3_32:0)	TG(20:3_32:0)	Triacylglycerols	Flow injection analysis
TG(20:3_32:1)	TG(20:3_32:1)	Triacylglycerols	Flow injection analysis
TG(20:3_32:2)	TG(20:3_32:2)	Triacylglycerols	Flow injection analysis
TG(20:3_34:0)	TG(20:3_34:0)	Triacylglycerols	Flow injection analysis
TG(20:3_34:1)	TG(20:3_34:1)	Triacylglycerols	Flow injection analysis
TG(20:3_34:2)	TG(20:3_34:2)	Triacylglycerols	Flow injection analysis
TG(20:3_34:3)	TG(20:3_34:3)	Triacylglycerols	Flow injection analysis
TG(20:3_36:3)	TG(20:3_36:3)	Triacylglycerols	Flow injection analysis
TG(20:3_36:4)	TG(20:3_36:4)	Triacylglycerols	Flow injection analysis
TG(20:3_36:5)	TG(20:3_36:5)	Triacylglycerols	Flow injection analysis
TG(20:4_30:0)	TG(20:4_30:0)	Triacylglycerols	Flow injection analysis
TG(20:4_32:0)	TG(20:4_32:0)	Triacylglycerols	Flow injection analysis
TG(20:4_32:1)	TG(20:4_32:1)	Triacylglycerols	Flow injection analysis
TG(20:4_32:2)	TG(20:4_32:2)	Triacylglycerols	Flow injection analysis
TG(20:4_33:2)	TG(20:4_33:2)	Triacylglycerols	Flow injection analysis
TG(20:4_34:0)	TG(20:4_34:0)	Triacylglycerols	Flow injection analysis
TG(20:4_34:1)	TG(20:4_34:1)	Triacylglycerols	Flow injection analysis
TG(20:4_34:2)	TG(20:4_34:2)	Triacylglycerols	Flow injection analysis
TG(20:4_34:3)	TG(20:4_34:3)	Triacylglycerols	Flow injection analysis
TG(20:4_35:3)	TG(20:4_35:3)	Triacylglycerols	Flow injection analysis
TG(20:4_36:2)	TG(20:4_36:2)	Triacylglycerols	Flow injection analysis
TG(20:4_36:3)	TG(20:4_36:3)	Triacylglycerols	Flow injection analysis
TG(20:4_36:4)	TG(20:4_36:4)	Triacylglycerols	Flow injection analysis
TG(20:4_36:5)	TG(20:4_36:5)	Triacylglycerols	Flow injection analysis
TG(20:5_34:0)	TG(20:5_34:0)	Triacylglycerols	Flow injection analysis
TG(20:5_34:1)	TG(20:5_34:1)	Triacylglycerols	Flow injection analysis
TG(20:5_34:2)	TG(20:5_34:2)	Triacylglycerols	Flow injection analysis
TG(20:5_36:2)	TG(20:5_36:2)	Triacylglycerols	Flow injection analysis
TG(20:5_36:3)	TG(20:5_36:3)	Triacylglycerols	Flow injection analysis
TG(22:0_32:4)	TG(22:0_32:4)	Triacylglycerols	Flow injection analysis
TG(22:1_32:5)	TG(22:1_32:5)	Triacylglycerols	Flow injection analysis
TG(22:2_32:4)	TG(22:2_32:4)	Triacylglycerols	Flow injection analysis
TG(22:3_30:2)	TG(22:3_30:2)	Triacylglycerols	Flow injection analysis
TG(22:4_32:0)	TG(22:4_32:0)	Triacylglycerols	Flow injection analysis
TG(22:4_32:2)	TG(22:4_32:2)	Triacylglycerols	Flow injection analysis
TG(22:4_34:2)	TG(22:4_34:2)	Triacylglycerols	Flow injection analysis
TG(22:5_32:0)	TG(22:5_32:0)	Triacylglycerols	Flow injection analysis
TG(22:5_32:1)	TG(22:5_32:1)	Triacylglycerols	Flow injection analysis
TG(22:5_34:1)	TG(22:5_34:1)	Triacylglycerols	Flow injection analysis
TG(22:5_34:2)	TG(22:5_34:2)	Triacylglycerols	Flow injection analysis
TG(22:5_34:3)	TG(22:5_34:3)	Triacylglycerols	Flow injection analysis
TG(22:6_32:0)	TG(22:6_32:0)	Triacylglycerols	Flow injection analysis
TG(22:6_32:1)	TG(22:6_32:1)	Triacylglycerols	Flow injection analysis
TG(22:6_34:1)	TG(22:6_34:1)	Triacylglycerols	Flow injection analysis
TG(22:6_34:2)	TG(22:6_34:2)	Triacylglycerols	Flow injection analysis
TG(22:6_34:3)	TG(22:6_34:3)	Triacylglycerols	Flow injection analysis
METABOLITES_END
#END