#METABOLOMICS WORKBENCH YjChern_20250828_201310 DATATRACK_ID:6345 STUDY_ID:ST004164 ANALYSIS_ID:AN006913 PROJECT_ID:PR002624
VERSION             	1
CREATED_ON             	September 2, 2025, 8:11 pm
#PROJECT
PR:PROJECT_TITLE                 	Equilibrative Nucleoside Transporter 2 Modulates Inosine Catabolism to Influence
PR:PROJECT_TITLE                 	Astrocyte Metabolism and Reactivity
PR:PROJECT_SUMMARY               	Astrocytes are central regulators of brain function and exhibit diverse reactive
PR:PROJECT_SUMMARY               	states in response to injury and inflammation. Although the mechanisms
PR:PROJECT_SUMMARY               	underlying these states remain debated, cellular energy metabolism is thought to
PR:PROJECT_SUMMARY               	play a crucial role. This project aimed to define the role of equilibrative
PR:PROJECT_SUMMARY               	nucleoside transporter 2 (Ent2) in regulating astrocytic responses to
PR:PROJECT_SUMMARY               	inflammatory stimulation, with a particular focus on its function in inosine
PR:PROJECT_SUMMARY               	metabolism and energy balance. Using mouse primary astrocytes exposed to
PR:PROJECT_SUMMARY               	cytokine-induced activation, together with targeted metabolomic profiling and
PR:PROJECT_SUMMARY               	pharmacological manipulation, we examined how Ent2 activity influences purine
PR:PROJECT_SUMMARY               	metabolism and reactivity. Our findings show that inosine is an essential energy
PR:PROJECT_SUMMARY               	substrate during inflammation and that Ent2 is required to regulate inosine
PR:PROJECT_SUMMARY               	efflux and maintain ATP production. Loss of Ent2, or pharmacological inhibition
PR:PROJECT_SUMMARY               	of inosine catabolism, disrupted energy homeostasis, impaired mitochondrial
PR:PROJECT_SUMMARY               	function, and enhanced astrocytic reactivity. These results establish an
PR:PROJECT_SUMMARY               	Ent2-inosine-PNP axis as a critical pathway linking purine metabolism to
PR:PROJECT_SUMMARY               	astrocytic reactivity.
PR:INSTITUTE                     	Institute of Biomedical Sciences, Academia Sinica
PR:LAST_NAME                     	Chern
PR:FIRST_NAME                    	Yijuang
PR:ADDRESS                       	128 Section 2, Academia Road, Nankang, Taipei, 115201, Taiwan
PR:EMAIL                         	bmychern@ibms.sinica.edu.tw
PR:PHONE                         	+886-2-2652-3913
#STUDY
ST:STUDY_TITLE                   	Equilibrative Nucleoside Transporter 2 Modulates Inosine Catabolism to Influence
ST:STUDY_TITLE                   	Astrocyte Metabolism and Reactivity
ST:STUDY_SUMMARY                 	In this study, we demonstrate that inosine functions as an essential energy
ST:STUDY_SUMMARY                 	substrate for astrocytes under inflammatory conditions. Targeted metabolomic
ST:STUDY_SUMMARY                 	datasets were generated from mouse primary astrocytes after 24 hours of cytokine
ST:STUDY_SUMMARY                 	cocktail treatment. Metabolomic profiling, combined with pharmacological
ST:STUDY_SUMMARY                 	approaches, revealed that Ent2 regulates inosine efflux and is critical for
ST:STUDY_SUMMARY                 	maintaining astrocytic energy balance. Pharmacological inhibition of inosine
ST:STUDY_SUMMARY                 	utilization in energy-producing pathways with Forodesine led to disrupted energy
ST:STUDY_SUMMARY                 	homeostasis and increased astrocytic reactivity. The datasets include both raw
ST:STUDY_SUMMARY                 	and processed metabolomic files. Metabolomic analyses were performed at the
ST:STUDY_SUMMARY                 	Metabolomics Core Facility, Agricultural Biotechnology Research Center, Academia
ST:STUDY_SUMMARY                 	Sinica, Taipei, Taiwan.
ST:INSTITUTE                     	Institute of Biomedical Sciences, Academia Sinica
ST:LAST_NAME                     	Chern
ST:FIRST_NAME                    	Yijuang
ST:ADDRESS                       	128 Section 2, Academia Road, Nankang, Taipei, 115201, Taiwan
ST:EMAIL                         	bmychern@ibms.sinica.edu.tw
ST:PHONE                         	+886-2-26523913
#SUBJECT
SU:SUBJECT_TYPE                  	Cultured cells
SU:SUBJECT_SPECIES               	Mus musculus
SU:TAXONOMY_ID                   	10090
#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           	WT_1_Ctrl	WT_1_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=WT_1_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	WT_2_Ctrl	WT_2_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=WT_2_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	WT_3_Ctrl	WT_3_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=WT_3_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	WT_4_Ctrl	WT_4_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=WT_4_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	WT_5_Ctrl	WT_5_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=WT_5_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	WT_6_Ctrl	WT_6_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=WT_6_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	WT_1_Cytokine	WT_1_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=WT_1_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	WT_2_Cytokine	WT_2_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=WT_2_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	WT_3_Cytokine	WT_3_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=WT_3_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	WT_4_Cytokine	WT_4_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=WT_4_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	WT_5_Cytokine	WT_5_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=WT_5_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	WT_6_Cytokine	WT_6_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=WT_6_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	WT_7_Cytokine	WT_7_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=WT_7_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	WT_1_CytokinePlusForo	WT_1_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰/Forodesine	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=WT_1_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	WT_2_CytokinePlusForo	WT_2_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-2𝝰/Forodesine	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=WT_2_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	WT_3_CytokinePlusForo	WT_3_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-3𝝰/Forodesine	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=WT_3_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	WT_4_CytokinePlusForo	WT_4_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-4𝝰/Forodesine	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=WT_4_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	WT_5_CytokinePlusForo	WT_5_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-5𝝰/Forodesine	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=WT_5_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	WT_6_CytokinePlusForo	WT_6_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-6𝝰/Forodesine	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=WT_6_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	WT_7_CytokinePlusForo	WT_7_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-7𝝰/Forodesine	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=WT_7_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	KO_1_Ctrl	KO_1_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent2 knockout | treatment:Vehicle	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=KO_1_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	KO_2_Ctrl	KO_2_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent3 knockout | treatment:Vehicle	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=KO_2_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	KO_3_Ctrl	KO_3_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent4 knockout | treatment:Vehicle	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=KO_3_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	KO_4_Ctrl	KO_4_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent5 knockout | treatment:Vehicle	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=KO_4_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	KO_5_Ctrl	KO_5_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent6 knockout | treatment:Vehicle	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=KO_5_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	KO_6_Ctrl	KO_6_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent7 knockout | treatment:Vehicle	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=KO_6_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	KO_1_Cytokine	KO_1_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent8 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=KO_1_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	KO_2_Cytokine	KO_2_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent9 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=KO_2_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	KO_3_Cytokine	KO_3_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent10 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=KO_3_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	KO_4_Cytokine	KO_4_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent11 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=KO_4_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	KO_5_Cytokine	KO_5_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent12 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=KO_5_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	KO_6_Cytokine	KO_6_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent13 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=KO_6_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	KO_7_Cytokine	KO_7_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent14 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=KO_7_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	KO_1_CytokinePlusForo	KO_1_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent15 knockout | treatment:TNF𝝰/IL-1𝝰/Forodesine	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=KO_1_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	KO_2_CytokinePlusForo	KO_2_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent16 knockout | treatment:TNF𝝰/IL-2𝝰/Forodesine	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=KO_2_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	KO_3_CytokinePlusForo	KO_3_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent17 knockout | treatment:TNF𝝰/IL-3𝝰/Forodesine	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=KO_3_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	KO_4_CytokinePlusForo	KO_4_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent18 knockout | treatment:TNF𝝰/IL-4𝝰/Forodesine	Batch=B1; MS_ion Mode=negative; RAW_FILE_NAME=KO_4_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	KO_5_CytokinePlusForo	KO_5_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent19 knockout | treatment:TNF𝝰/IL-5𝝰/Forodesine	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=KO_5_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	KO_6_CytokinePlusForo	KO_6_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent20 knockout | treatment:TNF𝝰/IL-6𝝰/Forodesine	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=KO_6_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	KO_7_CytokinePlusForo	KO_7_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent21 knockout | treatment:TNF𝝰/IL-7𝝰/Forodesine	Batch=B2; MS_ion Mode=negative; RAW_FILE_NAME=KO_7_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_1_Ctrl	p_WT_1_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_1_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_2_Ctrl	p_WT_2_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_2_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_3_Ctrl	p_WT_3_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_3_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_4_Ctrl	p_WT_4_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_4_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_5_Ctrl	p_WT_5_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_5_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_6_Ctrl	p_WT_6_Ctrl	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_6_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_1_Cytokine	p_WT_1_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_1_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_2_Cytokine	p_WT_2_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_2_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_3_Cytokine	p_WT_3_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_3_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_4_Cytokine	p_WT_4_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_4_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_5_Cytokine	p_WT_5_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_5_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_6_Cytokine	p_WT_6_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_6_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_7_Cytokine	p_WT_7_Cytokine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_7_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_1_CytokinePlusForo	p_WT_1_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰/Forodesine	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_1_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_2_CytokinePlusForo	p_WT_2_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-2𝝰/Forodesine	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_2_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_3_CytokinePlusForo	p_WT_3_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-3𝝰/Forodesine	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_3_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_4_CytokinePlusForo	p_WT_4_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-4𝝰/Forodesine	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_4_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_5_CytokinePlusForo	p_WT_5_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-5𝝰/Forodesine	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_5_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_6_CytokinePlusForo	p_WT_6_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-6𝝰/Forodesine	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_6_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_WT_7_CytokinePlusForo	p_WT_7_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-7𝝰/Forodesine	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_WT_7_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_1_Ctrl	p_KO_1_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent2 knockout | treatment:Vehicle	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_1_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_2_Ctrl	p_KO_2_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent3 knockout | treatment:Vehicle	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_2_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_3_Ctrl	p_KO_3_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent4 knockout | treatment:Vehicle	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_3_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_4_Ctrl	p_KO_4_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent5 knockout | treatment:Vehicle	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_4_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_5_Ctrl	p_KO_5_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent6 knockout | treatment:Vehicle	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_5_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_6_Ctrl	p_KO_6_Ctrl	Sample source:mouse primary astrocytes | Genotype:Ent7 knockout | treatment:Vehicle	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_6_Ctrl.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_1_Cytokine	p_KO_1_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent8 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_1_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_2_Cytokine	p_KO_2_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent9 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_2_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_3_Cytokine	p_KO_3_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent10 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_3_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_4_Cytokine	p_KO_4_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent11 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_4_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_5_Cytokine	p_KO_5_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent12 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_5_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_6_Cytokine	p_KO_6_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent13 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_6_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_7_Cytokine	p_KO_7_Cytokine	Sample source:mouse primary astrocytes | Genotype:Ent14 knockout | treatment:TNF𝝰/IL-1𝝰	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_7_Cytokine.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_1_CytokinePlusForo	p_KO_1_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent15 knockout | treatment:TNF𝝰/IL-1𝝰/Forodesine	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_1_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_2_CytokinePlusForo	p_KO_2_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent16 knockout | treatment:TNF𝝰/IL-2𝝰/Forodesine	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_2_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_3_CytokinePlusForo	p_KO_3_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent17 knockout | treatment:TNF𝝰/IL-3𝝰/Forodesine	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_3_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_4_CytokinePlusForo	p_KO_4_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent18 knockout | treatment:TNF𝝰/IL-4𝝰/Forodesine	Batch=B1; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_4_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_5_CytokinePlusForo	p_KO_5_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent19 knockout | treatment:TNF𝝰/IL-5𝝰/Forodesine	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_5_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_6_CytokinePlusForo	p_KO_6_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent20 knockout | treatment:TNF𝝰/IL-6𝝰/Forodesine	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_6_CytokinePlusForo.mzML
SUBJECT_SAMPLE_FACTORS           	p_KO_7_CytokinePlusForo	p_KO_7_CytokinePlusForo	Sample source:mouse primary astrocytes | Genotype:Ent21 knockout | treatment:TNF𝝰/IL-7𝝰/Forodesine	Batch=B2; MS_ion Mode=positive; RAW_FILE_NAME=p_KO_7_CytokinePlusForo.mzML
#COLLECTION
CO:COLLECTION_SUMMARY            	Primary astrocytes were isolated from the brains of wild-type or ENT2-/- mice at
CO:COLLECTION_SUMMARY            	postnatal day 1 (P1). On DIV27, cells were stimulated with a cytokine cocktail,
CO:COLLECTION_SUMMARY            	and metabolites were extracted on DIV28 using 0.6N perchloric acid (PCA).
CO:COLLECTION_PROTOCOL_FILENAME  	culture_and_collection_protocol.pdf
CO:SAMPLE_TYPE                   	Astrocyte cells
#TREATMENT
TR:TREATMENT_SUMMARY             	Ent2+/+ and Ent2-/- primary astrocytes were treated on DIV27 with TNFα (30
TR:TREATMENT_SUMMARY             	ng/mL) and IL-1α (3 ng/mL) for 24 hours to induce activation. To inhibit PNP
TR:TREATMENT_SUMMARY             	activity, Forodesine (2 μM) was applied simultaneously with cytokine treatment.
TR:TREATMENT_PROTOCOL_FILENAME   	Treatment_protocol_24h.pdf
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Primary astrocytes were washed, digested, and subjected to metabolite extraction
SP:SAMPLEPREP_SUMMARY            	using 0.6 N perchloric acid (PCA), followed by neutralization with K₂CO₃.
SP:SAMPLEPREP_SUMMARY            	The clarified supernatants were collected and used for metabolomic profiling.
SP:SAMPLEPREP_SUMMARY            	The remaining protein pellets were processed separately and retained for
SP:SAMPLEPREP_SUMMARY            	concentration measurement.
SP:SAMPLEPREP_PROTOCOL_FILENAME  	PCA_extraction.pdf
SP:EXTRACT_STORAGE               	-80℃
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	HILIC
CH:INSTRUMENT_NAME               	Agilent 1290 Infinity II UPLC system
CH:COLUMN_NAME                   	ACQUITY UPLC BEH Amide (100 x 2.1 mm, 1.7 μm)
CH:SOLVENT_A                     	100% Double-distilled Water; 15 mM ammonium acetate; 0.3% Ammonium hydroxide
CH:SOLVENT_B                     	90% Acetonitrile/10% Double-distilled Water; 15 mM ammonium acetate; 0.3% Ammonium hydroxide
CH:FLOW_GRADIENT                 	0–8 min, 90-50% B; 8–10 min, 50% B; 10–11 min, 50–90% B; 11–16 min,
CH:FLOW_GRADIENT                 	90% B. (amide column)
CH:FLOW_RATE                     	0.3 mL/min
CH:COLUMN_TEMPERATURE            	40℃
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:ANALYSIS_PROTOCOL_FILE        	UPLC-MS-protocol.pdf
#MS
MS:INSTRUMENT_NAME               	Agilent 6545XT QTOF
MS:INSTRUMENT_TYPE               	QTOF
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	NEGATIVE
MS:MS_COMMENTS                   	Data were acquired in both positive and negative full-scan modes (m/z
MS:MS_COMMENTS                   	60–1500), processed using Agilent Qualitative Analysis 10.0 and Profinder
MS:MS_COMMENTS                   	B.10.00 software, and quantified based on peak area across treatments.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	ion counts
MS_METABOLITE_DATA_START
Samples	WT_1_Ctrl	WT_2_Ctrl	WT_3_Ctrl	WT_4_Ctrl	WT_5_Ctrl	WT_6_Ctrl	KO_1_Ctrl	KO_2_Ctrl	KO_3_Ctrl	KO_4_Ctrl	KO_5_Ctrl	KO_6_Ctrl	WT_1_Cytokine	WT_2_Cytokine	WT_3_Cytokine	WT_4_Cytokine	WT_5_Cytokine	WT_6_Cytokine	WT_7_Cytokine	KO_1_Cytokine	KO_2_Cytokine	KO_3_Cytokine	KO_4_Cytokine	KO_5_Cytokine	KO_6_Cytokine	KO_7_Cytokine	WT_1_CytokinePlusForo	WT_2_CytokinePlusForo	WT_3_CytokinePlusForo	WT_4_CytokinePlusForo	WT_5_CytokinePlusForo	WT_6_CytokinePlusForo	WT_7_CytokinePlusForo	KO_1_CytokinePlusForo	KO_2_CytokinePlusForo	KO_3_CytokinePlusForo	KO_4_CytokinePlusForo	KO_5_CytokinePlusForo	KO_6_CytokinePlusForo	KO_7_CytokinePlusForo																																											
Factors	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Ent2 knockout | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Ent3 knockout | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Ent4 knockout | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Ent5 knockout | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Ent6 knockout | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Ent7 knockout | treatment:Vehicle	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Ent8 knockout | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Ent9 knockout | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Ent10 knockout | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Ent11 knockout | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Ent12 knockout | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Ent13 knockout | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Ent14 knockout | treatment:TNF𝝰/IL-1𝝰	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-1𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-2𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-3𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-4𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-5𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-6𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Wild-type | treatment:TNF𝝰/IL-7𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Ent15 knockout | treatment:TNF𝝰/IL-1𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Ent16 knockout | treatment:TNF𝝰/IL-2𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Ent17 knockout | treatment:TNF𝝰/IL-3𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Ent18 knockout | treatment:TNF𝝰/IL-4𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Ent19 knockout | treatment:TNF𝝰/IL-5𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Ent20 knockout | treatment:TNF𝝰/IL-6𝝰/Forodesine	Sample source:mouse primary astrocytes | Genotype:Ent21 knockout | treatment:TNF𝝰/IL-7𝝰/Forodesine
Total protein	238.6	279.2	279.2	279.2	286	245.4	245.4	326.4	292.6	238.6	428	272.4	340	319.8	286	279.2	292.6	299.4	258.8	326.4	292.6	286	380.6	279.2	245.4	204.8	313	286	286	265.6	286	313	482	373.8	265.6	286	292.6	326.4	340	279.2																																											
Fenclonine (IS)	42350	56665	50568	45674	42896	47375	47588	42220	45299	32683	34254	33098	57776	35086	53022	45630	45042	44186	41486	43074	32978	49393	36263	35539	33058	33704	42577	37435	36170	48954	39314	38638	37434	43977	45804	42255	41153	29117	32331	28619																																											
2,3-BPG																																																																																			
2-HG	2869	2425	2669	2494	2977	2837	5157	3861	7375	3745	5624	3879	3408	2508	2607	2101	2015	2669	2376	4110	4960	5956	2694	4550	3494	3099	2365	2418	2367	4116	2745	3019	1635	4418	4063	4057	4009	2650	2918	3279																																											
2-PG	3799	5073	4237	5048	4939	5697	4808	4423	4466	3770	3888	3966	4266	3468	3988	5413	4549	4762	5014	4591	3846	3801	3737	4241	4893	4239	4719	5148	3571	5303	5422	5115	5201	4023	4053	3953	4020	3744	4025	3752																																											
3-PG	3702	5109	4208	7565	6064	7458	3188	3072	2217	4078	3943	4332	3666	4291	3955	6597	5644	5874	6059	2813	2203	1841	3383	3637	3620	4194	4436	4828	3397	4090	6023	5356	5023	2454	2808	1573	1505	3375	3142	3051																																											
6PG																																																																																			
Ala	4936	4467	4419	4560	5889	5869	8165	6596	9055	7126	9895	7646	6575	5513	5349	5311	5207	7295	6252	7235	7579	10284	9018	9734	7930	7541	3925	4117	5427	6670	6942	5821	5456	7257	6146	8642	8117	7375	7293	8335																																											
alpha-KG																																																																																			
Arg	1236	1154	1377	2257	1848	2119	3309	3364	3128	2436	2883	2371	805		593	629	1611	1163	874	561	1172	1431	1116	1115	1492	1007				659	921	819	931	1215	832	1698	1324	1299	1255	740																																											
Asn		656	543		712	640	2117	1109	1848	1068	1383	822	1515	978	1287	563	747	1275	1310	2402	2502	2957	1791	1921	1375	1347	801	732	739	1835	1156	956	964	2355	1672	1997	1376	1439	1510	1530																																											
Asp	23945	26196	27760	33812	31298	37396	44813	39982	45023	33779	38074	33035	38542	33123	33019	29647	31303	41985	40355	39057	42192	45690	31687	34169	32562	30689	16274	24592	23030	33433	29882	28047	26233	33434	31585	37418	30800	26824	31107	34632																																											
Aconitic acid																																																																																			
Citrate	193457	218911	228043	248817	246050	274165	344353	306507	353413	294301	338301	334096	246903	188894	209836	231530	226659	270663	271373	398336	381624	470786	363065	383168	388012	391898	204135	239838	212781	312244	333997	296915	283288	372968	335904	409219	377936	339688	377203	390486																																											
Cys																																																																																			
Cystine																																																																																			
DHAP																																																																																			
dTMP																																																																																			
E4P																																																																																			
F16BP																																																																																			
F6P / G1P		2633	3577	1091	761	892	2993	4717	3243	1052	878	816	1988	1001	867	887	714	699	917	4616	678	6590	1979	986	1572	1114	619	2579	1053	4090	1162	685	783	2346	1638	1056	4589	693		962																																											
Hypoxanthine	260457	472052	564042	490799	562723	649290	2040245	1883737	2154337	1832599	1843487	1908735	815655	594207	981655	1028615	891849	1160873	1117682	2567167	2433077	3061455	2656257	3267575	2581558	2519172	767278	909566	585044	1102577	1241075	1053624	905893	1490193	1418260	1685635	1538088	1151062	1365304	1508225																																											
Fumarate																																																																																			
G6P				588		542	588			562	1120	846						789		641		840	762	878	623						942	823	665			525			675	805																																											
GAP(G3P)																																																																																			
Glc																																																																																			
Gln	25886	26716	30056	36606	45620	40048	57443	46748	66299	70935	79370	59403	53405	33334	44460	57018	48380	68087	47407	72214	67168	89179	92770	106520	77276	58121	31982	32419	33617	46641	54837	51974	39517	76922	63682	75564	65988	93898	94168	70088																																											
Glu	41478	44034	55668	59146	55290	66878	87969	74910	97360	73126	82902	75528	85453	67048	76332	61316	64048	79658	81419	104062	102148	118389	91694	101833	89671	89358	66532	72578	72074	92771	83587	90664	78813	104870	94107	98436	90065	76995	90099	98468																																											
Gly	5258	5595	6676	7901	7901	8750	14497	11186	14853	11412	19181	11389	10029	6378	8850	8049	10164	12071	9590	15057	14645	17387	14092	16065	16583	11318	6907	7003	5948	12124	10491	9217	8323	13643	12545	14383	12980	12255	13648	12769																																											
His																																																																																			
Ile	7586	8778	10122	9977	9632	9624	17956	14536	16137	11808	21309	12852	10847	7513	10048	10059	11828	11459	9561	11746	10571	13720	9337	10440	14499	9370	7020	8602	6209	12541	9946	9139	8122	11697	10970	12392	11548	8438	8646	8345																																											
IMP	20459	21759	26755	27413	26371	30807	48827	38967	48711	41304	46747	49642	45115	22098	39177	36894	27546	42406	41226	45754	44474	71099	62809	66828	59963	46218	78609	76328	51313	88882	98565	89410	78272	72384	63766	91682	79917	59779	73598	72319																																											
Inosine							1467	813	1575	2360	2018	2388								4949	5316	6598	4922	8254	4720	4046	6072	7887	4302	9478	11339	9217	8551	31872	28479	28089	30621	31477	33449	29842																																											
Inositol	209795	249362	248053	261971	232432	267646	379990	300302	300549	248492	318280	311877	326887	260952	283210	217746	208981	315707	306166	404555	389143	387622	309464	387885	340849	268026	221254	287761	239622	323149	298866	307726	276889	370754	331028	327647	288054	262169	318677	300584																																											
Lactate	5400	2182	1990	5126	2437	4564	4589	3289	4392	4216	70654	5580	2485	5489	2181	4163	49724	4681	3353	3644	6806	5802	8781	5727	54587	15942	2338	1957	4660	3323	4508	4980	3812	5503	5623	6249	5616	5359	5853	6881																																											
Leu	7015	8074	8961	8751	9165	10058	14647	12538	14721	13555	23499	13320	9874	7298	9086	8575	10142	11178	10639	10498	11292	14498	12795	14155	15512	10234	5928	6993	6345	11271	10499	9540	9285	12282	11692	13233	11973	9199	10926	10981																																											
Lys	7261	7205	8197	13359	13700	14598	15015	13786	14190	17568	24511	18179	5275	3083	4654	6879	7877	8913	7801	6452	6598	8682	10719	11809	11447	8566	3836	4410	3277	5848	8330	7769	6991	7243	6470	7847	6960	9881	10588	9461																																											
M6P																																																																																			
Malate	16607	14662	24742	25134	22089	28093	33710	29809	52313	39369	35777	36526	16343	16316	16471	16153	19027	21667	18941	23518	27468	41092	29445	31547	26644	25791	11034	12465	17320	22401	22408	20099	16947	23043	23449	29450	27057	21071	24151	27007																																											
Met																																																																																			
OAA																																																																																			
PEP	10082	15761	10908	14146	12437	15517	10452	10837	9488	10190	10062	12173	10655	9700	9159	16344	12198	12490	13454	10091	8509	8023	9489	10375	11577	11486	12359	13472	9960	12129	14466	11406	13283	9768	9097	7323	7818	10129	11218	9429																																											
Phe	1751	1874	2410	2629	1855	2804	4431	3952	4143	3125	6843	3805	3009	2050	2238	2016	2709	2927	2537	2803	2905	3694	2888	3576	4297	2083	1047	1921	1492	3109	2516	2287	1757	3971	2617	3492	2671	2292	3132	2385																																											
Pro	5083	4584	5415	8437	4579	9204	8635	6491	8128	8643	13071	10290	6582	5733	5810	7239	8537	10889	8838	9239	10189	11509	10781	14057	12487	10654	4129	5656	5053	9191	10765	10336	8857	9150	8371	8404	8142	9609	11106	11089																																											
Pyruvate																																																																																			
R5P		586	638	1039	1162	1714	1530	880	1125	1135	1846	1086	665		718	784		1187	1009	1372	1768	1364	1496	1710	1774	1000	1052	1004	564	1559	1620	1480	1202	1497	1340	1063	958	1159	1307	996																																											
Ru5P																																																																																			
S7P																																																																																			
Ser	9756	8735	9130	10748	10412	11180	18957	14919	17347	13008	22772	13992	14776	11968	11807	10288	12370	14289	12380	19501	18824	21520	15937	17540	20462	13220	9405	9683	10184	17383	11965	11470	10050	17865	16072	17584	15135	14214	14147	13608																																											
Succinate	2579	1831	2622	3642	3789	4671	4372	3666	5648	5587	7903	6481	2826	2304	2946	4084	4292	5301	4531	4432	6190	6509	7318	8633	6909	8040	2870	2337	2645	4321	5688	5629	4581	4850	5060	5336	5291	7704	7958	8057																																											
Thr					859	545	1488	928	1449	1018	1985	1237	584			523	637	1137		953	619	1202	1288	1172	1281						641			1099	594	712	1117	542	724	680																																											
Thymidine																																																																																			
Thymine																																																																																			
Trp			506	856	748	893	2135	1139	1484	1383	2533	1423	783		665			1427	571	653	701	909	1228	608	1661			507		745	676			747	528	1143	1117		960	630																																											
Tyr	3633	4137	3689	4731	5008	5677	5823	5091	5477	5450	8315	4744	5005	3703	4576	3942	5285	5209	4174	4752	3860	4757	3451	4818	5898	3487	3117	4277	1836	5184	4166	4376	3867	4784	5659	4679	4064	4014	4005	3534																																											
UDP	1022	2362	1390	3812	2669	4010	3976	4147	4589	4202	5806	4730	2642	1162	2778	2313	3033	3513	3080	5965	2621	5077	5465	6807	6496	5317	4289	3384	3777	6191	6475	5763	5050	6771	7583	6120	5612	4251	4244	4837																																											
UMP	2714	23369	22671	17176	16472	19568	29218	29606	27877	17540	9012	16419	18803	14130	16403	13300	11706	14846	16235	27566	6153	33665	21887	17704	20630	14496	12799	20009	17347	28690	15270	14374	13805	25061	23708	21595	26281	3028	3465	3952																																											
Uracil																																																																																			
Uridine																																																																																			
UTP	6575	8204	8950	8433	8360	9027	18397	16078	16960	13513	13498	13416	10149	7693	9349	8089	7555	10328	8653	37251	47328	42349	25682	28479	25224	22101	13858	24606	14671	31069	21846	21632	17839	39779	30467	30667	30142	26290	29601	27613																																											
Val	4349	5373	5458	6312	6186	6476	9268	7881	8653	7792	13824	7660	5978	4875	5664	6240	7102	7021	6303	6721	6590	7978	6514	6970	10027	5670	815	4833	2660	7063	6322	5596	5623	6508	6274	6645	6276	5411	6211	5488																																											
Xanthine	4259	5994	7747	15328	17806	16441	19077	16220	21914	31174	27874	19204	10183	7291	12469	17198	19956	19638	19863	14023	11963	19786	23520	24650	22446	20647	7401	9118	6257	11506	17759	13644	13263	10000	8990	12667	14302	9286	9881	12207																																											
Xanthosine																																																																																			
XMP																																																																																			
Xu5P																																																																																			
Adenosine diphosphate ribose																																																																																			
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	Formula	Mass	RT	CAS ID
Total protein
Fenclonine (IS)	C9 H10 Cl N O2	199.040	1.9	14173-39-8
2,3-BPG	C3 H8 O10 P2	265.959	5.6	138-81-8
2-HG	C5 H8 O5	148.037	4.5	13095-48-2
2-PG	C3 H7 O7 P	185.993	5.6	2553-59-5
3-PG	C3 H7 O7 P	185.993	5.6	820-11-1
6PG	C6 H13 O10 P	276.025	5.7	921-62-0
Ala	C3 H7 N O2	89.047	3.7	56-41-7
alpha-KG	C5 H6 O5	146.022	3.9	328-50-7
Arg	C6 H14 N4 O2	174.111	6.1	74-79-3
Asn	C4 H8 N2 O3	132.053	4.1	70-47-3
Asp	C4 H7 N O4	133.038	4.6	56-84-8
Aconitic acid	C6 H6 O6	174.016	4.9	499-12-7
Citrate	C6 H8 O7	192.027	5.7	77-92-9
Cys	C3 H7 N O2 S	121.020	5.2	52-90-4
Cystine	C6 H12 N2 O4 S2	240.024	5.2	56-89-3
DHAP	C3 H7 O6 P	169.998	4.8	57-04-5
dTMP	C10 H15 N2 O8 P	322.057	4.5	365-07-1
E4P	C4 H9 O7 P	200.009	5.2	585-18-2
F16BP	C6 H14 O12 P2	339.996	6.2	488-69-7
F6P / G1P	C6 H13 O9 P	260.029	5.5	643-13-0 / 59-56-3
Hypoxanthine	C5 H4 N4 O	136.039	1.9	68-94-0
Fumarate	C4 H4 O4	116.011	4.1	110-17-8
G6P	C6 H13 O9 P	260.029	5.9	56-73-5
GAP(G3P)	C3 H7 O6 P	169.998	5.2	591-57-1
Glc	C6 H12 O6	180.063	3.2	50-99-7
Gln	C5 H10 N2 O3	146.069	4.0	56-85-9
Glu	C5 H9 N O4	147.053	4.5	56-86-0
Gly	C2 H5 N O2	75.032	4.1	56-40-6
His	C6 H9 N3 O2	155.070	4.4	71-00-1
Ile	C6 H13 N O2	131.095	2.4	73-32-5
IMP	C10 H13 N4 O8 P	348.046	5.4	131-99-7
Inosine	C10 H12 N4 O5	268.081	2.2	58-63-9
Inositol	C6 H12 O6	180.063	4.4	87-89-8
Lactate	C3 H6 O3	90.032	2.2	50-21-5
Leu	C6 H13 N O2	131.095	2.4	61-90-5
Lys	C6 H14 N2 O2	146.105	6.4	56-87-1
M6P	C6 H13 O9 P	260.030	5.5	3672-15-9
Malate	C4 H6 O5	134.021	4.7	6915-15-7
Met	C5 H11 N O2 S	149.051	2.5	63-68-3
OAA	C4 H4 O5	132.006	5.4	328-42-7
PEP	C3 H5 O6 P	167.982	5.6	138-08-9
Phe	C9 H11 N O2	165.079	2.2	63-91-2
Pro	C5 H9 N O2	115.063	3.1	147-85-3
Pyruvate	C3 H4 O3	88.016	1.7	127-17-3
R5P	C5 H11 O8 P	230.018	5.4	4300-28-1
Ru5P	C5 H11 O8 P	230.019	5.1	551-85-9
S7P	C7 H15 O10 P	290.040	5.4	2646-35-7
Ser	C3 H7 N O3	105.042	4.1	56-45-1
Succinate	C4 H6 O4	118.026	4.5	110-15-6
Thr	C4 H9 N O3	119.058	3.6	72-19-5
Thymidine	C10 H14 N2 O5	242.090	1.3	50-89-5
Thymine	C5 H6 N2 O2	126.043	1.3	65-71-4
Trp	C11 H12 N2 O2	204.089	2.3	73-22-3
Tyr	C9 H11 N O3	181.073	2.9	60-18-4
UDP	C9 H14 N2 O12 P2	404.001	5.7	58-98-0
UMP	C9 H13 N2 O9 P	324.035	5.3	58-97-9
Uracil	C4 H4 N2 O2	112.027	1.7	66-22-8
Uridine	C9 H12 N2 O6	244.070	2.0	58-96-8
UTP	C9 H15 N2 O15 P3	483.967	6.2	63-39-8
Val	C5 H11 N O2	117.079	2.9	72-18-4
Xanthine	C5 H4 N4 O2	152.033	2.5	69-89-6
Xanthosine	C10 H12 N4 O6	284.076	3.4	146-80-5
XMP	C10 H13 N4 O9 P	364.042	5.7	523-98-8
Xu5P	C5 H11 O8 P	230.019	5.2	60802-29-1
Adenosine diphosphate ribose	C15 H23 N5 O14 P2	559.0717	4.9
METABOLITES_END
#END