#METABOLOMICS WORKBENCH jgengatharan_20240726_093132 DATATRACK_ID:5036 STUDY_ID:ST003354 ANALYSIS_ID:AN005495 PROJECT_ID:
VERSION                          	1
CREATED_ON                       	07-30-2024
#PROJECT
#STUDY
#SUBJECT
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
#COLLECTION
#TREATMENT
#SAMPLEPREP
#CHROMATOGRAPHY
#ANALYSIS
#END

#METABOLOMICS WORKBENCH jgengatharan_20240726_093132 DATATRACK_ID:5036 STUDY_ID:ST003354 ANALYSIS_ID:AN005495 PROJECT_ID:PR002085
VERSION                          	1
CREATED_ON                       	07-30-2024
#PROJECT
PR:PROJECT_TITLE                 	Altered sphingolipid biosynthetic flux and lipoprotein trafficking contribute to
PR:PROJECT_TITLE                 	trans fat-induced atherosclerosis
PR:PROJECT_SUMMARY               	The goal of the project is to determine the role of sphingolipid metabolism in
PR:PROJECT_SUMMARY               	atherosclerosis induced by dietary trans fat. We analyzed lipid metabolites in
PR:PROJECT_SUMMARY               	Huh7 cells following various fatty acid treatments, with specific focus on cis
PR:PROJECT_SUMMARY               	and trans unsaturated fatty acids. Additionally, we analyzed lipid metabolites
PR:PROJECT_SUMMARY               	in plasma and liver of Ldlr-/- mice fed high-fat diets enriched in cis or trans
PR:PROJECT_SUMMARY               	fatty acids in the presence or absence of myriocin, a pharmacological inhibitor
PR:PROJECT_SUMMARY               	of Serine palmitoyltransferase (SPT), the initial rate-limiting enzyme of
PR:PROJECT_SUMMARY               	sphingolipid biosynthesis.
PR:INSTITUTE                     	Salk Institute for Biological Studies
PR:LAST_NAME                     	Gengatharan
PR:FIRST_NAME                    	Jivani
PR:ADDRESS                       	10010 N Torrey Pines Rd, La Jolla, CA, 92037, USA
PR:EMAIL                         	jivani14@gmail.com
PR:PHONE                         	(858) 453-4100
PR:DOI                           	http://dx.doi.org/10.21228/M83R6P
#STUDY
ST:STUDY_TITLE                   	Incorporation of co-treated oleate-d9 and elaidate-d17 in long-chain base of
ST:STUDY_TITLE                   	sphingolipids in Huh7 cells.
ST:STUDY_SUMMARY                 	We analyzed hydrolyzed long-chain bases (LCBs) in Huh7 cells treated with a
ST:STUDY_SUMMARY                 	combination of BSA-oleate-d9 and BSA-elaidate-d17. We aimed to confirm the
ST:STUDY_SUMMARY                 	incorporation of oleate and elaidate in the LCB of sphingolipids using their
ST:STUDY_SUMMARY                 	deuterated versions and put them both in direct competition for SPT.
ST:INSTITUTE                     	Salk Institute for Biological Studies
ST:LAST_NAME                     	Gengatharan
ST:FIRST_NAME                    	Jivani
ST:ADDRESS                       	10010 N Torrey Pines Rd, La Jolla, CA, 92037, USA
ST:EMAIL                         	jivani14@gmail.com
ST:PHONE                         	(858) 453-4100
ST:SUBMIT_DATE                   	2024-07-26
#SUBJECT
SU:SUBJECT_TYPE                  	Cultured cells
SU:SUBJECT_SPECIES               	Homo sapiens
SU:TAXONOMY_ID                   	9606
SU:CELL_STRAIN_DETAILS           	Huh7
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	-	Huh7_oleated9elaidated17_1	Sample source:Huh7 cells | Treatment:BSA-oleate-d9 + BSA-elaidate-d17	RAW_FILE_NAME(Raw file name)=Huh7_oleated9elaidated17_1.d
SUBJECT_SAMPLE_FACTORS           	-	Huh7_oleated9elaidated17_2	Sample source:Huh7 cells | Treatment:BSA-oleate-d9 + BSA-elaidate-d17	RAW_FILE_NAME(Raw file name)=Huh7_oleated9elaidated17_2.d
SUBJECT_SAMPLE_FACTORS           	-	Huh7_oleated9elaidated17_3	Sample source:Huh7 cells | Treatment:BSA-oleate-d9 + BSA-elaidate-d17	RAW_FILE_NAME(Raw file name)=Huh7_oleated9elaidated17_3.d
#COLLECTION
CO:COLLECTION_SUMMARY            	Cells (~400,000) were spiked with internal standards sphinganine-d7 (Avanti
CO:COLLECTION_SUMMARY            	Polar Lipids, Cat# 860658) and sphingosine-d7 (Avanti Polar Lipids, Cat# 860657)
CO:COLLECTION_SUMMARY            	and were scraped with 0.5 mL methanol.
CO:SAMPLE_TYPE                   	Cultured cells
#TREATMENT
TR:TREATMENT_SUMMARY             	Huh7 cells were treated with a combination of 50 µM BSA-oleate-d9 and 50 µM
TR:TREATMENT_SUMMARY             	BSA-elaidate-d17 for 48 hours in delipidated media.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Cells (~400,000) were spiked with internal standards sphinganine-d7 (Avanti
SP:SAMPLEPREP_SUMMARY            	Polar Lipids, Cat# 860658) and sphingosine-d7 (Avanti Polar Lipids, Cat# 860657)
SP:SAMPLEPREP_SUMMARY            	and were scraped with 0.5 mL methanol. Homogenate aliquot of 50 µL was taken to
SP:SAMPLEPREP_SUMMARY            	determine protein content using the BCA protein assay (Thermo Fisher
SP:SAMPLEPREP_SUMMARY            	Scientific). Samples were placed on a mixer for 1 hr at 37°C and then
SP:SAMPLEPREP_SUMMARY            	centrifuged for 5 min at 16,000g. The MeOH was supernatant transferred to a new
SP:SAMPLEPREP_SUMMARY            	Eppendorf tube and hydrolyzed for 16 hr at 65°C. 100 µL 10M KOH, 625 µL
SP:SAMPLEPREP_SUMMARY            	chloroform, 100 µL 2N NH4OH, and 500 µL alkaline water were added to samples
SP:SAMPLEPREP_SUMMARY            	followed by vortexing for 5 min and centrifugation for 5 min at 16,000g. The
SP:SAMPLEPREP_SUMMARY            	lower organic phase was washed 3 times with alkaline water and dried under air.
SP:SAMPLEPREP_SUMMARY            	After dried extracts were resuspended in 60 µl Buffer B, 5 µL of sample was
SP:SAMPLEPREP_SUMMARY            	injected.
#CHROMATOGRAPHY
CH:INSTRUMENT_NAME               	Agilent 1260 Infinity II
CH:COLUMN_NAME                   	Thermo Hypersil GOLD C18 Selectivity (100 x 2.1 mm, 1.9 µm)
CH:COLUMN_TEMPERATURE            	40°C
CH:FLOW_GRADIENT                 	0 min, 40%B; 0.5 min, 40%B; 16 min, 100%B; 25.5 min, 100%B; 26 min, 40%B
CH:FLOW_RATE                     	0.2 mL/min
CH:SOLVENT_A                     	60% methanol/40% water; 0.1% formic acid; 5 mM ammonium formate
CH:SOLVENT_B                     	100% methanol; 0.1% formic acid; 5 mM ammonium formate
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Agilent 6460 QQQ
MS:INSTRUMENT_TYPE               	Triple quadrupole
MS:MS_TYPE                       	ESI
MS:MS_COMMENTS                   	Long-chain base (LCB) species were analyzed by multiple reaction monitoring of
MS:MS_COMMENTS                   	the transition from precursor to product ions at associated optimized collision
MS:MS_COMMENTS                   	energies, and fragmentor voltages using Agilent Masshunter. The m/z values of
MS:MS_COMMENTS                   	the precursor and product ions are provided in the metabolite metadata section.
MS:ION_MODE                      	POSITIVE
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS         	Peak area
MS_METABOLITE_DATA_START
Samples	Huh7_oleated9elaidated17_1	Huh7_oleated9elaidated17_2	Huh7_oleated9elaidated17_3
Factors	Sample source:Huh7 cells | Treatment:BSA-oleate-d9 + BSA-elaidate-d17	Sample source:Huh7 cells | Treatment:BSA-oleate-d9 + BSA-elaidate-d17	Sample source:Huh7 cells | Treatment:BSA-oleate-d9 + BSA-elaidate-d17	
SA d18:0 d7	88652.0000	63277.0000	63481.0000
SA d20:1-d17	60081.0000	43025.0000	42070.0000
SA d20:1-d9	2647.0000	3100.0000	2473.0000
SO d18:1 d7	887646.0000	693947.0000	672659.0000
SO d20:2-d17	525415.0000	399006.0000	381920.0000
SO d20:2-d9	11749.0000	4988.0000	5532.0000
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	pubchem_id	inchi_key	kegg_id	other_id	other_id_type	ri	ri_type	moverz_quant	
SA d18:0 d7									
SA d20:1-d17									
SA d20:1-d9									
SO d18:1 d7									
SO d20:2-d17									
SO d20:2-d9									
METABOLITES_END
#END