#METABOLOMICS WORKBENCH cararolopes_20250320_111148 DATATRACK_ID:5759 STUDY_ID:ST003893 ANALYSIS_ID:AN006395 PROJECT_ID:PR002436 VERSION 1 CREATED_ON April 29, 2025, 9:45 pm #PROJECT PR:PROJECT_TITLE Respiration defects limit serine synthesis required for lung cancer growth and PR:PROJECT_TITLE survival PR:PROJECT_SUMMARY Mitochondrial function supports energy and anabolic metabolism. Pathogenic PR:PROJECT_SUMMARY mitochondrial DNA (mtDNA) mutations impair these processes, causing PR:PROJECT_SUMMARY mitochondrial diseases. Their role in human cancers is less clear; while some PR:PROJECT_SUMMARY cancers harbor high mtDNA mutation burden, others do not. Here we show that a PR:PROJECT_SUMMARY proofreading mutant of DNA polymerase gamma (PolGD256A) increases the mtDNA PR:PROJECT_SUMMARY mutation burden in non-small-cell lung cancer (NSCLC). This mutation promotes PR:PROJECT_SUMMARY the accumulation of defective mitochondria, reduces tumor cell proliferation and PR:PROJECT_SUMMARY viability, and improves cancer survival. In NSCLC, pathogenic mtDNA mutations PR:PROJECT_SUMMARY enhance glycolysis and create a glucose dependency to support mitochondrial PR:PROJECT_SUMMARY energy, but at the expense of a lower NAD⁺/NADH ratio that hinders de novo PR:PROJECT_SUMMARY serine synthesis. Thus, mitochondrial function in NSCLC is essential for PR:PROJECT_SUMMARY maintaining adequate serine synthesis, which in turn supports the anabolic PR:PROJECT_SUMMARY metabolism and redox homeostasis required for tumor growth, explaining why these PR:PROJECT_SUMMARY cancers preserve functional mtDNA. PR:INSTITUTE Rutgers University PR:DEPARTMENT Rutgers Cancer Institute PR:LABORATORY Eileen White PR:LAST_NAME Cararo Lopes PR:FIRST_NAME Eduardo PR:ADDRESS 195 Little Albany Street PR:EMAIL edu.llopes@gmail.com PR:PHONE 732-235-5795 PR:FUNDING_SOURCE NIH PR:PUBLICATIONS Respiration defects limit serine synthesis required for lung cancer growth and PR:PUBLICATIONS survival #STUDY ST:STUDY_TITLE Respiration defects limit serine synthesis required for lung cancer growth and ST:STUDY_TITLE survival - NSCLC rewires glycolytic metabolism to synthesize more serine from ST:STUDY_TITLE glucose (Tumors) ST:STUDY_TYPE In vivo Isotope Tracing ST:STUDY_SUMMARY This study investigates the impact of mtDNA mutation burden induced by the ST:STUDY_SUMMARY PolGD256A mutation in Non-Small cell lung cancer (NSCLC). Using in vivo, we ST:STUDY_SUMMARY characterized the metabolic profile of NSCLC harboring this mutation compared to ST:STUDY_SUMMARY controls after submit the animals to 12 weeks of special diet and 2h30 of ST:STUDY_SUMMARY [U-13C]D-Glucose infusion. Here we found that mitochondria impairment causes ST:STUDY_SUMMARY more use of glucose to synthesize serine in NSCLC tumors but not in other ST:STUDY_SUMMARY tissues (lungs, liver, plasma, and muscle. Due the lack of carbons from glucose ST:STUDY_SUMMARY to TCA (Tricarboxylic acid cycle) the PGKP cells have an energetic imbalance. ST:STUDY_SUMMARY WT: Wild Type animals KP: NSCLC conditional animals PolG: Animals with PolG ST:STUDY_SUMMARY mutation PGKP: NSCLC conditional animals with PolG mutation ST:INSTITUTE Rutgers University ST:DEPARTMENT Rutgers Cancer Institute ST:LABORATORY Eileen White ST:LAST_NAME Lopes ST:FIRST_NAME Eduardo ST:ADDRESS 195 Little Albany Street ST:EMAIL edu.llopes@gmail.com ST:PHONE 732-235-5795 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 SU:GENDER Male and female #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS - AAK_4830_Tu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4830_Tu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4830_TuII_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4830_TuII_woSG SUBJECT_SAMPLE_FACTORS - AAK_4835_Tu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4835_Tu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4835_TuII_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4835_TuII_woSG SUBJECT_SAMPLE_FACTORS - AAK_4837_Tu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4837_Tu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4837_TuII_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4837_TuII_woSG SUBJECT_SAMPLE_FACTORS - AAK_4838_Tu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4838_Tu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4838_TuII_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4838_TuII_woSG SUBJECT_SAMPLE_FACTORS - AAK_4840_Tu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4840_Tu_woSG SUBJECT_SAMPLE_FACTORS - AAK_4840_TuII_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4840_TuII_woSG SUBJECT_SAMPLE_FACTORS - AAK_4896_Tu_C_PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4896_Tu_C SUBJECT_SAMPLE_FACTORS - AAK_4896_TuII_C_PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4896_TuII_C SUBJECT_SAMPLE_FACTORS - AAK_4898_Tu_C_PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4898_Tu_C SUBJECT_SAMPLE_FACTORS - AAK_4898_TuII_C_PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4898_TuII_C SUBJECT_SAMPLE_FACTORS - AAK_4900_Tu_C_PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4900_Tu_C SUBJECT_SAMPLE_FACTORS - AAK_4900_TuII_C_PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4900_TuII_C SUBJECT_SAMPLE_FACTORS - AAK_4942_Tu_C_PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4942_Tu_C SUBJECT_SAMPLE_FACTORS - AAK_4942_TuII_C_PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_4942_TuII_C SUBJECT_SAMPLE_FACTORS - AAK_5004_Tu_C__PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_5004_Tu_C_ SUBJECT_SAMPLE_FACTORS - AAK_5004_TuII_C_PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_5004_TuII_C SUBJECT_SAMPLE_FACTORS - AAK_5005_Tu_C_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_5005_Tu_C SUBJECT_SAMPLE_FACTORS - AAK_5005_TuII_C_PGKP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_5005_TuII_C SUBJECT_SAMPLE_FACTORS - AAK_5013_Tu_C_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_5013_Tu_C SUBJECT_SAMPLE_FACTORS - AAK_5013_TuII_C_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_5013_TuII_C SUBJECT_SAMPLE_FACTORS - AAK_5359_Tu_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_5359_Tu_woSG SUBJECT_SAMPLE_FACTORS - AAK_5359_TuII_woSG_PGKP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=AAK_5359_TuII_woSG SUBJECT_SAMPLE_FACTORS - KP_3327_Tu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_3327_Tu_woSG SUBJECT_SAMPLE_FACTORS - KP_3327_TuII_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_3327_TuII_woSG SUBJECT_SAMPLE_FACTORS - KP_3371_Tu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_3371_Tu_woSG SUBJECT_SAMPLE_FACTORS - KP_3371_TuII_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_3371_TuII_woSG SUBJECT_SAMPLE_FACTORS - KP_3425_Tu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_3425_Tu_woSG SUBJECT_SAMPLE_FACTORS - KP_3425_TuII_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_3425_TuII_woSG SUBJECT_SAMPLE_FACTORS - KP_3430_Tu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_3430_Tu_woSG SUBJECT_SAMPLE_FACTORS - KP_3430_TuII_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_3430_TuII_woSG SUBJECT_SAMPLE_FACTORS - KP_5020_Tu_C_KP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5020_Tu_C SUBJECT_SAMPLE_FACTORS - KP_5020_TuII_C_KP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5020_TuII_C SUBJECT_SAMPLE_FACTORS - KP_5021_Tu_C_KP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5021_Tu_C SUBJECT_SAMPLE_FACTORS - KP_5021_TuII_C_KP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5021_TuII_C SUBJECT_SAMPLE_FACTORS - KP_5022_Tu_C_KP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5022_Tu_C SUBJECT_SAMPLE_FACTORS - KP_5022_TuII_C_KP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5022_TuII_C SUBJECT_SAMPLE_FACTORS - KP_5155_Tu_C_KP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5155_Tu_C SUBJECT_SAMPLE_FACTORS - KP_5155_TuII_C_KP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5155_TuII_C SUBJECT_SAMPLE_FACTORS - KP_5156_Tu_C_KP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5156_Tu_C SUBJECT_SAMPLE_FACTORS - KP_5156_Tu_CII_KP_Control Diet:Control | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5156_Tu_CII SUBJECT_SAMPLE_FACTORS - KP_5167_Tu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5167_Tu_woSG SUBJECT_SAMPLE_FACTORS - KP_5169_Tu_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5169_Tu_woSG SUBJECT_SAMPLE_FACTORS - KP_5169_TuII_woSG_KP_Ser/Gly free Diet:Ser/Gly free | Sample source:Tumor RAW_FILE_NAME(Raw)=KP_5169_TuII_woSG #COLLECTION CO:COLLECTION_SUMMARY Extraction of polar metabolites from solid tissues: 20 to 30 mg of tissues were CO:COLLECTION_SUMMARY weighed and added to a 2 mL round-tipped microtube with a – 80° C cold Yttria CO:COLLECTION_SUMMARY Grinding Ball per tube. The tissues were pulverized in CryoMill (Retsch) CO:COLLECTION_SUMMARY following alternating three cycles at 5 Hz for 2 min with three cycles at 25 Hz CO:COLLECTION_SUMMARY for 2 min. Buffer was added to each 2 mL microtube (sample weight x 40)/2 volume CO:COLLECTION_SUMMARY of the buffer) 40:40:20 buffer with 0.5% formic acid, samples were vigorously CO:COLLECTION_SUMMARY vortexed and incubated on ice for 10 minutes, vortexed, and incubated for an CO:COLLECTION_SUMMARY additional 10 min. After the samples were centrifuged for 10 min at 16,000g at CO:COLLECTION_SUMMARY 4° C, the supernatant A was collected and saved, and the pellets were submitted CO:COLLECTION_SUMMARY to re-extraction following the same procedure to generate supernatant B. CO:COLLECTION_SUMMARY Supernatant A and B were mixed and transferred to a clean 1.5 mL microtube with CO:COLLECTION_SUMMARY the appropriated volume of 15% NH4CO3. The samples were stored in a -80° C CO:COLLECTION_SUMMARY freezer until analysis by LC-MS. Extraction of polar metabolites from plasma:To CO:COLLECTION_SUMMARY extract polar metabolites from mouse plasma 40 µL of cold methanol was added to CO:COLLECTION_SUMMARY a 15 µL of mouse plasma in a 1.5 mL microtube. This mixture was vortexed for 10 CO:COLLECTION_SUMMARY seconds and incubated for 20 minutes in a -20° C freezer. Samples were CO:COLLECTION_SUMMARY centrifuged for 10 min at 16,000g at 4° C. Next, supernatant A was collected in CO:COLLECTION_SUMMARY a new tube, and the pellet was saved for re-extraction. For re-extraction, the CO:COLLECTION_SUMMARY pellet was resuspended in 200 µL of 40:40:20 buffer, vortexed, and allowed to CO:COLLECTION_SUMMARY sit on ice for 10 min. The samples were centrifuged for 10 min at 16,000 g at CO:COLLECTION_SUMMARY 4° C. Supernatant B was collected and mixed with supernatant A. This mixture CO:COLLECTION_SUMMARY was further processed to remove phospholipids using 1 mL Phenomenex (Phenomenex CO:COLLECTION_SUMMARY Inc.) tubes according to the manufacturer's instruction and stored at -80° C CO:COLLECTION_SUMMARY until analysis by LC-MS. CO:SAMPLE_TYPE Tumors CO:VOLUMEORAMOUNT_COLLECTED 1mL of organic phase of metabolites extraction CO:STORAGE_CONDITIONS -80℃ CO:COLLECTION_VIALS 1.5 mL Eppendorf tubes CO:STORAGE_VIALS 1.5 mL Eppendorf tubes #TREATMENT TR:TREATMENT_SUMMARY Tumor were collected from animals with NSCLC. The animals were weighed one week TR:TREATMENT_SUMMARY before NSCLC induction. In the same period, special diets (control amino acid TR:TREATMENT_SUMMARY food and ser/gly free diet) were provided and kept until the end of the TR:TREATMENT_SUMMARY experiment (12 weeks). After this period the animals were subjected to TR:TREATMENT_SUMMARY [U13C]-Glucose infusion for 2h30. Therefore the animals were euthanized and have TR:TREATMENT_SUMMARY their tissues collected. Muscle (gastrocnemius), liver, plasma, lung or tumors. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY For Tumor: 20 to 30 mg of tissues were weighed and added to a 2 mL round-tipped SP:SAMPLEPREP_SUMMARY microtube with a – 80° C cold Yttria Grinding Ball per tube. The tissues were SP:SAMPLEPREP_SUMMARY pulverized in CryoMill (Retsch) following alternating three cycles at 5 Hz for 2 SP:SAMPLEPREP_SUMMARY min with three cycles at 25 Hz for 2 min. Buffer was added to each 2 mL SP:SAMPLEPREP_SUMMARY microtube (sample weight x 40)/2 volume of the buffer) 40:40:20 buffer with 0.5% SP:SAMPLEPREP_SUMMARY formic acid, samples were vigorously vortexed and incubated on ice for 10 SP:SAMPLEPREP_SUMMARY minutes, vortexed, and incubated for an additional 10 min. After the samples SP:SAMPLEPREP_SUMMARY were centrifuged for 10 min at 16,000g at 4° C, the supernatant A was collected SP:SAMPLEPREP_SUMMARY and saved, and the pellets were submitted to re-extraction following the same SP:SAMPLEPREP_SUMMARY procedure to generate supernatant B. Supernatant A and B were mixed and SP:SAMPLEPREP_SUMMARY transferred to a clean 1.5 mL microtube with the appropriated volume of 15% SP:SAMPLEPREP_SUMMARY NH4CO3. The samples were stored in a -80° C freezer until analysis by LC-MS. SP:SAMPLEPREP_SUMMARY For Plasma: To extract polar metabolites from mouse plasma 40 µL of cold SP:SAMPLEPREP_SUMMARY methanol was added to a 15 µL of mouse plasma in a 1.5 mL microtube. This SP:SAMPLEPREP_SUMMARY mixture was vortexed for 10 seconds and incubated for 20 minutes in a -20° C SP:SAMPLEPREP_SUMMARY freezer. Samples were centrifuged for 10 min at 16,000g at 4° C. Next, SP:SAMPLEPREP_SUMMARY supernatant A was collected in a new tube, and the pellet was saved for SP:SAMPLEPREP_SUMMARY re-extraction. For re-extraction, the pellet was resuspended in 200 µL of SP:SAMPLEPREP_SUMMARY 40:40:20 buffer, vortexed, and allowed to sit on ice for 10 min. The samples SP:SAMPLEPREP_SUMMARY were centrifuged for 10 min at 16,000 g at 4° C. Supernatant B was collected SP:SAMPLEPREP_SUMMARY and mixed with supernatant A. This mixture was further processed to remove SP:SAMPLEPREP_SUMMARY phospholipids using 1 mL Phenomenex (Phenomenex Inc.) tubes according to the SP:SAMPLEPREP_SUMMARY manufacturer's instruction and stored at -80° C until analysis by LC-MS. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY Tumor CH:CHROMATOGRAPHY_TYPE HILIC CH:INSTRUMENT_NAME Thermo Vanquish CH:COLUMN_NAME XBridge BEH Amide (150 × 2.1mm, 2.5um) CH:SOLVENT_A 95% water/5% acetonitrile; 20mM acetic acid; 40mM ammonium hydroxide (pH 9.4) CH:SOLVENT_B 20% H2O, 80% acetonitrile with 20 mM acetic acid20% water/80% acetonitrile; 20mM CH:SOLVENT_B acetic acid, 40mM ammonium hydroxide (pH 9.4), 40 mM ammonium hydroxide, (pH CH:SOLVENT_B 9.4) CH:FLOW_GRADIENT 0 min, 100% B; 3 min, 100% B; 3.2 min, 90% B; 6.2 min, 90% B; 6.5 min, 80% B; CH:FLOW_GRADIENT 10.5 min, 80% B; 10.7 min, 70% B; 13.5 min, 70% B; 13.7 min, 45% B; 16 min, 45% CH:FLOW_GRADIENT B; 16.5 min, 100% B; and 22 min, 100% B CH:FLOW_RATE 300 μL/min CH:COLUMN_TEMPERATURE 25 °C CH:METHODS_FILENAME Chromatography_method.pdf #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Plus Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS Maven #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS ion count MS_METABOLITE_DATA_START Samples AAK_4830_Tu_woSG_PGKP_Ser/Gly free AAK_4830_TuII_woSG_PGKP_Ser/Gly free AAK_4835_Tu_woSG_PGKP_Ser/Gly free AAK_4835_TuII_woSG_PGKP_Ser/Gly free AAK_4837_Tu_woSG_PGKP_Ser/Gly free AAK_4837_TuII_woSG_PGKP_Ser/Gly free AAK_4838_Tu_woSG_PGKP_Ser/Gly free AAK_4838_TuII_woSG_PGKP_Ser/Gly free AAK_4840_Tu_woSG_PGKP_Ser/Gly free AAK_4840_TuII_woSG_PGKP_Ser/Gly free AAK_4896_Tu_C_PGKP_Control AAK_4896_TuII_C_PGKP_Control AAK_4898_Tu_C_PGKP_Control AAK_4898_TuII_C_PGKP_Control AAK_4900_Tu_C_PGKP_Control AAK_4900_TuII_C_PGKP_Control AAK_4942_Tu_C_PGKP_Control AAK_4942_TuII_C_PGKP_Control AAK_5004_Tu_C__PGKP_Control AAK_5004_TuII_C_PGKP_Control AAK_5005_Tu_C_PGKP_Ser/Gly free AAK_5005_TuII_C_PGKP_Control AAK_5013_Tu_C_PGKP_Ser/Gly free AAK_5013_TuII_C_PGKP_Ser/Gly free AAK_5359_Tu_woSG_PGKP_Ser/Gly free AAK_5359_TuII_woSG_PGKP_Ser/Gly free KP_3327_Tu_woSG_KP_Ser/Gly free KP_3327_TuII_woSG_KP_Ser/Gly free KP_3371_Tu_woSG_KP_Ser/Gly free KP_3371_TuII_woSG_KP_Ser/Gly free KP_3425_Tu_woSG_KP_Ser/Gly free KP_3425_TuII_woSG_KP_Ser/Gly free KP_3430_Tu_woSG_KP_Ser/Gly free KP_3430_TuII_woSG_KP_Ser/Gly free KP_5020_Tu_C_KP_Control KP_5020_TuII_C_KP_Control KP_5021_Tu_C_KP_Control KP_5021_TuII_C_KP_Control KP_5022_Tu_C_KP_Control KP_5022_TuII_C_KP_Control KP_5155_Tu_C_KP_Control KP_5155_TuII_C_KP_Control KP_5156_Tu_C_KP_Control KP_5156_Tu_CII_KP_Control KP_5167_Tu_woSG_KP_Ser/Gly free KP_5169_Tu_woSG_KP_Ser/Gly free KP_5169_TuII_woSG_KP_Ser/Gly free Factors Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Control | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Diet:Ser/Gly free | Sample source:Tumor Glycine_C12 PARENT 80731006 51450066 73202406 146706962 114169362 95941369 86866425 102446519 125271112 15402315 8831965 963053 80001275 70986019 4718885 9358775 34771553 99260881 1455361 1531085 137555338 130620962 91608206 119944262 7491225 114263438 1740718 125450288 1758792 178795212 237687925 202241338 156292788 111165888 1685736 173658862 116243912 1410639 1280039 119871738 14758585 115495288 8866985 100989906 161566562 128450038 115730738 Glycine_C13-label-1 2681423 1758095 2442573 4193032 3062901 2886721 2601977 3446994 2944427 4234145 2432735 284183 2077651 2183353 1424701 3188193 1328022 3284804 4522999 4531686 414997 3918152 2875577 3701654 2279444 3583107 5046076 3846628 5398077 5354786 6601138 5498964 4778402 3064242 4820864 50780 3184872 401443 3897721 3774205 3964294 3484579 2284732 2444929 4808977 385278 3323539 Glycine_C13-label-2 946462 617951 864734 1158228 1054385 1285684 896059 1014032 802346 1160851 634012 875847 680013 486483 447652 981711 342864 1078337 2159386 1918801 1474842 155515 1093795 1727314 795666 971545 2001167 1282361 1768962 1318736 1914057 152896 1437315 1076964 2398677 2434779 1291874 1652526 1535406 12133 1572488 1280773 790932 790736 155179 1738729 1395234 Phenylacetaldehyde_C12 PARENT 10959209 6720202 8195927 9344534 11171384 14862011 14421698 12157079 18760555 8718823 488605 881566 8894459 8098328 12828441 8115228 9826819 11365541 13207844 8709576 14449005 5538211 15461342 9756384 15280516 805934 29567853 12003712 14773461 11016065 5301965 11451777 6366136 12505635 6237011 10748234 11638129 12153612 10116891 9395171 11239084 10092927 7562577 10262423 12868669 8254218 9263966 Phenylacetaldehyde_C13-label-1 813553 55829 489018 678252 888508 131938 1119095 1108641 1796492 617882 362598 812251 479975 619593 975002 581765 885064 82765 1021001 515889 1174693 320273 1317545 971727 1292013 620501 2569962 1075526 1204066 775282 423636 940087 238612 874907 473215 895619 938123 1006087 873408 936506 1145689 82949 455475 945185 1178716 640351 774192 Phenylacetaldehyde_C13-label-2 77947 0 0 0 0 8308 10742 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 60407 0 0 0 0 0 0 0 0 0 0 Phenylacetaldehyde_C13-label-8 132735 640776 881018 78558 1212281 123425 1290592 1174762 1080825 106209 893933 872506 1065855 967398 1736962 1301552 862638 114948 1588937 1131377 124096 1105557 1643292 1122023 678755 1635829 100087 1130061 975765 996176 905735 1380385 579939 878478 1010899 958833 1215642 1079785 870075 898906 110029 10286 69729 666539 1072868 1052018 1044765 Tryptophanamide_C12 PARENT 1006594 946036 1120156 1667442 1906212 1866746 2020328 1929587 1249303 1186614 943207 866883 886709 1394858 1090611 105437 353441 1620676 1456591 1559351 1488538 1759583 1143371 985078 156299 2431868 1389743 1496896 1227338 1456432 2058612 2853451 1118331 154511 1713572 1461531 1770365 1744801 1589298 1318327 259796 1884103 1276689 1382718 220595 1167636 1898545 Tryptophanamide_C13-label-1 236175 16951 21205 72734 2501 276368 306244 273436 10122 252813 0 192057 279659 105758 73145 363475 86335 274826 234528 971467 300796 250945 24696 110258 223116 366963 303217 617138 202144 431193 413363 529119 57861 347816 324311 586828 565887 719493 174775 675621 330328 109166 153949 327511 425857 0 286922 Tryptophanamide_C13-label-3 3848721 1532706 2372476 2598969 2979275 3219145 3463889 4065902 2383521 2235134 1719462 1961535 2159373 1775692 4138689 3611501 1654389 2381363 2575704 2056738 3638209 1857966 2339014 2688515 3201509 6483876 295203 3704867 1885861 3054775 2061018 366255 2106122 2269329 3214114 3081301 3249319 2597542 2495272 2890093 4269659 3284016 2273951 3590665 2730967 2386826 2973727 Tryptophanamide_C13-label-4 281367 387035 139193 134861 235326 293853 261029 159928 21791 193552 7564 149984 14246 7094 230744 182711 131646 231044 0 156042 298053 114764 115058 225142 208544 205309 115813 32335 174749 301104 431159 2892 130445 13938 250021 129917 212038 471074 259347 192878 383344 209435 154525 217474 132432 136504 297508 Tryptophanamide_C13-label-5 329474 226984 378145 538145 406251 280514 684778 383117 46652 635273 474733 551253 212231 559173 306948 239612 175436 234547 571956 257497 481962 339303 281435 228232 215322 180871 704483 346709 264324 276572 234081 210666 501211 187261 542704 403029 396582 259995 406003 233661 309886 23834 34318 22749 369853 339619 335648 5-Deoxy-5-(methylthio)adenosine_C12 PARENT 474268 2889391 4873363 5060527 6948766 8082688 737754 8258457 39111 4241418 3228496 2264916 237581 3049794 3786561 3219515 1229421 3046611 4596486 3696008 4214859 3751431 3510183 34808 4860316 6990457 5420507 5816509 2693061 42413 397869 8564938 2668113 3589383 3916777 1154653 4857447 3932889 5354648 4835325 7416582 6150958 4071271 5791627 5315621 2456117 4614679 5-Deoxy-5-(methylthio)adenosine_C13-label-1 70255 247181 562224 509064 685081 492772 895723 488608 175573 399381 513691 215933 193829 207643 248267 255383 153333 213611 800156 478489 963792 203696 205972 301437 457265 69073 1279321 290414 106421 318417 259877 1071054 220021 426542 350052 150633 223178 295174 455942 598358 970762 885644 723158 290608 657641 161346 327058 5-Deoxy-5-(methylthio)adenosine_C13-label-10 0 0 0 0 0 0 0 0 169574 0 0 0 134789 131307 0 0 0 0 0 0 0 0 710 0 0 0 0 0 0 0 0 0 0 120732 0 0 0 0 0 0 0 91771 0 0 0 0 0 Nicotinamide_C12 PARENT 10288639 52472545 7777304 13119011 79093115 9854387 13562965 10367720 5453123 7670952 65101505 74694705 67255635 5901454 4649152 66780025 241271925 7355100 13738779 13618592 63524975 10084063 52672255 49788515 5057714 12004653 9421107 72315895 46830755 393273775 20071958 23179640 9187324 6311608 10454475 17486896 10649200 10823733 83696695 13814759 68284745 52058715 3620234 82018655 8794143 5921952 57391695 Nicotinamide_C13-label-1 66070181 32954822 50676516 87288631 52583506 61531225 87571881 70177531 37099475 52586456 42428575 47424172 43001359 38629088 31352197 44500309 15685505 49622559 917331 87830369 4198805 66249775 33751088 32683816 31502762 79547025 61246531 46282134 29703838 25925564 129995862 147851912 57001506 42789366 63551306 114638712 70101794 7341355 53369006 94034381 48024312 33348872 22634208 52786381 576856 38022628 34593003 Nicotinamide_C13-label-2 2152157 961993 1350269 2247243 1554445 1525777 2100827 1468166 1046722 1516907 1383509 1036437 1195274 963893 1310854 941429 285379 788017 1964105 2012245 1389809 1373596 925509 826383 1137925 1655826 2051621 1294869 776963 356606 3655852 4917435 1606103 1183235 1667751 275348 190797 1685188 1650988 2316487 986548 567841 718392 1193878 161445 1244961 40734 N-Acetyl-Leucine_C12 PARENT 3547717 1329302 2460163 735138 3385089 670012 1959207 3343112 2791695 1734113 306527 1695246 3852998 602236 4875892 2667498 1692769 1969885 4130548 342265 3568095 513563 4279379 3735701 235369 4571765 4395491 2733677 1439558 1009606 2097993 3699893 47071 1685651 2747764 2891097 2973629 3159729 632922 2240572 4532142 4209562 1765155 1763005 2302521 2262168 3391171 N-Acetyl-Leucine_C13-label-1 254212 70505 99173 65155 169001 113135 244196 66296 70423 169765 72357 0 201461 54307 201169 191106 217486 172676 273872 174957 136518 137489 19358 174985 176269 446925 200402 100313 109087 153284 157678 199718 80597 235971 166661 372323 132369 203156 160363 283991 211592 476823 155855 203816 278809 186912 143273 Adenine_C12 PARENT 3746395 31538641 25277983 30755478 153511388 119572062 84461481 119247825 70266969 91139719 39955309 34282216 6224245 56839381 67412138 61248544 14563756 63707169 8315145 856771 84265344 82567506 75394006 71689175 7283065 90124181 111456488 81708794 71648094 631974 37362016 50032009 41094325 70041119 54233594 52412325 76566125 61066969 7151655 70541825 13391045 85478581 64668219 52583369 711202 56656344 61820181 Adenine_C13-label-1 2249176 2000854 1768748 1799118 8816252 7236538 5289625 6876288 3429936 550759 2544513 2149958 3590186 3142901 4188239 3840918 917583 3750966 5411836 4869559 5175734 5501966 454608 3876461 4549302 5630418 6988726 4887725 4291248 3571871 210556 2875862 250823 4167633 2993448 3475371 45100 4012116 4618916 4059175 7296565 4739317 4038498 3127216 4426723 3508027 3846705 Adenine_C13-label-2 0 0 57417 0 108776 81599 71269 247755 0 0 0 0 0 61936 102593 69568 0 61795 200883 81471 89992 164411 60824 769 88712 8008 310808 156359 203997 76786 0 0 0 90386 0 68583 0 0 79097 67357 192376 88833 0 0 0 67702 105597 Adenosine_C12 PARENT 2436207 13078055 157640688 100636769 2301423 2130221 168087962 20407675 1620196 2191994 135046062 111078012 11738935 117567712 235734675 80711019 32162203 77594175 1803394 234851625 129075362 2046223 1167048 149108262 133363462 250379525 153432812 101349969 73984381 81908381 111242188 157952462 1514316 195342262 194475562 295897425 1543720 154965988 167713688 139629212 400836925 171153038 94198344 131137338 178085188 138817625 203864188 Adenosine_C13-label-1 28924734 14674464 18761012 11806926 25907408 24531338 19297256 23721714 17642567 24576067 1506582 12667209 13544355 12915526 28118359 10678741 4036744 8687843 21629312 28007506 15014473 24714712 13435864 16833608 15338773 26695559 19020792 11687048 9040221 9629423 12712826 18500355 16926208 22911773 21063433 34939862 19432845 18567406 19433548 16410233 4830245 19207198 1080434 15837977 19814552 1712803 25057661 Adenosine_C13-label-2 2799522 1614592 1969431 1025301 3041276 2594779 2068066 2542496 1578254 247679 1659317 1371026 1332074 1445272 4338136 1292133 63117 1148451 2722543 3542455 1850014 3202254 1624257 1989898 1923009 3024805 2559946 1531608 993821 1087207 1155336 2126479 1849722 2595898 3018062 4735143 2314999 2812058 2522808 2418141 6661228 2407435 1362068 1981799 2165475 2126984 2877273 Adenosine_C13-label-3 1308097 873931 781566 561076 1009522 1045739 761684 800642 407015 591213 738368 607574 403986 519828 2242767 659438 208488 645883 1499069 147577 1115689 1727897 609526 845124 783896 1149627 1174545 617269 55304 467406 535505 719662 910716 1073642 1471942 2520613 1340371 13986 1319144 1190426 3452783 1304931 527381 959252 8848 874498 1413503 Adenosine_C13-label-4 463967 127122 252501 91853 313643 321728 180875 160801 113795 148067 198039 92472 80174 97212 987431 18961 74559 249771 563611 652693 261628 751876 217757 375935 86787 29164 630859 449133 129182 141169 241955 1962 345466 277151 550414 1062636 585525 425132 476699 187692 1482042 465488 91962 345451 457806 492451 559039 Adenosine_C13-label-5 185383 7988 87941 0 118773 265766 0 94185 0 75005 70206 0 77806 0 223215 85373 0 0 330921 276811 9977 456215 74277 139856 96984 185969 407108 124169 85226 113629 94856 124086 187408 9329 46109 772173 271639 283001 127295 144213 1281019 389817 107977 111214 122003 327119 374337 Creatinine_C12 PARENT 18066845 155705488 140119788 161147612 2512972 259480725 3113293 2986721 155428288 176811662 106407312 11751495 133572638 1492304 98832894 137967162 52003534 1258987 189824312 186234688 173384012 183745662 165630262 125617262 146476762 2156219 327917825 329816075 229111625 242533825 237501075 293912675 1490641 161056988 175616238 171454738 206533438 181533662 192008938 1887786 225518075 172217512 136794488 1810866 2037908 216939925 382768325 Creatinine_C13-label-1 8398856 6077991 5949173 716297 10702918 11527365 14225208 13216005 6319447 7536205 4414207 4781333 6264041 6788799 4373149 5701069 2431349 5396256 811341 7683734 6980768 7601263 682845 5825677 6442111 9798752 14573995 14414652 970548 9965031 1027249 12182646 6601278 7239132 7703359 679482 9042979 8052334 8037084 8066989 9360096 7453391 5956658 783799 8461729 9896548 16650225 5-Methylcytosine_C12 PARENT 954058 810042 848459 1071538 2404209 2690383 1783386 1337988 975503 1106086 719273 529431 746781 888029 710568 717439 393911 53343 1371272 1070311 1077739 1096555 1448293 1160219 1226299 157234 1847949 188103 1026004 1286059 1693803 2811816 1438082 1586391 1485587 1237257 172599 1319257 1098721 854787 1203017 1420852 1137953 2126571 1275172 1072787 3204817 Hypoxanthine_C12 PARENT 8406356 52064275 51933475 9154292 10133905 12943409 12909500 13825139 80877015 11331236 56943005 54939015 8675073 7782636 7160254 6727060 197330912 54492145 10141677 10848808 74601945 81859655 50625185 66415975 70316495 14770173 12323681 11517267 47642665 4393727 14479996 21185448 8573403 11961661 11768691 12829429 11359083 72487345 7179734 10166415 10637579 7162696 48866765 83660055 71637285 75805325 10265640 Hypoxanthine_C13-label-1 47105134 30277397 308300 52251184 58664531 73695169 75528025 77707975 45413662 61687838 32291791 31715875 47101822 44257922 42232175 40073253 10288188 29309372 62378419 63392444 43950316 48219066 29429828 40536459 40405959 89756844 74797669 68114344 28711553 2510107 81545619 123050388 50378059 674729 71379919 77574881 669191 42111509 43191572 59545925 63552038 42304375 27920012 50041172 41801222 44303659 58390256 Hypoxanthine_C13-label-2 1147465 671186 689568 1090894 1111167 1673971 1802751 143335 953618 128969 770947 74166 845629 1005894 1221185 1094337 32364 796994 1489448 1411318 926989 1305531 518558 866273 1031652 1853434 2136072 1829577 710157 554291 1899482 240978 1108461 1419433 1630953 2278016 1654765 978648 1082003 1203501 1721968 1126712 580107 1174648 910169 1103211 1442487 Hypoxanthine_C13-label-4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 72672 0 0 0 0 Cytosine_C12 PARENT 36207575 35898303 34166978 45952909 7669325 67304475 54166562 42417612 51249241 38475275 24731858 25468358 21768092 28195556 23614923 2486153 14891192 24932806 42055278 43218991 41372128 57770431 53967431 43154009 484914 557752 56432812 582246 41760534 46293603 81334331 94042919 67532056 68621594 73714819 61237206 48280412 56466619 49759134 34080553 44408466 43338097 42121634 720204 48343578 44984378 59476769 Cytosine_C13-label-1 1822041 1400687 1607773 2278438 3709819 3250124 2260096 1799354 2211117 1629754 1077103 1163852 935898 1336143 1276323 1055083 534691 1130456 1846738 1897687 201951 2411416 2419187 1846905 2076698 2410085 2722615 2679515 1824394 1859913 3414825 391667 3064889 2981325 2989951 2723359 2063576 2558247 1942313 1718723 181198 209942 2000887 2925929 2174755 2059224 2561308 Deoxycytidine_C12 PARENT 2709853 3096766 2643103 3795034 6003613 6261389 4138068 3275245 4516545 3008507 1874735 2028942 1827183 1958937 1528465 1623877 1262104 1812962 3773191 3925178 3542604 4798323 4555397 3733185 3958541 5327955 4488131 52833 3395289 4331394 6739109 8200467 6124812 6005632 5910114 510322 4143962 4289208 4080587 2726026 3123974 3798821 3196683 5693366 4310532 3681205 6931888 Deoxycytidine_C13-label-1 0 143914 117839 268205 429244 607697 154569 0 304938 258873 0 0 110885 173997 0 0 0 6573 8799 131848 77995 340346 257644 254524 127368 146882 173572 166692 171479 376112 530596 657599 550903 598979 469052 42595 310913 430847 295816 10423 99038 96151 126928 320125 86871 10473 700524 Tryptophan_C12 PARENT 46400325 43560325 37481538 38304191 94524756 99463256 6450675 77291856 42007197 53509956 21095164 22094438 43074722 49606525 60919206 63210169 13370097 4001325 67668431 56645025 61965356 61489744 45144916 46058603 427494 71428906 110913738 888720 7710135 774071 60163731 86218531 54306556 618311 59098356 6628175 88073944 66446025 91304431 8848335 8934165 63161044 40256778 65119006 77643531 70386269 8057455 Tryptophan_C13-label-1 5803153 4869521 4447836 4280804 10783484 11048347 7035169 9350803 4586523 62854 2553638 2667119 537095 5834767 7235259 7558475 1639694 465823 8653409 6842548 7319439 7119693 5389898 5241581 5183888 8328001 13009129 10670391 8688934 8699273 6823934 11809757 6333214 7662576 6614718 771857 11032391 7923788 11323309 10172652 10948577 7150512 4733755 7995772 9268872 7561059 9482821 Tryptophan_C13-label-2 172302 83565 114312 117892 452723 556559 248707 510091 166755 72725 6924 124817 97654 124561 110374 245281 0 95902 356763 300762 287405 392413 298212 162234 211971 371784 525539 509243 414347 194421 211026 391919 202389 330055 226461 31914 49866 225689 399584 180639 339391 1058442 213056 234834 179104 319347 310407 Guanine_C12 PARENT 21028136 16575736 19905355 12549149 46821941 38081259 31472975 556021 18164567 2312032 9181672 7637391 15079158 16384919 16684573 13707086 4754897 9059759 13745083 16616233 33810162 28271538 11850813 18389136 36883375 32178575 26707116 23839312 26974775 26456572 9976701 18144619 14575448 24864692 25356742 13144642 24838881 1536437 27479272 24947519 27939294 48229059 20721506 25647258 32896278 16081006 27817747 Guanine_C13-label-1 1257687 1054098 1071038 573529 257241 2145678 160569 3072894 979425 1550223 511256 54444 824029 894149 851768 877293 330136 423736 825722 870116 1955077 1681312 619331 1024371 2126907 1674586 1663196 1488896 1471169 1373947 564928 1096806 865418 1449958 1701241 773541 1402925 814337 1574917 1518302 1450302 2635976 1332783 1291383 1837732 90787 1696737 Guanine_C13-label-2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 60275 10026 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Acetylcholine_C12 PARENT 268910675 111091312 163122688 88495356 9100747 7914380 8217170 49540605 7384300 67054365 186193088 130618338 4237998 45581085 76467975 182318262 4856865 70458744 19860755 256999375 242053325 202309412 10916259 250727575 3923498 2432488 2874948 50686515 263779125 3127809 101810906 122553512 23629495 132201712 10737483 399585275 290791775 63901185 380524125 260172125 38080059 11677971 352632925 36791559 279394775 233929875 2729197 Acetylcholine_C13-label-1 22767539 905034 1303069 7052653 71494756 641265 65170975 39076691 58244025 53964794 16715019 12553229 32820538 35657216 5619707 14841205 4331657 5969076 15066105 19950308 18541669 14453697 82976431 17700062 29286159 20754486 23711339 41562625 21971217 25655067 8418855 10207859 18079895 10659688 80137269 31689359 22693173 49535066 28191009 20047938 3126848 92391975 27955816 2989801 21916438 18921388 22058108 Acetylcholine_C13-label-2 4650973 574857 2011976 1514122 6676585 7760387 2760632 4402571 2893808 4565433 83047 7569693 1243732 2465237 258916 3581883 1990324 2043881 698924 902886 646064 605372 3063778 748071 4033964 339628 5030089 14550052 6324343 812133 2731271 3326795 2045664 1474799 2674474 2675145 2812907 3126985 972785 680346 287143 300349 5246632 763299 2491024 6951423 3699345 Acetylcholine_C13-label-3 114758 0 86418 0 230845 29324 68148 169485 103443 102767 406068 371067 0 65696 0 199449 0 66389 0 0 0 0 0 0 20512 80207 106001 781148 370461 376851 168387 84843 74703 61285 80928 53727 104216 8163 0 0 71794 0 200643 0 165528 299878 140074 Inosine_C12 PARENT 24949475 155786388 154051262 265100025 344373775 43007365 4463436 44987445 258877825 3351975 167641362 148672762 245269975 21859625 230920975 172447888 60460494 151204512 2803955 297719625 2231868 225550525 145226338 19257665 2366174 52780755 3805310 383883225 134715012 133473988 4128446 67844415 247149425 3891616 363369375 3839898 378741475 206729962 20248585 297784275 363879725 223757875 164661562 276612625 2130068 2141731 346582875 Inosine_C13-label-1 27846788 18494475 17166933 31899284 41515516 50241359 50977566 55340294 29378944 38171175 19700311 17978083 26237178 2557787 28529884 22199242 692432 1873758 32996378 36475016 27080106 28107997 17247139 23930894 27109603 61362369 45866775 44035909 17113805 15729738 50005434 77936181 29377947 47644688 43556222 492838 47685316 23972808 2502583 36950816 45951025 26054158 19464925 320120 26038055 27383903 41918247 Inosine_C13-label-2 3697852 2474769 2172774 3646509 50725 5876042 5834338 634065 1890963 3998458 2387635 2286138 3225417 2594627 4471648 3007639 1087598 2682161 518275 524299 3256609 4098267 2048969 3108767 3007019 7513429 6022152 5853194 2155967 2005586 6013343 9369635 3365286 6036657 5979925 6265656 7034687 3420079 3518824 5213518 6747198 358467 2646677 4456702 3060483 3312955 5129029 Inosine_C13-label-3 933536 782257 635663 1405027 1911239 2033356 1743545 2060065 705715 991939 950248 1002592 1025262 854673 2075687 131882 325917 1105864 2206354 2127931 1578679 1865944 977806 1446122 1292178 2298698 3209302 2519332 775765 805714 2052045 3479604 1517078 2526477 2507537 3508935 3185331 1534218 1706597 24704 3510678 15463 1164665 2123067 1371748 1382481 2082397 Inosine_C13-label-4 197116 414547 179889 346836 465635 1018133 473049 590435 87298 133016 158549 109868 113137 253375 1025912 504703 91836 25721 759705 831896 442461 631623 270211 481945 281075 80304 1386473 1095011 198205 164716 754024 1784109 577689 975411 1096342 1196666 1275134 595909 716165 974624 1371192 543176 508874 731658 38298 609774 939542 Kynurenine_C12 PARENT 1106986 777327 838463 1423236 1432335 2103537 1527703 1480842 1108476 1166899 892846 834005 666636 803969 855196 1312586 398993 846595 1396252 1076365 1266148 1406763 970929 1209355 1067083 1716273 1442468 1409991 1069935 1062095 1434761 1857076 1138767 1186304 1085416 94515 1518764 1541216 1245189 979295 1049147 1613879 944815 1119711 1521266 924512 1096725 Kynurenine_C13-label-1 69436 211739 66398 99391 143258 122557 109373 76049 78733 95304 90678 70985 0 8024 97725 128761 75611 0 9909 6905 88036 140484 98455 72044 139931 68841 509702 117261 0 17193 10123 97887 109694 8128 84112 104913 88487 93665 83782 64144 83429 120808 97822 177935 103014 82203 91758 Phenylalanine_C12 PARENT 139990638 101099531 109987512 114916288 1848986 196360062 171932462 185623562 1230413 170634762 702641 68957044 105939488 119122825 93651456 1173460 35161009 922099 197081112 160225212 142920062 157165112 104743169 1020112 9424615 144432088 183268362 169282212 130639062 14255305 158175238 2048463 138173412 14330855 1491219 146160938 157795412 140028712 1706079 163801762 144714812 131242062 924034 12002925 1540214 129525238 1516536 Phenylalanine_C13-label-1 14516798 10628901 1075524 11276087 180968 19597094 17219814 18194562 12264466 17006562 6790555 7229846 10523919 11920879 9347346 11635662 3151261 8405191 19005686 15127388 14715722 15485597 9856662 10220204 8934554 14546217 18725806 16905161 12587009 13955419 1586672 19910781 13904325 13773995 14363408 14361098 15708655 14010725 16905014 16465242 13943209 13137352 9339937 11494335 15109786 12885516 14194908 Phenylalanine_C13-label-2 312198 146287 307994 415507 760785 541115 576861 612773 481735 535143 118233 129129 311823 350484 152768 36329 0 147507 65238 556943 50676 502871 476657 313607 178702 4549 73561 377627 488669 447822 473907 83777 552445 436842 418188 555273 562903 471708 531724 660746 31823 446337 301834 344468 542197 536278 222509 Leucine_C12 PARENT 32436 1817915 106023 7669 316885475 328970925 256606575 2925282 4183 104394 104351 0 47819 82082 1847417 104368 0 59471 9387 9774 138403 80849 86694 0 15322375 235382675 3288296 270497525 21606 0 26971 265006275 166964 252317025 81506 141298 2670650 120259 59616 107466 2795908 2356268 157698138 218132675 99841 6938 265021525 Leucine_C13-label-1 80502 12218141 81501 98083 21739938 22557342 17093386 19783705 116479 86928 99665 79045 90404 122506 12937977 100139 81413 93043 98244 69317 105194 8205 82139 68394 0 16508345 22344125 18999067 231547 74488 0 17232727 67619 1725617 89283 73642 18453198 0 103861 76876 18983723 15636012 0 14597595 142065 59215 18157017 Leucine_C13-label-2 0 423817 0 0 59678 69189 451959 575232 0 0 0 0 49161 0 171521 0 0 0 0 0 0 0 0 0 217626 432937 655995 614966 0 0 0 566851 0 518242 0 0 462742 0 0 0 410281 504753 378689 394976 0 0 43392 Cytidine_C12 PARENT 9122546 892855 7359024 6883464 28763422 29229047 18028098 1889328 10855869 11100465 6204914 5013175 6799263 7638143 7452641 5643884 2822445 5754081 8157291 11517126 7174175 9555484 11791656 11326354 11972335 18033336 28889166 25053075 15772583 18064538 13011691 24502508 11981452 22068245 1362698 12532762 16026319 12349188 10998477 9557952 15361344 14352297 12652538 26891566 11015829 9639388 20851136 Cytidine_C13-label-1 758365 445446 463536 520842 321354 2687216 1449288 1520987 669092 957281 399045 261604 265676 61856 436765 286065 198111 481117 607603 929745 540232 903445 1055134 733583 387701 1063433 2097056 2018546 1293102 1660372 1069462 2263023 1117096 1990266 972152 1089957 1356497 1365991 957987 961619 1276132 1116527 995657 2248469 1019681 805624 1753148 Cytidine_C13-label-2 0 0 0 6279 113027 688382 156942 92845 0 77378 0 7272 0 85821 91833 0 0 64112 75507 71271 64665 68931 81249 0 0 98289 126301 0 0 132575 0 164166 99963 95154 81455 81402 0 83676 69324 0 86804 0 0 108247 84403 114822 117439 Cytidine_C13-label-3 0 0 0 0 0 76381 0 0 0 0 0 0 0 57901 0 0 0 0 65069 0 0 0 0 0 0 0 0 0 64754 0 0 0 0 0 0 0 0 80426 0 0 0 0 62944 0 0 0 0 Cytidine_C13-label-5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 81108 0 0 0 0 0 0 0 0 0 0 0 0 Isoleucine_C12 PARENT 223752875 1817915 178172238 17236685 316885475 328970925 256606575 2925282 184333462 251442275 113739575 115922088 169303988 180861688 1847417 216401125 59401225 16028815 283969525 2410506 215736925 240442375 178397538 169482938 15322375 235382675 3288296 270497525 222520825 241769775 196038512 265006275 241205375 252317025 253814325 25959565 2670650 2245100 292417875 2986804 2795908 2356268 157698138 218132675 240544475 208813988 265021525 Isoleucine_C13-label-1 14951962 12218141 12034262 1177579 21739938 22557342 17093386 19783705 11984188 16311456 7709276 7329051 11560329 12118932 12937977 14646312 3832309 10604807 18823536 16103389 14778909 16234348 11839675 12232147 10193284 16508345 22344125 18999067 15636211 15420133 13389464 17232727 16266162 1725617 16435873 17223406 18453198 14990086 18945069 20349408 18983723 15636012 10054191 14597595 15730069 14748956 18157017 Isoleucine_C13-label-2 480176 423817 460152 355489 59678 69189 451959 575232 182465 444671 230619 111965 164011 329818 171521 366623 0 383465 477277 493133 32185 283197 33609 358696 217626 432937 655995 614966 397903 362072 410939 566851 274582 518242 509591 412797 462742 450531 490248 623883 410281 504753 378689 394976 611471 419009 43392 Methionine_C12 PARENT 40234909 30665297 32759462 30902359 50563091 56645225 52515225 56706875 31367903 47684903 17649494 18063923 28835309 27363444 26704981 33128503 10286293 29887059 59992144 51041012 40478988 47158884 28632909 33307234 25732423 41564825 4778665 42058559 32103016 34498988 41253366 48771638 23930712 20670673 46091512 43959516 48290572 41908275 51645528 51276984 43484509 4312125 2609657 32377309 431440 36385025 38376425 Methionine_C13-label-1 2730007 2027856 1812048 1826295 3249301 2930197 3271352 3225799 1894601 3185119 1136676 110639 1844745 1586624 1680739 2232847 854392 1683387 2972026 2793934 2565821 2601108 1892099 193487 1529013 2518236 3077736 2856258 2387481 2139433 1945104 3564495 1476816 1483741 2864227 2873609 2823477 2415309 291993 3410421 2275341 2757281 1757641 2377173 2433861 204301 2004105 Methionine_C13-label-2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 N-Acetylglycine_C12 PARENT 65952 537485 812024 1743623 958196 501384 647749 987159 768669 1955612 656493 748075 1179984 75273 705575 963329 324243 748611 744967 975817 123265 1197096 777554 1588512 761202 96073 1214816 947936 76819 1896504 816878 620516 1072249 590284 1710579 1501646 115952 1188221 131293 618137 700654 521628 635937 825668 1115324 667391 15591 Trimethylglycine (Betaine)_C12 PARENT 64635376 57773792 63146900 94719720 89327880 85503448 82444352 78886392 110918552 129213160 66284100 69030920 86480192 81137144 73996632 78471648 45659140 101587840 82368648 84689744 76560864 69954600 104434392 95966232 90907896 109696536 104478176 102320800 98872376 118478720 113956352 109593256 81600576 74061824 112969096 108682456 95263320 104310112 91741568 96021312 87948288 55292500 68847488 67341120 104573824 81336568 93435256 Trimethylglycine (Betaine)_C13-label-1 354345075 3202152 347787475 5304958 48864465 47749935 45214335 414020275 61482585 72391665 364731125 3810514 47249865 44347595 404582675 43135415 250032175 56580085 44578295 46756835 42037985 384488475 57805695 5265168 51770995 5946292 5833036 5613582 55762325 65534705 63154695 61015445 4512462 417844625 6294050 6006690 52278885 56844165 5112264 5203862 49648935 2973146 381563475 354845075 5772370 44819355 52384625 Trimethylglycine (Betaine)_C13-label-2 7750265 686777 8307804 1114495 10772246 9999821 9145823 9376421 12615625 15624381 8129613 774047 924462 9397113 8050944 9772854 5342789 12809352 9250322 9571085 8983654 8352238 12668155 10858191 1054429 12774548 13237903 11008031 11468309 14884009 12965948 13838906 9687066 9734123 13643106 14079583 11540703 11704706 10313465 11088706 10479057 6387326 8697075 798427 11731941 10078421 10739452 Tyrosine_C12 PARENT 44941209 30510659 36996897 380378 67547775 69733206 50383153 52723519 437280 54781981 22750006 22100917 39016925 4240985 33041153 44104703 13967048 33034672 68667044 58550775 56515831 61950094 3930065 43412284 33897316 50423434 66550594 54614394 45826825 49276141 51026978 71063194 52988569 52199716 5151185 49820253 58640131 52376966 65042206 61224312 56208406 49119997 35795297 43298141 55638844 45958659 52015959 Tyrosine_C13-label-1 4320268 3239726 3629061 3362131 6495211 6992377 5155485 5195757 4325393 5168352 2073112 2158608 3753545 3956591 3703647 4370268 1466033 3162882 6768527 5936368 4525502 6297569 3576483 4151564 3005438 4701985 6690197 5525595 4478761 4828259 4933206 6856113 5312672 4952759 5098072 4884979 5680027 5379026 6585878 6198025 5507171 4717726 3486279 4504745 5346847 4321732 4614428 Choline_+Hac_C12 PARENT 7849344 4745132 10409937 5773545 4462943 6795399 9437162 7907382 6106689 5505243 8706716 6329121 5034935 58663831 5766024 7314602 7624962 5388789 13504527 12192591 8554165 45334122 12246654 3745671 4726928 42821909 74315 5779227 4947866 8930073 9590421 10017512 10219448 14764806 1350104 25844812 11678655 5791671 8798756 73617794 7060183 7004851 9452734 4999642 4991482 8133576 5720807 Choline_+Hac_C13-label-1 713384 339807 832158 4417238 266295 384151 824069 679202 340431 293707 551567 4912 513987 4202784 43511 513352 698937 19197 1208665 864443 665156 2741158 71392 158899 314007 3035647 422312 355439 371468 697206 773832 760881 805253 1276571 9793788 167589 984494 187819 668755 5538898 418414 530834 603107 304694 314518 599354 465119 Taurine_C12 PARENT 68277168 62265348 62665548 65732704 92610536 92674600 97248992 89108872 69617240 69062536 45527892 45321440 49108420 51352384 47362240 45883084 25894552 48484788 62634544 59216836 54033732 56071168 65779596 58282972 66764752 92662528 92138520 90835624 67081996 79613048 74796664 114390632 67568536 75310280 66776240 65240384 73823392 60803052 63064300 61368528 75431400 64834304 54224928 89100760 67426176 58000080 85472600 Taurine_C13-label-1 156241438 14067515 143015862 14832655 2075553 209419362 224827675 203800738 151042338 156828662 103975981 10084625 110923062 115187712 104718744 101358831 56903075 108671962 13931555 130772075 116452838 125988088 148687512 130430862 1505054 205227262 2063175 2013704 148532962 1798376 1602924 2612747 151305962 169577912 148293838 146375012 167111362 134494012 1407179 130595712 1747002 146760838 120427912 199343438 155860762 128154812 197430238 Methylnicotinamide_C12 PARENT 126073612 92029756 101877881 1150412 83453494 94504075 92489675 101381825 97118506 99994225 66523544 76330169 42292525 73671531 28746341 43706484 19918294 67144581 95047931 866463 47359134 62725556 45242897 54152406 36187912 5049785 92060644 94694644 47803625 60311756 118394812 1401882 52382972 59996369 95670206 108550638 80277319 85986131 7151085 71761631 41250347 955653 83491575 421425 79853606 54138406 106362438 Methylnicotinamide_C13-label-1 9634723 70978 7864753 8701409 6174538 7071364 6978785 7960694 7386132 7195257 5302057 5963706 3648438 5966504 2395201 3370853 1593382 5238461 6802021 6164459 321507 4593848 3503233 4180502 3082638 3795566 679079 7392796 3646756 4278855 8320216 10548165 3609578 4540197 6566898 8487141 6191959 6752238 5394723 5442064 3177537 6964626 6120578 2948975 5842798 4109501 8194277 Methylnicotinamide_C13-label-2 424439 187018 247708 185407 157333 189108 96042 336246 118603 0 68074 94828 104703 7423 0 0 0 67261 234027 8669 86537 87314 0 0 73905 79026 128569 127624 0 0 21424 255331 0 285559 89864 89544 15596 110218 82501 0 0 188827 202768 66792 77698 68152 141529 Pipecolate_C12 PARENT 10767794 16882786 1140164 7919173 35613712 38326984 28086106 38984166 9626138 1072228 6076036 6455248 7239559 10599912 12965412 716267 2958556 4266147 2177093 17485938 14884155 16276552 8737626 11733709 15005447 19065262 18639038 15823244 7785484 8881294 11244473 30149362 10230279 20061758 76205 10308268 26401978 9961593 11848263 11941684 28336122 37605066 24967623 22404989 984393 5563469 14524733 Pipecolate_C13-label-1 231925 906178 378265 526565 2579005 2236215 2106556 2315002 434334 337274 295673 215132 332156 583631 754296 351369 369579 258423 1327596 716373 1255036 407534 307355 357231 1379832 116965 1143693 460026 398929 29485 500769 1787371 353602 847745 286694 228735 1598138 399499 530488 376804 1208634 25743 1441502 1228574 401959 21895 794242 Proline_C12 PARENT 229994975 112078712 209716825 211896775 145528538 163895288 154381288 176421988 2330611 269894275 152114438 15591685 18764665 218632125 153778488 279855025 114661688 196174212 3363180 269036975 2908652 325222425 230206575 219175675 154451562 154585262 135613588 119546662 192382762 194041738 168507038 115189288 17986785 98930225 210147625 2375444 160000412 243154075 2272083 228275675 128219588 133849562 94112625 112201875 20823495 20101975 1274339 Proline_C13-label-1 15333505 7139948 1367643 12924891 9882679 9633502 9472971 12158794 14475258 16612942 1072276 10525581 11822973 14549123 10444538 19222462 7557675 15539262 23301748 1853377 19843461 21372661 14485294 15161495 9818143 10511266 8131977 6692749 10844891 12107775 10080201 739586 112431 6263655 13299852 15750408 10620863 15655064 13983989 1440515 8682188 8351584 6763669 8502792 12594843 12828025 7595341 Proline_C13-label-2 2485254 1615984 2545643 1622955 1130505 1126977 1401402 2153602 131621 209193 1928363 1517167 1785286 1801379 186901 3259338 1542759 3102206 4794486 3014795 3231932 3525944 167409 2096869 1749113 1717794 302362 839798 987534 897772 896803 522575 901807 265199 1353687 3050253 1654883 19354 1441816 1570961 1531941 1451397 731822 118638 1197359 1985598 409472 Proline_C13-label-3 210065 243153 510232 390537 0 244148 90205 224872 195392 348557 205235 470278 288214 233541 442077 681676 296168 790434 1093498 455106 682346 601891 238096 551821 210737 269331 97607 275667 193793 113121 155044 0 0 232355 387339 37646 203009 477837 454117 288989 175232 152469 72672 179452 365458 171143 103095 Proline_C13-label-4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 168302 0 0 0 12627 76734 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Creatine_C12 PARENT 47734112 27650346 33802148 29327878 64128684 72878272 45281728 41240024 33516742 37393388 25261514 25319584 57680160 52571660 28027138 36264348 11418980 26224922 50207936 44249724 34791340 37558460 54973332 31765730 22075742 32269928 46494636 45951296 41500932 48467408 47316944 56254208 34767500 35900140 43016544 43900580 50927140 47311796 48253248 61944416 58548044 43224788 33629552 30416720 40673232 36565232 37941316 Creatine_C13-label-1 215189125 12674825 1511543 1324271 287572575 3313698 20609615 184801538 150484388 168246088 113597962 113825138 2565650 232022625 128443088 1632555 51153184 116630912 231185975 190953312 154100388 1717629 2455502 14280025 102691931 149545112 208258488 210649325 188153262 219052475 206873438 254293125 159593362 164039862 19411655 199018438 231701475 213228325 220017025 271044225 2585762 194684462 149709462 136574912 182689138 171005288 17274435 Creatine_C13-label-2 3957068 2210463 3147998 3236839 5496832 5550755 3707133 3793055 2304064 2963849 2044073 21387 4434542 3883559 2800632 3027249 945507 260326 3935788 3850534 3303048 3691104 4847403 3096242 2197872 289863 4920644 4755579 402001 4543482 3542793 4728383 3106361 3688365 4012717 4107856 4326491 4495878 4391214 5329885 4775369 3583182 2756181 199545 4059503 3858839 3717809 Alanine_C12 PARENT 2865103 211432475 236445675 3405736 55568905 54835595 44146585 5004398 373995225 5010876 188786038 200857662 2988038 288649775 251603225 348103225 90536369 2675441 54715145 5054842 4813113 50509665 3529550 339726675 3119094 49973425 4213454 349476375 3357940 338075325 42725425 50168865 3618300 316837375 3961352 369936325 401679325 4341221 416609875 4543089 47667045 45069175 2896713 286855075 43799955 3555699 416024275 Alanine_C13-label-1 26538941 20379655 22272839 25514595 41680825 38354225 34600138 38232712 25707186 33683803 14333827 1576735 19556458 20072492 21890817 27780694 7516374 23284525 43078397 387336 39053816 42028078 27847612 30108266 24886705 35891803 34673847 26968869 25939264 23784661 25234556 31248822 24428642 20065583 29851794 27803475 29320003 333769 31860525 36927159 36025353 33005988 19810592 2330945 32153153 27593538 32070094 Alanine_C13-label-2 13611317 10305215 11326191 1194651 15212166 14645577 13217188 16970083 11080627 16063908 6643816 7523378 7871559 8509776 10859619 13626677 3186985 11130016 2148823 1769542 15857498 2019483 11544603 13365797 10858794 15532842 14122825 10828521 8936148 8995138 9003757 10925929 5953523 5549766 14135917 11800988 12250903 12722644 13237239 15843831 15986777 14632766 7794502 821705 10850477 10289407 1224625 Alanine_C13-label-3 23694439 1862918 1966993 19528314 409662 39615488 22667467 29740097 26151275 35789866 15783589 16049714 17531762 18697108 27426759 31851753 6834665 22434608 53814075 43660778 40594547 49507322 27489066 33038759 19310525 27226991 36078428 27102784 20662214 22241595 27202322 33643984 17091756 15458286 40609038 37943997 353655 35319022 32487772 34957184 5104145 46658266 24789002 22483883 28841247 26278856 30225947 Hypotaurine_C12 PARENT 60453144 45888766 52478919 95811719 58722019 60565725 52383109 53535231 53764656 50578322 42560197 43423891 21485025 23929698 18867869 29742828 15241605 36330322 55301594 53148912 40080253 38407191 55651869 48998309 63352831 86993631 6722965 65236244 56734275 63366169 134774688 15716265 80593631 70755631 62352369 68853781 69724162 63437912 45602812 57051331 71802731 43284516 34648694 933456 50935275 27523062 34715441 Hypotaurine_C13-label-1 1048782 1000034 1207199 2448299 1043484 1060656 1375562 1023858 1177319 843264 803721 94101 501988 358296 377175 793167 217334 797956 834813 794708 954237 894593 1066472 1140738 113429 1950871 1400481 1633405 1197808 1314634 2958669 3452829 152324 1484255 1414984 1310917 1507339 1189266 819972 93111 1266735 838921 85197 1582693 100264 978227 895894 trans-4-Hydroxy-L-proline_C12 PARENT 6964121 5541072 653819 54973831 19260583 52228025 46005597 40904416 33505147 29223291 21465683 22804358 13125886 11355171 28482172 32554784 7817709 7491376 57459106 35860684 56722744 545686 50906191 55097625 29033478 4751015 36889097 2311622 30090431 22430044 59655825 52100328 5651395 49987841 48063816 41154997 32204178 45387766 42072066 36736175 744093 53830319 49932853 51155116 43635641 33186838 40221809 trans-4-Hydroxy-L-proline_C13-label-1 567013 1353276 1335767 3085008 3606159 346792 2615878 249234 1762875 2332138 1378097 1250705 1357393 973665 1689254 1652221 215486 1480385 3236893 3136927 3054706 3072204 3246319 2975482 180066 2657228 2214874 2118857 2150776 1386959 3466573 4237886 3046193 2825613 2656559 2788671 2749971 3140973 2644094 2722632 4298961 4288498 2570412 3205787 2876382 1798172 2645828 Threonine_C12 PARENT 102036269 64744425 76428381 101933769 187161538 188200138 11252485 129833788 121440112 1705157 50461884 53761519 8118355 78883594 65788344 89552675 21604111 63743394 1621968 153605338 118205762 136859362 108798488 103946006 66788744 101456575 127190862 106370388 92729244 100950819 1456935 1830814 1411558 121000588 108985162 110800125 128877288 1208876 16191035 163044262 123589862 12565685 76009481 8415365 131617862 96962875 1122214 Threonine_C13-label-1 4298936 2804774 3626403 4560294 8079803 8481268 4880396 5604246 5240641 7346994 2120171 2182591 3484715 3385883 3091312 4334641 1059469 2810456 7716048 667413 5541049 6254386 4829986 4973308 2886786 4772072 5355869 44016 3631816 429116 6588999 8061943 5746829 5049996 4720307 5099431 57753 5632852 6875232 759578 5294297 5813706 3322738 3445696 5622227 4267434 543955 Histamine_C12 PARENT 156618662 25657219 60540025 34222319 15710766 64661344 50137141 1886072 25623481 8771215 1791585 2141370 8923365 149914112 9437891 3545822 15872734 71811531 32462088 46537841 30911384 691706 798712 13061327 81653694 73695681 67908306 72215785 61381606 20977755 1371046 127749612 13511902 17526338 14563483 18317933 25232739 44075575 21025438 24982905 17425527 17353905 8965665 140602188 66452262 312209025 36623453 Histamine_C13-label-1 8603397 1279516 3406888 1784593 731911 3340265 2653316 1042596 1293729 4736367 9746706 11571599 501408 8049479 580643 18948817 927591 3754179 1575293 2404787 1901471 3744212 232163 810348 3976529 4074546 3625423 40428916 3353953 1159702 7763334 6879446 672119 982431 996891 939966 1244307 2229675 1135178 1249095 83875 1116035 5261561 7600096 3311777 16492627 1934804 Carnitine_C12 PARENT 65754096 67115648 67293064 94630232 120329568 118274968 113448488 96356224 94641304 98762688 74433728 68307992 73862552 70586568 53037444 59604796 48938156 69447264 72075096 71750800 70067592 55930752 85584808 84375328 102299904 132448008 100942168 98081720 70301328 79597280 98227320 123233272 85817592 88823416 99357896 101213536 97007112 89685888 80687488 74591832 94720808 88601728 85812480 95562552 90745576 75623424 97539448 Carnitine_C13-label-1 5097920 52019235 5200889 71413795 9139011 9029997 8390175 72977975 72199375 7509634 56962645 52644905 5552866 54189515 4007437 45433005 370053075 53443575 54775165 54898615 54785865 4244002 6691324 64718165 7890828 10117998 76654385 71898875 53676065 6153682 7852208 9513008 6576300 67863635 7593396 76742445 74749315 6840184 6168152 56865175 71751425 67439665 65555895 73590225 68208095 58318205 7547352 Carnitine_C13-label-2 9182838 8235221 8545629 1293482 14933383 16461325 14053642 12024604 12985037 12984998 8616542 8358915 10437119 886341 6656005 7602793 6249546 9323772 8948673 9342297 8867741 7336312 12040398 11071729 1269078 15920177 13623152 13181217 9069719 10388197 12397429 17561825 11082451 11744702 13008152 13281992 12601054 11371515 10484159 9666156 13604073 11208729 11651304 1246204 11896577 9938446 13529617 Acetyl-arginine_C12 PARENT 955212 342243 761282 1280676 1877557 1350018 1770573 1694569 1995743 2385203 732859 718956 560199 551192 537042 950299 160945 866652 1542351 1724126 1801029 1441111 852209 1537848 1182878 1719807 5439895 3122768 3002311 3734227 4434414 7282348 3069518 2821552 2563442 2759673 2072281 2056471 1608155 1422895 2332823 1709435 905212 3789043 3028791 2131802 3285275 Acetyl-arginine_C13-label-1 74979 0 0 11636 0 101606 98458 11864 185015 91702 62559 0 0 0 0 0 0 57173 0 71057 8169 86028 0 74519 0 122718 553131 116852 247425 136771 34889 587829 186865 1329 345246 173797 103139 84639 70052 83959 205858 8575 0 241995 199986 171727 167355 Glutamine_C12 PARENT 16080973 10440664 12110017 13372180 16184797 16084049 13052873 13713912 12834416 15988125 75590655 8043208 9881011 8608992 8849211 12956921 387216525 11954960 14014304 14122405 10871473 11379343 8970511 10859009 9577546 17165822 23328608 19913650 16221168 19177118 15595935 20268808 9905384 9616029 18355526 20058042 16059293 14828129 20467098 20504702 15126717 14980765 10087097 11856561 19799416 17835682 18998586 Glutamine_C13-label-1 214492825 139174762 1601878 157811938 17437655 17774295 150840838 156944088 126053788 149598688 83713056 91202744 100048106 88745169 10085595 1507458 47640822 149397938 16585345 161720362 1158088 123349088 110176775 13252995 110709838 200733362 238860425 20252745 157119588 175769812 145325762 188522512 10056875 100769231 190945438 211255525 16364435 14612225 20609065 20378225 154652612 1460465 93505075 122018188 192400962 176961438 182477238 Glutamine_C13-label-2 1229609 80886075 88934369 74651006 74446306 76164856 68275056 722016 56846556 690098 44791372 49585725 43176147 36303316 47075984 72739419 23785283 760708 81453031 84560994 52311725 54551931 52411088 62764731 48479309 88585719 92233175 8010265 58516225 66173406 55286081 6994995 305425 302079 7434735 86772969 64387669 561182 81081594 8169975 63639244 5179955 38101825 49709847 66588812 68113106 67940181 Glutamine_C13-label-3 35152541 2192923 24992288 20080938 1951635 17791783 18185306 18694825 15429931 2051452 12558891 13904202 11697672 9295413 13169336 18067069 6065958 19691694 1995827 22723323 12534027 1329637 14892639 17441048 12202841 23230342 26350234 21156552 15650105 1791352 15527173 19511583 7654645 6875149 21196727 25825939 15456561 15403662 20801031 22922033 14947698 14487705 10079743 12167991 18647064 18615533 19029073 Glutamine_C13-label-4 1179932 777214 1022883 820198 1394308 1197055 764266 660699 557325 815017 673233 233214 427775 356179 261723 672967 155048 804257 1441477 1314286 771317 726917 699278 817152 433737 1055189 1574694 1407641 1109111 885296 838412 1076789 598982 664392 944275 1337411 724504 519324 1242948 1040506 1137782 109498 804263 894711 887695 1027753 1054897 Glutamine_C13-label-5 0 0 0 0 16863 0 0 116767 0 0 0 0 0 0 0 0 0 0 115371 308791 0 0 86187 124717 0 0 0 0 0 0 0 0 0 0 0 85292 0 119659 0 0 0 106631 95551 139591 0 0 0 S-Adenosyl-homocysteine_C12 PARENT 1100386 848972 865554 2485504 2297845 2239251 2106808 2613237 1018589 165516 961939 1153787 80142 725015 87594 966495 209504 814703 122791 1657816 967832 1194838 72317 999383 1512847 325299 3541075 2154784 964936 1419752 4899736 9728277 1584485 1733924 1450551 1515891 1859885 1072784 129095 1610197 222361 1575053 1008995 1247779 1095612 1030148 2060559 S-Adenosyl-homocysteine_C13-label-1 130973 0 0 18137 186878 142475 96196 177845 98795 135468 82781 83861 99697 0 0 11699 0 0 257039 130922 97893 95686 83495 103949 127156 405256 50157 176439 111562 0 924277 1386953 87689 25844 11144 153228 150281 148198 182366 154431 141182 155175 0 155327 147032 199747 219097 Serine_C12 PARENT 57178119 35155853 43290341 65670006 1196691 1104467 78217006 89312169 82464944 112173062 39256025 4236985 64703125 55872956 46032034 738864 16412258 48906562 109056862 108177038 95685244 99760644 64473531 760373 62599819 89995181 114744312 88172125 80715019 85434069 111852612 1334176 101457131 89022881 102776269 98968056 107581162 105822762 1264298 128553162 123187975 113679338 63350794 73256519 105114862 94110881 102962756 Serine_C13-label-1 386001 2265255 2818526 3175511 721188 7642751 4512483 5149225 4526325 6237584 1984046 2436124 3301769 3138226 2841405 4871368 1041846 3069662 8634262 7501801 5849072 6310504 4000686 5431842 3584352 541493 7738084 6432098 4601018 5060696 6289421 7646001 5671717 5019582 6623841 698035 690437 7463796 7992599 7839088 8839566 7547952 3745726 4661332 6218807 6474022 6628775 Serine_C13-label-2 76247 311553 690383 47756 1337115 1050882 532328 882738 574488 968414 346254 208865 483475 322985 250755 856739 195627 225117 1624283 1719722 1075126 1281204 745667 93021 62542 845373 1460396 807251 843164 627791 1042527 1221692 739476 910001 1314851 1341019 1174179 1150564 12979 1209661 1780629 1486634 563267 801143 141105 1282091 97133 Serine_C13-label-3 453182 325752 468771 49079 1470354 1501458 603263 677764 90622 1213903 40086 371963 464092 443226 34245 784671 87321 350008 1762331 1365484 862839 1189462 685252 108999 321326 718319 2246021 1471486 1118574 120441 1825525 2017046 1469704 1482632 2323931 2358383 1671438 1547723 1399457 1642379 3287767 2020533 102103 1287743 1625219 1609644 2250971 Deoxycarnitine_C12 PARENT 6010186 51893365 4456206 81021295 12568427 11879296 11320684 9915771 11451151 12032261 49710025 55926315 7556768 6515984 370737675 52394445 2474584 67812715 55173765 6897860 69475935 5547264 9201671 8594134 10298514 13252733 11983559 10707490 7908146 8442075 14470989 16054549 11740289 10287385 12428496 13136528 9955648 12838005 79092945 8582000 9738549 8521053 6229392 8684185 11416120 10207766 13119396 Deoxycarnitine_C13-label-1 45430922 38354459 33905638 61543256 93363675 91159075 881126 74958694 85761131 91318481 36675525 42717116 58355744 47837825 27766725 39753584 18419533 52151784 42816684 51947834 52945406 42716997 68376481 64656644 7758705 103019331 90692175 814038 59713225 64208919 10978735 12035985 89361094 807038 9269465 98770125 75545669 99634594 6044315 63681069 74311981 65837594 46601972 66091156 86097106 77880775 99452244 Deoxycarnitine_C13-label-2 1339447 951539 891313 1704412 2690586 2524857 2505269 2097155 2277408 2553584 954594 1085666 1611485 1476159 628649 918406 578779 142437 1206267 1037088 1304362 1243084 1875579 1627343 2166645 2923409 2398797 2302224 1746727 2191126 2975715 3327301 2256338 1962095 2712367 2733643 2153721 2748481 1834148 1684488 1554456 1616412 1187282 1896025 2378771 1997144 2632596 Deoxycarnitine_C13-label-5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 59183 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Asparagine_C12 PARENT 63260562 39060622 44831066 60890812 98335775 99386925 64950225 70928644 70497675 82410275 27910312 32052703 45757941 41027534 40430009 58677319 14630581 43836297 80641656 79561981 73616856 830783 579647 64044062 54316931 71902181 89093031 7506955 57203731 66634825 74703425 9027415 69493294 573164 88513675 83992631 75381506 73212169 96463619 886649 79564725 70576344 36601409 49470178 86164769 714450 93773294 Asparagine_C13-label-1 2896675 1533041 192001 3021888 4534928 3924582 3036017 3271416 3158499 4451162 1272018 1383306 2295581 2312503 1649226 2888067 567445 2049137 374171 3842215 3507575 4113356 3069278 2886006 2360635 3371923 4555979 3976233 2853235 3874361 3538316 3853857 3572321 2370145 4293811 4384826 3221832 3896918 4374093 4543947 3105223 2967842 1679312 2597657 4207247 3295361 3899458 Asparagine_C13-label-2 153635 249493 322013 91101 459305 493275 218253 331807 133299 432289 122165 166324 142857 103292 218807 43482 83775 315719 414303 225408 143325 140544 139325 190394 14773 198232 616157 248366 15184 347754 221438 18815 16797 167717 475915 341898 189341 285926 419666 191852 245769 114999 105193 11045 249519 254188 387904 Asparagine_C13-label-3 167739 0 0 0 138576 165217 140124 0 63286 101004 0 0 0 0 163619 70911 0 93366 117258 80915 0 103171 100509 122137 0 0 142753 161062 110864 299623 121259 0 92639 7613 357047 234594 89049 205886 212737 218666 106222 0 98722 89131 120981 143373 113873 Methyl-histidine_C12 PARENT 4656289 1707233 3435594 7677181 6234939 6650445 5701211 7300688 6646998 8744865 323988 384106 4003702 4146315 2699144 4280722 1029679 3181601 9323641 1069386 6746171 8948404 6966065 6489209 375742 6710874 4926493 3318785 4553564 4337805 10013332 10366944 5446016 3971249 549977 6065154 3882875 5291028 666165 7442785 4384125 4162907 3646904 3692986 4685964 3848759 421402 Itaconic acid_C12 PARENT 4130283 2351309 3010907 3054113 5664481 5137494 4529427 53398 2780622 4533336 2117596 2063735 2969934 269166 3838839 4123788 927544 30105 4540857 3934085 4617861 4692136 3370502 3635235 4067382 5288348 7785259 4933671 4446807 4926764 4083118 5345343 3029682 2746611 4134986 3713798 4999533 4628597 5204162 4847373 7228865 4490906 2878639 611205 5647339 4267957 6036188 Itaconic acid_C13-label-1 0 242644 0 0 458173 836136 345091 450664 0 0 0 0 0 0 549878 0 0 0 0 0 0 0 0 0 378653 383165 746055 427085 0 0 0 498618 0 304256 0 0 448664 0 0 0 652708 35526 245849 740777 0 0 189114 Itaconic acid_C13-label-2 0 0 0 0 158179 108772 83118 0 0 0 0 0 0 0 148994 0 0 0 0 0 0 0 0 0 0 0 134853 103953 0 0 0 0 0 121435 0 0 0 0 0 0 188238 97912 0 0 0 0 0 Citrulline_C12 PARENT 34594259 26098306 28233709 35057084 53976488 49134059 41211962 50363591 35262066 45925166 18296005 17924862 15461728 13328012 22930775 23193536 8142492 19038627 35546209 35958509 31443888 31498091 23064952 26235972 25599688 43034462 64569256 53303012 39433791 46458134 72701344 106036788 41633797 42968041 57733619 53105056 61629981 50823197 44437059 52042128 59267694 70653294 4616415 43218466 54565731 45654716 67354406 Citrulline_C13-label-1 3797197 3028476 296929 3548108 6256393 6007857 4031146 5241756 3132296 4661246 1671947 1720452 1486453 1312101 2690723 247564 900159 2330581 4050791 4386998 3748722 3288729 2834115 2891376 3005306 506353 7732841 6398376 4184798 498842 6909604 9881065 4793211 4971194 6687004 6016101 6270042 5641916 5109384 5320052 6578335 7645012 5080053 4638947 5871203 4867481 7624929 Citrulline_C13-label-2 606173 538184 432127 205344 617526 584508 295302 454716 231065 227922 10588 166301 11967 79777 216258 230285 131646 203037 545982 587267 430815 143169 470961 421395 129609 492155 576367 532075 353309 524846 475345 531498 470586 415819 649071 693309 698391 433158 463953 529127 687426 763694 380528 35348 579059 546981 698462 Citrulline_C13-label-3 207233 7557 124154 0 104022 69233 67177 102816 0 0 0 0 0 0 62938 0 51155 77947 951 100398 8001 55258 148328 6848 0 73306 100788 0 55396 0 105657 0 0 0 148226 85827 106643 57823 104035 142084 69569 82201 0 76574 0 0 115754 Glycerophosphocholine_C12 PARENT 63865692 49787940 51953164 72719064 72554152 62902612 93461880 93111048 54921068 68634624 39026132 38699332 47915732 46022684 51315804 61819612 23039002 71497632 51387980 49597420 69801504 53160560 33377160 44408964 70483704 100598216 73182144 55191632 43657004 51681052 76869208 99375512 55659520 57834564 56168164 63771568 69936888 66784524 69442456 62156620 91114312 55761504 47125940 61600164 79838184 62859252 85835224 Glycerophosphocholine_C13-label-1 5925300 46788205 49466105 6632508 6482266 59810065 8711607 8633253 50586165 63183635 3606041 3577469 44810275 43398945 49555205 5797900 214941475 6809602 4730832 46127235 6509814 5029004 309304575 413679725 64620985 9334353 67642825 51356385 402465075 4815688 70858935 9181280 5170836 53497385 5305777 59495225 66213115 63136985 66332165 5806802 78741895 51601265 42950135 56965525 74857505 57165015 8085432 Glycerophosphocholine_C13-label-3 2365638 2153093 21523823 21099975 46777066 47582078 29098312 25966114 988453 10740432 11929863 12403924 24409145 30605244 822283 50059162 13230867 47588297 23510233 22621495 44020875 48000941 26308441 23125527 27075834 39812262 37810091 28012134 19691939 21845219 29908134 40245916 29625159 30451128 406303 42930341 64243156 60412056 60973831 459251 66002281 1885218 15761533 2450668 38357978 34976388 46490641 Glycerophosphocholine_C13-label-4 514582 1142155 928239 319434 1662576 2305386 81561 1018536 203543 0 1918 619731 1407762 1386548 3985893 2375246 462325 1904972 784695 1100214 1388424 2268702 1498198 1006739 354269 2055667 2042588 1566806 628895 708967 840803 1715707 1302466 1439534 1864727 1955273 3244605 2620654 3150288 2178196 3830161 745891 225233 1002577 1848405 1595484 2068105 Glycerophosphocholine_C13-label-5 0 0 0 0 352693 376043 0 0 0 0 0 0 294233 202546 317907 284747 0 0 0 0 0 152067 0 0 0 0 0 250832 0 0 0 0 0 0 245969 169558 328665 259147 303853 380626 393232 0 87085 0 242823 0 131219 N-Acetylneuraminic acid_C12 PARENT 2157738 1359228 16975469 23950264 26940388 29210559 2279313 2277417 1961283 24546245 13766852 14552822 15626298 1195707 10371506 22227905 7448104 16175255 17571556 1633518 17067117 16081964 21625586 14909867 17106995 27397147 18223733 21082906 16942723 17271227 21050017 26326147 1596078 12483772 27773272 41055253 36120938 31857628 45173072 25775605 16077817 24135167 12768659 12344988 23122414 19228633 20885958 N-Acetylneuraminic acid_C13-label-1 2842146 193043 2588162 2752904 3534837 3593087 3014062 282691 2325074 3144245 1806329 1940826 2157258 1670752 1481119 2792633 1095168 2284058 215371 2277446 2216464 2143119 3109137 2260271 2316698 3149274 2605972 2743381 2426235 2588098 2706057 3424879 1787421 1551618 3624504 5493865 4879868 4021321 6093273 3476242 2212568 3200308 1823002 1868427 3145281 2779608 2753552 N-Acetylneuraminic acid_C13-label-2 811437 490526 550678 64862 737835 588636 630828 416379 211563 488813 328537 318839 560776 246098 212238 564296 19773 450551 611534 508434 409462 46388 750218 46716 30831 639418 682821 754977 273651 574166 386119 69189 431419 347958 854416 998024 874714 930321 1044668 737158 251115 508238 432392 361128 599973 469063 53879 N-Acetylneuraminic acid_C13-label-3 457349 358754 341821 54895 58683 688334 540444 378046 270046 322829 265334 393399 374642 321481 304228 536843 106681 632017 511418 595679 393281 422885 627014 433658 397174 472501 708295 609872 371873 520595 372309 513882 312648 401943 763186 89098 964659 753233 913296 738334 503985 681491 43606 367254 446305 456213 626609 N-Acetylneuraminic acid_C13-label-4 0 0 72483 8256 0 78406 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 69065 0 0 172936 0 65118 75406 0 104693 0 0 72516 80478 78022 68171 66208 0 67091 78208 0 0 0 0 0 FAD_C12 PARENT 16132 194874 123536 308729 371172 433128 508822 400037 293948 476727 277451 157495 485844 284358 153619 246033 0 471992 390807 50154 498931 314706 436698 19118 377445 332346 491237 455038 586565 30097 441852 773128 165223 343216 502247 186541 327234 227004 495539 490682 5278 369251 312157 211203 538935 301982 64663 FAD_C13-label-1 0 0 0 113355 15421 176253 119861 119508 0 99661 91604 0 0 91393 129316 0 8019 100243 91369 94517 0 68677 137172 102617 0 146127 155965 0 0 0 91339 147738 0 0 0 207186 0 105842 69608 0 135951 111588 0 122497 0 0 0 N-Acetyl-aspartate_C12 PARENT 102319 67015 0 74217 83844 103365 205512 139923 163036 204948 79735 62006 0 88445 0 71335 0 0 62749 2500 0 62842 31496 103587 224006 0 321935 267897 133542 339109 0 106026 28337 87195 170257 100454 0 112339 135562 0 76397 0 0 170268 73411 70838 0 Histidine_C12 PARENT 76056106 4445035 40174978 60681156 13315315 133082475 8890615 12094595 59861069 98569244 19281892 31764434 43545528 464684 4565285 78348319 5994502 49182738 108060862 104191544 8166445 1203225 46697238 56160725 6806165 1142836 146125962 10007005 73352719 76533425 96678556 154017638 7400665 73666006 79970581 8717395 99841381 82390006 99926925 109112062 120207962 987211 39634459 92220931 944059 76759081 107079312 Histidine_C13-label-1 5052106 2969363 2671633 4054598 868568 8969829 5919332 8359538 4085757 6842331 1212514 2051188 2593191 3202008 3134349 4997971 516686 3367867 7284929 6748705 5353872 7920334 3036657 3438777 4293751 7027887 10244991 6656577 4435403 5188595 5970863 9431801 4744855 4544679 4387344 5316029 5833361 55026 6441648 7266768 7291621 6041484 2314321 582939 6567349 4783378 7419357 Glutamate_C12 PARENT 16391804 10510541 12456400 11708731 22623482 22528122 17798142 21766078 13893205 18637618 74277335 81056525 12377901 12838045 17709580 18058602 364198325 12749340 18932086 16494455 20641154 20660210 13367141 16481141 15865995 22811818 28845338 22562006 18290672 22213164 17142524 22511640 13241735 12443445 17845630 16955094 21704434 19419584 21886328 21677330 29488578 18723040 11578980 28315152 22740054 18134974 23902614 Glutamate_C13-label-1 196803112 132042388 15079625 123360725 2575513 2535331 194028938 242102925 127710162 180210862 78682831 89157406 1263831 126393538 2149264 2019883 44578703 1561190 233753525 206724362 235026275 231005225 152865588 1972020 179720238 25716285 2954785 216836775 1675778 204379562 165671112 216475525 133712488 128970388 186875838 178854238 231993175 199939988 2289734 223998775 3456028 208199062 121542038 307614775 216234025 191547438 2364484 Glutamate_C13-label-2 79505244 57658231 6228855 40525547 97070581 99485481 64712931 84364281 40071959 59316825 29058125 32168459 41314434 40813941 92848719 71970019 16726186 64116175 113424412 94474725 85442319 90179244 55479856 77247419 63812494 88985981 84231781 63036069 4332975 50262084 56897112 7308065 34931988 33595172 62772606 66990056 86526781 68248681 68997038 75464756 143764612 82907331 46716559 108127962 60515369 651870 71985206 Glutamate_C13-label-3 19815577 13617217 15950838 8066363 21422648 20346756 14653625 18604177 9554982 17223134 6270409 7547723 10385679 10440901 2555898 19205919 3776635 1602202 28264372 22716983 21351667 20879962 12625085 18002711 12889984 18257856 21169194 15301325 10856235 12872307 10493881 1345488 5662502 6863634 17742845 17843012 2176677 17259972 19152711 1900227 34968912 20960592 9852412 19077592 14913253 16148389 15830058 Glutamate_C13-label-4 952252 68555 773008 341021 1915098 2051318 975407 894276 520605 627371 207209 431097 488104 403633 859781 804393 15818 711993 2189582 1928284 895745 1202826 120817 1344991 883445 938366 952059 650199 302425 380065 782429 141798 514169 477656 849264 1185952 1120846 1088869 576838 767025 2740587 1240866 890815 1574215 427683 1006023 725767 Ophthalmate_C12 PARENT 22973386 14155511 14218952 12430881 15989055 15480481 20971605 25308708 9347368 12471147 3617416 4168792 13477245 12847991 30644259 23354612 4263723 10610305 25761142 17521608 29671109 22840492 61697 10648384 19918723 28356312 14986014 13107741 7584119 8903638 10404944 15480102 2692958 2909321 31787784 13768502 14490386 13485002 26570288 28473353 9244279 161295 5298412 3654445 20663202 20153758 28759853 Ophthalmate_C13-label-1 3707061 2698134 2579938 2128711 3038487 2701959 3691656 4838877 156147 1846284 639008 7509 2102489 2016146 5332947 3965197 719524 1751386 4835844 2771574 4903476 3754355 1132082 2198859 355224 4363498 237791 1846849 1473614 1366102 1718697 2333649 550064 601106 5119243 1896449 2461551 2621854 3953443 4454941 1449898 2629112 948942 790003 3444932 3563583 5479892 Ophthalmate_C13-label-2 131283 983538 11135 689792 111364 1071663 791525 1347592 215853 498139 236931 129538 765198 666876 2350012 122103 179799 649714 1621864 119752 1482998 1733533 587266 621014 1504165 1790575 834988 61314 129289 165428 560664 838002 127752 130358 1444978 515516 976933 843542 1161583 1473621 671037 840103 285109 162009 1391372 951199 1542945 Ophthalmate_C13-label-3 135305 133949 118031 0 0 150961 0 150985 0 0 72786 0 1102 77223 539788 318935 0 96801 42654 346488 438175 135319 0 97626 224581 550684 10927 0 0 12582 0 0 84947 0 282145 0 0 110892 173658 183402 0 12029 0 0 121847 195533 198821 Glutathione_C12 PARENT 10271652 8814035 81114535 10629020 20179800 17508192 17189258 17241820 12164993 15992464 55742095 6193240 10285150 8724273 10499436 10283857 288844075 10771151 15229848 14696619 14214368 12910187 9498676 11476033 10268311 19546078 15457200 11826405 9439885 10895711 12900256 18560322 8602284 8697271 14308712 13107761 15590705 12299163 17528746 17616446 24444842 18316806 9956808 15147144 14711920 11527509 15407400 Glutathione_C13-label-1 12556015 105507888 97276719 124147375 243742075 2027095 2045165 20885595 1417419 18255825 64289044 7113655 120167988 10517225 131895612 1262632 35161034 131232975 1823046 1759111 170743888 155923562 113623438 138535712 122996938 242357425 195175438 149626612 116096912 130735612 15282095 222244925 106976025 10674965 178835238 159944512 194953462 149542688 214047975 216420775 3027986 223976975 119932788 178455962 179390238 142695338 175273062 Glutathione_C13-label-2 24828155 19878286 17050889 18809802 47145334 40717353 31302169 34451056 19236558 25363644 1048342 12216779 20521292 18128733 31679822 2401975 686618 2526522 33361375 29258816 28996234 29313278 24478808 2575792 21933656 40980116 37909322 29149116 202152 2286762 24514183 37673062 19917481 186224 30489862 28977147 39131728 28382538 40541662 40474722 60788619 40326225 2183293 31751528 30112025 26800025 32759772 Glutathione_C13-label-3 3759282 3132026 3048402 2869447 710627 5512952 4149419 442387 2213917 2562556 140188 1914247 295976 2911127 6201393 452876 120657 4380958 5354946 4923681 4217839 4567238 3670066 3908107 3156777 5957086 7002587 4497911 3050706 340095 331182 4501204 2908793 2917588 4551592 4361102 6802816 4646302 6317427 6746546 8516782 5643672 359578 399467 4194072 451968 4658345 Glutathione_C13-label-4 444786 263979 233028 238219 662757 720197 175639 423633 0 0 98652 94298 97945 264562 679129 463311 97273 385552 49221 426067 383167 366542 345957 340557 257744 597171 612248 392382 158653 287322 282411 299063 255342 199166 369599 365044 599932 471823 575138 519211 689385 610066 399623 420882 17219 297811 302491 Glutathione_C13-label-5 0 0 0 0 0 134787 0 140751 0 0 0 63916 0 0 0 0 0 0 0 154006 107538 0 0 0 0 0 0 0 0 113359 0 0 80857 0 0 0 116709 0 0 0 181585 0 94515 0 0 0 122384 NADH_C12 PARENT 85802 460364 6765 0 2163726 2147862 985017 1860382 1726335 1849976 506275 573511 1532311 1192091 730458 317924 165359 451153 415749 205447 1080482 633402 1172412 1196368 1499706 1368532 1956871 1629674 1916241 1624275 0 0 396631 886684 103266 297034 1055828 92687 1167078 292018 1902895 1209373 908304 329565 1568672 766612 1126256 NADH_C13-label-1 19874 100417 0 0 702813 648696 329418 608692 310101 581806 134696 0 458011 253077 121092 63036 0 121335 0 85553 13272 120312 307325 339202 332137 290602 534532 265051 531215 448148 0 0 0 159205 128534 0 246035 0 275432 0 512023 301497 430859 0 512833 155844 125642 NADH_C13-label-19 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 85531 0 0 0 0 0 0 0 0 0 0 0 0 0 0 NADH_C13-label-3 153026 136804 105531 147764 14137 192161 121975 132711 246086 306879 0 2244 120342 252007 118061 267358 0 229739 16615 125515 166754 278625 192866 148411 151758 118704 102634 130622 10134 341305 254037 0 328213 151537 145874 150256 102688 190941 142318 0 232401 234033 96123 293563 14773 143974 0 NADH_C13-label-4 86201 0 0 0 0 0 0 80561 87357 0 0 0 0 83501 86043 0 0 0 0 98832 0 0 0 0 0 0 0 0 79628 0 0 0 0 132169 120976 0 0 80276 0 0 0 0 0 0 0 0 92339 Aspartate_C12 PARENT 136238662 76939219 9574605 126505275 3529550 338339725 149926362 163088662 1488229 15834365 81817519 7994565 103711781 1041492 1048734 1464887 30342097 863687 1802979 1668457 1628719 154689638 179097038 182259762 153577638 2504739 366941125 264421125 2179033 2536727 278845425 365896475 2630429 235231625 2337234 203917112 211037925 209275738 2154815 214577475 26333345 1910833 13327155 44177725 2525003 2466130 358778525 Aspartate_C13-label-1 16099328 9481115 10362953 1197953 38274141 36771759 15179994 16820625 14273036 14666434 7919979 793341 9156116 8944715 10478001 13514189 3308174 8988591 21647052 20288889 17583031 16981361 20547412 2216955 15511631 25895064 38959962 25845088 1933145 2285493 25469167 33390522 24759902 23349883 2452352 19381773 1966805 20321633 19674577 21104862 30771934 20510088 14850977 44026566 22924383 24214577 35338312 Aspartate_C13-label-2 5022693 3573906 4284744 3700999 13114389 1239769 4785497 4973249 5072545 4873314 2622982 2735437 2922297 2879354 478865 5245066 1183629 3027928 9409266 7790194 5936789 552624 7026466 8667161 5088078 7769416 11565463 7330222 5088942 5635417 7438831 9997416 5956727 575205 8174626 6455918 6284064 6039388 5557227 6337008 10999912 7960263 4810339 1436348 615343 8042418 10664759 Aspartate_C13-label-3 2206774 1166702 15144 10357 6423847 5548588 1744995 1816245 2148335 2706066 92732 1173036 1368779 1462152 2406123 2521028 39518 1132388 4095323 3134776 2241638 2134406 3001636 334422 1516977 2569743 64630 3627281 2805787 3082701 2826693 3199821 2815238 2454661 459718 3051963 2824426 3025349 3557067 3624696 4996905 4265026 208693 3450889 3055397 4593678 5013989 Glutaryl-Carnitine_C12 PARENT 1590567 1147018 1315988 3032703 5068289 4923508 4779242 3526379 3894098 4788057 1171103 1188302 1781578 1573451 85717 1659502 75626 1797337 126989 1573333 1641755 1576082 1665125 150495 3647296 4530926 10265532 107740 7588756 1054618 4913106 542623 4632344 3655018 6021541 4263568 3508863 4714983 2325936 3300456 1790055 2415906 249143 2847906 6168856 5400236 7960812 Glutaryl-Carnitine_C13-label-1 105139 127638 0 179574 814636 529778 888064 259397 593066 658521 103112 117452 407241 91041 0 129997 0 137946 137773 65966 14919 112055 350632 267581 420153 552834 1283844 1276526 95719 1409216 243041 560744 587275 515209 78983 625891 507271 54315 188813 173549 234774 233941 138604 220072 741627 650606 1106104 2-Aminoadipic acid_C12 PARENT 4880255 35725322 39534534 48746478 89299706 89572431 68674731 80507825 59751475 8546285 23341177 24129481 25908392 28552875 32335156 42888762 13323298 40488188 54956694 4290325 580624 60342938 42750047 40797034 60907081 87928519 219937975 1791454 158826162 17641815 115410012 1668626 86780231 871589 57935012 70065231 81650519 72955756 694790 72280619 118474888 65903394 58045394 99003081 1149723 77725725 122458662 2-Aminoadipic acid_C13-label-1 2947207 2468078 2625624 3300716 5500444 5646985 4451465 4578721 4191287 5788901 1575645 1615186 1490834 1670504 2513005 2733606 674933 2682899 3536681 2878115 3805906 4221764 2889893 2517927 3755611 5850517 1458677 11062007 10152732 11847223 7488692 11123815 5875256 5736539 417554 4579993 5581109 4701627 4332669 491286 8084013 437035 3811933 6728691 7574954 5161309 8661525 Acetyl CoA_C12 PARENT 176543 220838 7193 404087 268085 400492 419129 368046 498218 489789 415278 212949 712343 618422 121329 121007 0 457115 210012 411621 549171 237646 41505 475648 428303 360147 360578 35021 751789 29895 144985 132088 80289 218312 225451 229469 273391 41543 584618 182554 507434 383649 150285 136618 712191 489957 511482 Acetyl CoA_C13-label-1 0 0 0 0 78048 101864 10091 0 122594 0 0 6839 106523 102233 0 0 0 73205 0 0 116638 0 88453 0 0 110362 0 113453 113078 83134 0 0 0 0 79584 99281 0 98275 9375 0 120284 0 77935 0 107207 89547 120847 Acetyl CoA_C13-label-12 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 63613 82175 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Acetyl CoA_C13-label-18 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 79253 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6011 0 0 0 0 0 0 0 0 0 0 0 ADP-ribose_C12 PARENT 3992407 2430834 3140231 9371688 5111822 6914691 891876 6544829 3317501 3638393 4972283 5211112 4419756 3071855 2788954 3137154 1501378 6151443 8039379 6877602 4367648 50948 4228855 2633629 4114862 7257921 5532605 5078506 3909305 2191848 10929452 14828766 2344648 2228931 6038629 7497612 5091481 5841738 5229861 8357347 4355771 4278667 1833922 5107662 6474265 3224483 2444585 ADP-ribose_C13-label-1 719643 544331 705877 1987413 1059841 1200375 2027872 1329386 442716 774619 1076266 96773 69323 787901 863299 797961 231028 1345488 1833648 1339261 943628 1138831 869867 800649 891369 1488963 1306624 1099884 82498 410454 2198344 2920799 723283 608993 1242654 1675464 1160662 100112 1239686 1805306 1101439 780298 36016 1151016 1328097 718296 703828 ADP-ribose_C13-label-2 194564 106639 281839 676333 34271 485651 565311 259323 84833 203753 262322 336964 349932 138284 8395 117019 79682 621307 587733 474737 357733 298527 225204 290381 234184 405346 418289 167021 121967 98781 684584 826691 206652 101526 505286 341475 425752 408598 505418 643206 527997 143929 0 264558 514879 183223 87853 ADP-ribose_C13-label-3 0 0 80899 0 100112 91034 0 102168 0 0 80272 70127 0 0 84182 80162 0 83922 118284 71622 78334 69764 74507 0 0 94511 94989 102223 0 0 190946 261836 0 0 12433 85254 110183 108191 95255 359023 99724 83391 0 13522 144907 64165 0 ADP-ribose_C13-label-5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 79526 0 0 0 0 0 0 0 0 0 AMP_C12 PARENT 2546415 122150688 1794660 48750205 52341385 47551135 49048405 3577431 242248475 3529006 250490525 265761175 225910425 220463325 236100575 2279880 104228375 2909148 42986135 410803825 248915375 327203675 328611925 2517587 26355315 363495175 403675775 3174024 2946491 306093175 76440075 9002633 2321267 225952175 3168044 349492875 375911925 351772675 3402514 390796375 415293075 2297101 160033438 326857475 3695653 273453025 254359475 AMP_C13-label-1 28381784 12561915 19804295 55182156 60833856 53953181 54035469 39415303 25065333 39210225 2931515 31379559 24064505 25049733 27445972 26685441 11696435 34663809 49691984 47499859 29571872 39696166 36983859 28734303 29442609 40072491 52964294 38775878 343626 36749097 88910025 105177688 26666303 25113464 38899459 41272691 45351334 42401075 41191453 46834441 47801341 27059822 16808011 39469053 44016341 31856222 31141059 AMP_C13-label-2 5195804 2420274 3078112 9662597 10691706 9962438 9204159 7574444 4126021 6062966 4716958 5168564 4386532 4285599 6520616 5685925 2528865 6527078 10643048 9488131 5233652 7466409 7288797 6150985 5382438 7152901 10686256 7086125 6314022 6934241 164696 18888675 4676143 4935923 7620001 8892749 8703076 8083423 8304696 9091709 9273619 5516007 3356597 6880157 7295963 6155816 5621161 AMP_C13-label-3 135149 689595 917528 222809 2698153 3094262 1900862 1737401 785283 1448538 1400117 1328023 863812 127111 2256564 1778529 953213 2191987 4112258 2792412 2005301 311838 2039939 1888493 1700972 1664825 3815711 2305633 1750608 1735942 400853 5056093 1300662 1385441 2574255 3298788 3459529 2916403 256939 3200962 3209671 1841263 987211 2278843 2329153 1905834 1564256 AMP_C13-label-4 422137 13054 268925 645326 929656 1008367 678856 516353 233328 371831 384441 483769 33693 308348 787355 640047 311975 626059 147174 1106523 597531 1117797 555272 436696 364126 5758 164928 99568 663086 735332 1592942 193109 447573 481506 929098 121204 1628158 1045745 990708 1286056 1239871 859461 252457 1002427 807573 905738 617361 AMP_C13-label-5 9393 8179 19445 18935 725958 650679 337348 344047 0 126984 297288 142726 69347 104829 650664 364817 88187 362895 799715 51406 151507 599134 357019 444368 201436 12593 100341 715657 39161 367552 1139669 749451 282501 128686 856909 979153 754439 623616 913452 627833 847643 551882 188521 747687 465755 518988 436221 Glycerol 3-phosphate_C12 PARENT 60632269 32813716 42297316 49968134 138254288 11521565 84036019 11563915 6442195 122435838 32820312 36711738 90240181 69999706 576442 70733619 20122445 73962719 89494631 92427056 1001015 85285219 94347494 825667 58293062 914418 8212035 60438356 79487669 80657419 36877203 42115325 45186434 516184 68215731 54188244 86522369 844298 117989412 1192462 113196075 80652394 54030325 57528756 91590831 66531044 80598869 Glycerol 3-phosphate_C13-label-1 5263329 2362584 3362893 3911706 7645123 5847794 5082717 6219811 3409673 7127438 2823486 2662001 5462046 4212254 3470072 445084 1710412 6201523 5937657 5807571 6282608 5334355 549421 5673652 3820958 6019593 6534867 4355427 5762784 5706072 2234591 2820178 2278715 3091133 4481718 3857289 5889456 5442688 7894795 8209319 7842882 5976132 3774964 4103603 6291183 4145692 5274283 Glycerol 3-phosphate_C13-label-2 1912116 1434862 1462177 1246614 17936 1787813 1154521 1275152 98235 1711903 947474 1240373 1202017 1371841 862473 1419332 579357 2343234 2015111 1810136 1866277 1448137 1549652 1735228 1243022 1608005 2170011 1738465 16361 1766137 631257 966106 298392 550559 1586879 1509496 197009 1437358 2179607 2277026 2688637 2116451 1141903 1079396 1259309 986556 1555684 Glycerol 3-phosphate_C13-label-3 3827184 2149027 2326549 1853054 6903812 552892 2260249 3517423 2667282 5070011 2559857 2404424 2874313 2858746 2582143 2945443 124135 4049393 607632 4885895 4366919 4317334 4867339 4488825 2468722 3317067 5576106 4424076 4865708 4658727 2813171 3245088 1665397 1901791 4941877 5395703 6577905 4914664 6407153 6839659 10264009 6776482 4315918 3293343 3990815 3359705 3776663 UDP-N-acetylglucosamine_C12 PARENT 13855895 9399096 12450051 16701248 20714723 28949572 19243194 24785795 1766273 21000483 11325229 9824084 17459362 16348492 10890996 11420677 5329728 15719359 17335142 17171936 20010625 13289156 17376569 15122164 21689033 2384185 16961475 17245917 1621208 14168475 14216508 183983 8945725 12429143 17474402 17872386 19473395 14897898 20865058 17956188 22216933 24318612 16380186 13760959 24366975 12165571 15994247 UDP-N-acetylglucosamine_C13-label-1 359828 2573126 3325626 4561181 5288914 7351401 522713 6099478 3974768 4559004 2834241 3170609 4326609 4438709 3351526 3031953 1589199 432748 4462089 4336375 5582921 349812 4407181 4488684 5074418 5572079 5013859 4974052 480195 3704875 3997675 4914171 2693562 3570823 4634172 4308553 5071825 4221436 5934981 4788249 6113444 6042959 4288641 3631764 692031 3499925 4181235 UDP-N-acetylglucosamine_C13-label-2 1755239 12669 1117082 1595245 2373025 2780453 1871352 2383858 136322 1705749 1248387 1173346 1682962 166684 1103688 1501997 745466 2019773 181018 1961585 2244641 1614834 1690327 195829 2221078 2210147 229336 2267706 2094361 2037042 1540291 1915276 1106296 1538188 2017331 1934477 2049487 1851452 2378501 2301929 2799226 2552094 1716317 155837 2650363 1406378 2121731 UDP-N-acetylglucosamine_C13-label-3 90386 55634 693592 774815 1008153 173977 698455 1241009 750382 639786 720492 547686 809243 926276 106864 1054851 543087 1039054 1078008 1040821 1207413 765749 809559 963867 1016819 1154383 1560773 124869 1141956 837757 843918 903494 491176 710747 1422319 1137625 174172 1164586 1559817 1208516 196739 1540948 1036037 1143103 1670234 935546 917442 UDP-N-acetylglucosamine_C13-label-4 243924 337394 411821 41631 341424 632329 319523 51989 91019 16304 168595 323923 13357 210257 29197 285743 104254 553579 433928 320427 253899 234003 402841 473761 302466 450723 812747 624992 452867 445886 299394 424955 110012 51917 556585 61403 621658 520675 606959 457867 725169 735204 428277 502604 600722 406732 539014 UDP-N-acetylglucosamine_C13-label-5 76864 0 84299 0 137607 287673 0 191036 81265 90675 87143 67544 75744 81685 10361 89722 0 24826 198698 190004 193964 99726 244047 305809 112165 96673 342379 173726 104594 149487 82597 313822 70342 107026 296211 278804 237896 139206 325668 242303 456261 288745 164078 80878 121395 88121 218476 UDP-N-acetylglucosamine_C13-label-6 394274 180174 255006 87735 616163 643662 380718 441502 92366 140085 343407 213468 68342 33932 273417 309995 89221 438046 526237 311054 439498 230101 294921 409006 147138 454877 572994 521917 553376 391913 286061 433388 154133 136024 550539 539444 610932 519701 421936 489259 1075354 777673 447046 288602 624582 326291 27277 UDP-N-acetylglucosamine_C13-label-9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 75384 0 0 0 0 0 0 NAD_C12 PARENT 33272734 229447 26324366 30886825 49633275 4299735 41446791 44941803 403119 43958075 21866795 23683489 331327 28759712 26728712 34948888 12147041 31763053 27106512 34752891 38994116 33880731 41808847 46573488 43192075 52135547 49098716 47993884 38344538 51579766 29841238 37608372 27038112 33113594 38469366 24960112 33213203 4298315 37048259 3557435 531215 46735616 29801359 35977925 43201053 42772916 52015216 NAD_C13-label-1 8770669 6094739 6989552 7558915 14179636 12163165 11555291 12749165 1057866 1058981 6882543 6445262 8671249 8392798 7952452 9870888 3744485 9602078 7866849 8853896 11071998 9054707 12267529 11925479 12035488 14554025 15282145 15529889 12812166 15828297 8703437 10693778 79334 10041926 10371443 7362679 9814884 12388856 1121489 10089677 14147808 12379566 9075716 10737848 11890891 1269015 15841675 NAD_C13-label-14 6605 0 0 0 7472 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 NAD_C13-label-2 2650547 1924726 2095872 2705188 4265917 3274491 3375196 3520478 2436038 2690084 1855471 1999656 2664821 2666564 2614109 3084431 1262222 3115207 2403239 2774351 3490307 343463 416988 3611841 3671535 4452682 5567297 4893564 3302244 4950753 2427591 3115084 2297241 2915418 3449341 2430063 3052124 3917284 358998 3181026 5010201 3977316 2941843 345536 3905569 3880379 4867338 NAD_C13-label-3 880374 540828 859163 775089 150369 1409761 1064758 1280727 858473 832072 679258 64397 698546 895893 1353747 1766754 284989 1347133 1163263 1113147 1269598 1145502 1417783 1457972 1257508 1178756 2411657 1598102 136365 2003935 964455 1075361 868542 1057411 1304386 960012 1314056 1797965 1565525 1450115 2316783 1665801 994576 1662038 1407059 1533085 1769753 NAD_C13-label-4 451349 109493 21161 274318 691198 420022 19518 326205 241871 198393 384539 190365 17824 194729 505575 546434 106663 645803 266734 280544 556027 267293 70116 461017 439648 509059 922871 934033 495721 640105 413782 397373 396217 374169 45859 428471 412584 706938 754195 610911 762295 677589 41001 692521 467048 60223 770285 NAD_C13-label-5 102075 0 0 0 445433 279674 0 0 0 0 0 73001 0 83741 136414 182618 78098 133538 233048 108523 21057 78522 409587 278758 84477 19246 533196 437593 238266 415969 95013 138329 102918 30857 336614 173403 361495 262139 280599 14348 504636 178705 87906 390546 238157 227306 526374 NAD_C13-label-7 0 0 0 0 0 0 0 7444 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 UMP_C12 PARENT 2915295 12362831 1843712 39669716 42299172 42209441 3751295 25642533 21538281 32474084 21426373 19584595 20457075 16988578 16940973 16646127 8326254 223072 46747734 37485278 19199806 25791533 23645175 20476392 20151538 35186916 3432985 25236319 19921255 20489852 68345338 81120719 25085702 2162702 34026984 41862309 41536234 31989725 26736078 45882234 35522288 30651497 17548733 28312812 35974078 22331055 21297814 UMP_C13-label-1 3542152 1361308 1925721 4628207 4939654 4421504 4054232 316882 2386658 3247637 238595 2560078 2122517 1940038 2164539 185571 848919 2433552 5072632 4440877 2197158 2866143 2432471 2465547 2502942 372315 4044683 277277 2002785 2266401 7143484 8921735 3101083 2816676 3882212 4977035 4617712 3859468 298366 4616036 3540129 3131222 2075549 3355712 381634 2192852 2355533 UMP_C13-label-2 760845 275905 407557 777108 1080134 1056784 1012131 726206 739837 837614 505877 529807 524822 542504 334733 657822 228589 611587 1347268 1249506 65969 1015653 7852 724828 663044 951975 1059009 766632 570092 369986 1779984 1948931 662992 596755 996535 1244215 1408461 1023614 651731 1107252 862039 573645 512364 885308 885124 663729 621754 UMP_C13-label-3 185805 7926 0 230766 237862 408398 122107 142326 80077 209408 212337 103348 88008 77611 263739 10713 0 264877 703386 330059 125924 347715 225694 31426 119211 39661 382135 265456 170688 219946 48451 72401 188227 105343 358094 620432 682821 486757 273371 445136 243184 273786 94985 195712 172596 103853 88261 UMP_C13-label-4 0 0 0 93784 8679 97904 0 0 0 0 70744 9378 0 0 0 59129 0 0 191527 64712 77675 58812 72431 69193 0 0 87676 125819 69396 80397 185778 130324 69468 0 172693 229562 279113 104398 60188 7476 96499 0 0 147986 63041 0 0 UMP_C13-label-5 69079 0 0 71577 87276 92572 0 0 0 67698 67788 0 0 0 0 0 0 74723 131179 75475 0 65965 0 0 0 0 7811 65779 0 0 0 96527 0 106247 6974 155839 80697 73464 0 78437 66515 0 0 8066 0 68841 0 Creatine phosphate_C12 PARENT 126555912 92278681 98608706 64050606 62654444 91882069 73846069 40701516 65164494 42474022 4116345 42855728 89369781 145955288 34763247 59783394 2432547 48029528 27428509 583236 465527 31535772 1081985 5573115 41623603 61161912 74316094 88942731 74921919 74433875 144779862 186523638 755304 57292144 76678081 79816156 59640325 8083945 68655694 56334756 10251815 96382906 96861781 88003731 63039056 68676706 10289055 Creatine phosphate_C13-label-1 5252666 4040191 427907 2723685 2751071 375115 3093788 178674 2593969 1494229 1601723 1961022 3577152 5991477 1321957 2608498 1052398 2317155 1082304 2682776 1983879 1218391 427948 2368752 172951 271784 3372351 3764718 3132594 327668 6160292 8206899 3290976 2528708 33800 3302032 2308794 3509139 3080337 2369362 4441175 4099696 3694444 3649052 2786135 2808428 4441266 IMP_C12 PARENT 22574781 9958641 13083652 27066906 373847 37464072 33904322 2865215 23763856 34717047 9167802 8838037 23072742 18552006 15821642 14544584 4637718 14002356 26141412 29106462 28486772 24340967 23415708 19905161 19124077 28740269 33711522 30868094 20626212 16673061 37665466 46581325 19597014 22368114 23242655 27486809 2364302 20898227 271402 30370572 25001273 22693767 15987756 25358877 22437144 15557408 16222319 IMP_C13-label-1 2552417 113569 1607137 3037675 4268062 4283212 3509571 3412529 2215138 3942889 974017 1275848 2817584 2275434 1879624 181822 595451 1630429 3069379 3220882 3101256 2862859 2502038 265436 2154821 3135634 4414344 3276304 2468832 2235678 4082067 5808556 2284363 2342171 2924788 350555 2882823 2434637 3251596 3200951 3073558 2924535 1820693 2694452 2555602 1778076 2181812 IMP_C13-label-2 485929 109578 205578 610401 913164 691799 566251 68703 363223 808986 11135 100641 454699 449697 336036 430038 148475 278001 694196 737621 724303 656723 464436 606384 441258 671349 973121 61084 577191 434523 683567 986518 353321 408367 684196 648135 745571 560723 802214 837383 404306 597437 249786 480792 521583 393585 281357 IMP_C13-label-3 95992 0 9216 74676 99649 105291 0 91455 0 109467 0 72788 854 77429 114724 157982 0 82168 300849 87309 174158 196131 93101 80857 97115 0 317489 144361 93458 113064 8765 27563 169583 0 10295 236171 87879 95398 192275 20995 122914 218634 0 96757 78815 78242 6981 IMP_C13-label-5 0 0 0 0 67899 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 112964 0 0 0 97525 0 0 0 0 0 0 0 0 0 0 0 CDP-choline_C12 PARENT 21133127 10879876 14036798 21511005 61742081 66240144 47503909 66115369 28056541 41209375 16464177 16535792 38580622 33610053 27115669 33980453 7705766 22050362 39212647 34397162 47844266 41056378 30276109 27707797 39689759 469139 50247659 40111566 383567 499655 21941039 2442825 1796518 24081586 34130844 30597172 52761494 41896341 64451331 59315725 56212725 46685475 26519053 38900178 45329009 42594147 42907675 CDP-choline_C13-label-1 3496572 1969252 2176843 3601978 9722012 10162541 7117652 10861635 3892735 655173 2665504 2610108 6256492 550882 4503041 5447406 1207084 3497325 6325472 6063837 7830404 655565 5151125 4707201 6391827 7524301 7567152 6548546 6034975 7601648 3400664 38184 2909442 4378096 5474461 4476864 8356182 6545226 10120834 9921904 9011552 681413 4325328 6739881 727858 6001633 6786992 CDP-choline_C13-label-2 1006462 309434 427839 66319 1995251 2182113 1584174 2264491 1084863 1688092 56789 578925 1266409 1192492 959063 1207856 267792 868755 1369576 1258647 1608926 1586667 1120916 1072336 1407544 1445255 1909472 1607513 1470675 1836688 806592 898998 808281 969966 1166134 100428 2016589 1457483 2347921 2312076 1918803 1579757 872825 1517031 1658267 1502251 150274 CDP-choline_C13-label-3 0 0 69521 0 468349 396801 195208 428498 64261 178828 78815 0 218131 112581 177425 187245 0 72675 268465 166839 603867 33732 214717 208266 417174 19677 416614 256791 114963 387501 151257 0 0 93634 236288 105449 664036 272204 480434 489634 382688 256553 77898 303947 210681 120869 28296 CDP-choline_C13-label-4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 61487 0 0 0 0 67102 65732 76721 0 0 0 103406 0 0 0 0 0 0 0 0 0 97014 8526 0 0 90303 0 0 0 742 66665 0 CDP-choline_C13-label-5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 76594 0 91055 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Cystathionine_C12 PARENT 1794645 1346975 1029934 659761 2237516 2885474 4312446 2058031 624171 833207 212055 100008 859781 725559 438987 768089 88941 281571 750749 548923 337641 320109 184274 366129 718424 1026584 745412 925859 697634 929798 941072 1334425 889254 727176 748087 540879 1748174 1841736 983803 1870678 671822 953353 414941 611997 991322 920303 1043108 Aconitate_C12 PARENT 184304 73791 74143 133449 1044512 873546 59897 895514 481224 689781 406582 1283 601615 530388 473994 434714 93897 113557 439328 565444 473165 666867 502501 439384 521491 352325 368015 451753 282275 523207 131478 434589 295723 286161 405858 215522 540905 231397 891086 899888 48112 375802 263554 344511 711595 592228 387098 Aconitate_C13-label-1 0 0 0 0 0 0 0 0 0 122968 0 0 0 0 0 0 0 87852 97978 0 0 0 113557 118418 0 0 0 110098 108969 109339 0 0 0 0 0 121543 0 0 0 118361 0 116766 0 0 9285 0 0 Ribose 5-phosphate_C12 PARENT 1562625 217189 973146 1914206 132619 393446 404465 46232 1498611 2239556 627783 822859 1384047 1149179 114393 978104 364229 809776 1914226 1877108 942476 1118356 794857 870482 140405 529516 166354 210379 867827 537049 1812679 685791 1618025 399828 1459825 2090699 466081 1172548 1266407 1736917 26636 113405 178835 114425 1122327 987225 406058 Ribose 5-phosphate_C13-label-1 100142 83233 0 119312 78868 0 75287 0 172008 93171 88372 56156 83844 57349 0 0 0 0 151171 190195 73993 0 0 0 0 0 0 86682 0 0 289065 75997 58722 79117 202381 286612 0 6708 72045 311411 0 0 0 0 204315 80934 0 Ribose 5-phosphate_C13-label-2 0 0 66314 0 0 0 0 0 0 91247 0 0 71563 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 85156 0 0 83188 71305 78464 0 0 0 0 0 0 0 0 0 0 0 Glyceraldehyde-3-phosphate_C12 PARENT 1316481 501641 750119 934877 973677 1111773 732389 957104 1184946 1350618 525591 589744 924689 888531 433752 607103 1604 5343 510846 644853 605278 78124 807073 760294 687553 1735142 793283 583378 820639 596984 693185 804297 1050062 1249016 1198402 1420593 914757 736458 937013 1015582 385095 719032 590004 515392 1121608 844129 109804 CDP-ethanolamine_C12 PARENT 9123318 8545482 10288682 1390463 2253842 24869738 23250805 22623712 1610657 2665215 856108 9650459 13719198 12065176 11299441 14113108 3896988 12632981 16528989 1449127 17393767 15364641 15129691 13846719 15693933 241116 25789645 22203542 21303617 21521219 16633336 23198995 11521609 11670006 1371537 14718533 19630645 1794492 19616419 20739705 24407802 19457139 13403127 24329642 18593567 15310398 22271555 CDP-ethanolamine_C13-label-1 1298414 101135 1188183 1784768 3018528 3398711 2888387 3022665 2085258 269061 1208988 1183013 1785279 1674463 1634435 203832 521872 1588821 1885903 1696184 203209 2377093 2026226 1615073 2121852 3214517 3412198 2629365 2782482 2654908 2138702 3290356 1300387 1590482 1518495 2048173 2705574 2596026 2437101 2942684 2924103 2535594 2372266 352339 2605676 2132325 2526826 CDP-ethanolamine_C13-label-2 18647 322096 341643 532358 850862 843853 655356 744466 476025 0 248714 335767 370321 406679 479769 469536 0 408124 543836 393594 673796 456027 527044 436142 590897 851252 761802 649453 63752 646264 403729 674439 431882 306435 397472 576743 803509 705838 616319 652415 588807 637866 504177 697394 487256 487662 531902 CDP-ethanolamine_C13-label-3 0 0 0 0 0 77483 0 0 0 0 0 0 0 0 0 81564 0 0 0 0 0 0 64897 0 83223 100791 78541 0 0 64949 5929 0 0 0 0 0 93656 176635 0 0 0 76803 0 0 0 0 0 Fructose 6-phosphate_C12 PARENT 4082486 3004515 2463348 5585654 4816367 5562108 10051449 17169881 3229412 7716178 1796394 1879105 8757372 5523283 2360967 5859439 978751 4244291 3317188 3968769 6997641 4250813 2820643 3385918 3531022 8920359 3846857 4163643 2919883 2143113 1715326 4601164 935273 1178736 2947086 2128149 5996325 3653402 5391843 11363084 3440638 8739937 4134232 4333219 4453298 2121442 3976125 Fructose 6-phosphate_C13-label-1 736784 425316 410267 1042355 620747 763559 1004361 1356634 319354 742935 263849 366137 1038068 584462 385252 547797 15343 743561 541777 416688 744124 515202 290004 378186 576181 1295019 588346 590818 268758 336868 532479 567131 153045 170446 42683 414785 837778 491886 743136 1493027 548251 1057064 613575 814047 649473 241065 580651 Fructose 6-phosphate_C13-label-2 291611 288217 83081 339253 8708 17153 479558 488545 93913 207974 76909 111371 235723 156995 97128 120835 68731 206786 72616 232748 301446 94994 105589 127435 102623 393673 229612 220024 67947 81802 99918 256168 0 63714 112213 75628 348747 161595 128768 624525 11559 536649 241704 296835 214753 75645 204775 S-Adenosylmethionine_C12 PARENT 21939695 1256238 7272785 28362162 33995241 28031209 34710109 32580641 23018939 42324378 5965049 11220679 28406541 22640725 15712539 27007253 2021637 23153445 37909984 49144691 25438919 35454597 23776314 23377294 19358655 31832209 26203925 20580338 270020 26522934 47713362 10385715 15255005 23781202 28278184 39959312 26479656 33946531 36663275 46143153 32590472 28194147 17890183 22214723 37820947 25541417 24097802 S-Adenosylmethionine_C13-label-1 3862255 1973339 1119085 4727827 5369048 4854322 5591047 512824 3248053 699308 1083291 1991889 4469452 3661223 2575603 47844 412564 4331755 6428052 8006685 4843551 557936 4131131 4036291 348921 5521742 4903181 362073 4912393 4631278 7987141 170941 2776558 3929466 4841523 6941241 4552064 5713543 6477627 8207849 5529427 4831679 2946192 4381078 63430 4118371 3942162 S-Adenosylmethionine_C13-label-2 335801 147054 92871 365336 429358 482009 557642 607701 26113 61983 77574 107393 303639 455959 29156 547675 0 483346 849745 884962 606491 788007 482582 494444 281733 601521 4047 17992 673854 367834 795317 556353 337198 142682 45791 676016 34743 857076 827333 1185607 635195 678727 443353 62546 601319 542905 437533 CMP_C12 PARENT 3236428 5015557 273941 436627 154499 15672648 16694658 9868096 4505377 4643589 275628 2626288 3704057 3842392 5454211 355632 1225965 3246864 3702542 4206947 5005489 4053925 4584575 4181323 8271356 1461427 14157892 10829873 5414486 601295 4837263 40087984 2976637 8908827 4977457 4466869 16672833 525515 602211 5622746 11788048 9043178 6464639 10928951 5695147 4748812 9703638 O-Phosphorylethanolamine_C12 PARENT 414014675 2508379 238968075 406594375 5132378 49503615 55236725 5592302 3321460 58595015 2218042 251264125 4300746 352072825 304066875 43154625 95868969 4415846 49346715 5141690 386434775 47114075 387309175 387602675 310763275 54408975 4531748 371220125 45872735 4576818 57659975 63463165 292873325 222434075 44850895 42750155 54260635 56850425 4502898 57416025 76708565 3841928 258071675 65729815 49402105 42048185 381358725 O-Phosphorylethanolamine_C13-label-1 9650116 5671366 5536505 9349346 1207439 11907085 12282154 13375738 7996924 13631442 5026806 5812595 10363709 7959621 7159303 9997871 2284631 9927193 12059848 11391279 8869245 10472959 859583 8545382 7320294 12147062 10353777 9170412 10890531 10881531 13302425 14566489 6473139 4944346 10025235 962025 1258409 13133398 9751309 13251988 17855267 8572752 6224638 15641152 12066378 974925 9099525 Dimethyl-arginine_C12 PARENT 9561445 38503441 56182375 9414515 119032562 10984765 81711994 78653631 115621288 150203288 49130991 63178044 103312656 10968325 40167216 94081625 23310795 93761269 120420738 1455423 96466769 128022838 123701938 115745088 50747966 68551769 11844245 81503369 121412712 122067788 117417462 93682956 85965794 633558 145472238 135743538 75453525 1513764 1282653 12994885 65462181 60867938 41809075 50372625 136123962 108886162 684728 Dimethyl-arginine_C13-label-1 755524 202227 454917 794994 5061735 0 3432752 0 10283253 12672404 4052663 4962521 8622428 9021116 165861 7916034 1780371 8123998 10066074 1255842 8228138 10640537 10197203 9965231 2066706 2920774 0 3255655 10734835 10252419 9697175 4338164 6733401 0 12231629 11594512 2841897 13531977 11057421 11073696 3054978 2231567 1785956 2240317 11227898 9309754 28967 GMP_C12 PARENT 13745058 6597723 810001 22510855 349730 34710194 29315734 19119814 11887149 19500069 12479009 11229972 1480822 11279459 14725402 8043052 3808257 11014738 18635195 16481591 12722101 15350102 14502602 12369525 16174125 24800583 29961669 21964911 16370094 1867587 34247259 44386966 1303382 12352756 20029131 17809089 25606255 18941045 16779467 24661236 23803358 14715131 9797141 18742358 20437281 13045288 1538008 GMP_C13-label-1 1696202 771015 839168 2760768 438253 4380659 3236355 2188822 1327817 2265371 1679439 1557437 1657516 158715 1943721 1256159 567108 1556274 2731905 2115524 179796 2115103 2000904 1639639 1707863 283932 37699 3136413 2191343 215155 4304418 5765919 1761231 1489131 2717283 2517623 3274251 2460074 2273517 3609868 262454 1536165 1221712 2417884 2929282 1903475 2264953 GMP_C13-label-2 43306 203163 117038 701011 1012807 102843 509044 624183 279129 388226 389329 356581 284557 336383 476707 243014 78167 46829 901584 786859 507704 453276 459318 395504 492075 668422 1086588 83133 584815 639467 109844 1218309 361716 264244 597021 514083 9286 586276 715481 945289 914334 545427 131215 657719 617603 411549 521876 GMP_C13-label-3 100975 88158 114373 128048 55867 498388 23695 284943 0 79889 89112 103578 121849 75095 415002 140596 0 185796 251281 256682 182252 405847 192491 2764 82648 306267 419333 260676 285117 23068 42042 503639 77786 191534 152442 349935 619537 307172 282488 409091 599476 222077 84613 139049 265947 80457 123558 GMP_C13-label-4 66977 0 0 0 93175 97283 0 0 91912 0 0 89957 0 67828 0 7033 0 75657 111658 0 0 0 0 72496 0 0 122564 91809 67276 0 70242 124262 0 0 99248 87328 112656 107219 0 97871 97166 70106 0 957 74293 65246 0 GMP_C13-label-5 0 0 0 0 187704 0 0 0 0 0 0 0 0 0 69964 0 0 0 0 61882 0 0 0 73489 0 0 99688 87222 0 0 104126 0 0 0 0 75206 161025 73775 0 0 80021 0 0 70541 0 0 75498 ADP_C12 PARENT 8580594 4634761 5365945 27883559 16243714 18352044 16229431 21501631 10056106 16125252 12640573 13354667 13176014 14329573 10465468 1304611 4130985 22337044 18223719 20539908 13475439 12461823 21263731 16170839 11596146 16392117 15824864 12996803 1514088 11171737 18976675 24519175 6210613 7084548 11929759 1175758 13863844 1596455 13080657 21958017 30400612 1999947 7778903 23287677 15167983 8651504 10674438 ADP_C13-label-1 823996 652019 573683 3243373 2091113 1956939 1809656 2218531 1230362 1939318 1530638 1605809 1690828 1663839 1346871 1512958 579704 2581309 2179376 242945 1466874 1697073 2356111 2173451 151013 2101815 2014729 1620027 1667406 133158 2563911 2965675 778319 1058248 1650261 93412 1838628 1947971 1627162 2636747 3487142 2341223 1047554 2617612 1701604 101937 118782 ADP_C13-label-2 24563 74201 104581 844301 284553 613786 414229 526619 332902 459994 339636 497571 325744 470545 43498 40584 95297 810067 5628 698993 407915 274036 49337 511259 454435 525363 465892 43243 30215 345208 565181 701056 99203 200334 253261 0 507477 614191 42643 778515 953632 771521 211183 537875 48374 329831 250036 ADP_C13-label-3 0 0 0 175865 89396 74213 0 80689 0 71643 0 83023 0 179701 83029 102012 0 208969 144796 176652 83877 89051 181912 111472 0 0 74177 81286 0 0 83264 183406 0 0 6082 0 87522 154848 84763 124469 345916 227033 0 219181 62541 59873 0 Arginino-succinate_C12 PARENT 695775 498342 491009 1477423 168684 1291784 148288 1621998 1996992 1846828 550627 617904 814728 510341 1006277 859372 427587 1069407 1688458 1630576 13798 1569902 843075 143474 971764 1639964 235287 2086303 1273434 191164 1770547 2597298 188231 1762308 2705003 2245333 2233283 1976893 1939412 1752721 1363125 1499858 804563 1268323 1981254 1445389 2821077 Arginino-succinate_C13-label-1 0 0 65577 291665 131097 123484 89169 324935 287775 31094 0 0 75723 0 79523 86158 72585 102022 274816 268126 132388 222245 125251 107136 165896 24542 373941 319298 218181 255725 353218 458326 64427 88779 358749 408938 30589 121452 277278 127017 207228 97646 61544 89832 122093 106928 24494 Glucose 6-phosphate_C12 PARENT 5493178 1857024 4342872 7016023 741272 3337176 909163 1413518 4041896 12371718 3071517 373758 11324668 7899668 490481 8745198 1297271 5952384 4451779 5852232 9106312 620135 335652 434244 7125 1027421 605735 711597 403545 3547927 3104475 718541 1999372 2162323 4401406 2763669 747423 4100252 7435466 17330566 732898 924746 558556 1940437 6770629 3874018 861158 Glucose 6-phosphate_C13-label-1 1048694 78147 724555 1397723 0 9546 80076 93349 523597 1241143 38433 56334 1322717 967867 0 1069345 170735 917541 513386 730417 1385306 559334 451537 676686 71489 109679 727 68902 517907 495103 414252 0 157147 11079 792152 499694 74629 634386 1111288 2334424 84806 6736 0 71094 853783 552309 0 Glucose 6-phosphate_C13-label-2 359581 0 326032 547258 0 0 0 0 8763 351447 120831 107836 26213 216279 0 313568 89605 426246 166204 195435 44269 189074 136168 278564 0 0 0 0 167981 86411 96046 0 69838 0 12942 261569 0 11276 381941 1078286 0 0 0 0 232774 157999 0 Glucose 6-phosphate_C13-label-3 289282 0 225206 411717 0 0 0 0 216225 416718 113608 183409 294581 293956 0 201352 69999 226207 27905 348676 301742 29591 162826 88958 6156 0 0 0 300411 100823 135378 0 75251 0 334965 313774 0 318091 480369 78945 0 0 0 0 36725 225372 0 Phosphocholine_C12 PARENT 49913775 277938875 25373938 109945938 3162688 255619775 6079264 60100905 2026558 52466915 105841162 207096738 303678325 297780425 286345325 398595525 64395825 371768525 47138225 62241225 4971420 64990055 317658225 46664865 5195278 48519115 3644778 306415325 47264965 2361755 282263725 3466015 3131393 252396175 347211725 2173922 3417194 382307475 2298642 54906225 56799695 4577098 108932388 7083334 42332885 65788625 3085332 Phosphocholine_C13-label-1 26741444 15159755 1307831 5643433 16719862 1352743 329184 32780816 10971923 28315497 5412704 11162123 15154641 1607183 15110225 21340092 345141 20018023 2609397 33169528 27213103 359538 16699912 25163525 28858922 25853792 19620483 16595552 24433975 12527375 14748859 18367742 17185544 13705539 18103277 11877648 18348706 21156383 12762177 28311812 30276147 24577062 5683981 35786416 22536383 372163 16085561 Phosphocholine_C13-label-2 68844 0 0 0 0 0 99281 67449 0 80184 0 0 0 0 0 64135 0 0 88315 94634 70467 0 0 61634 0 55429 66812 0 0 0 0 0 0 0 0 0 0 50866 53101 90471 0 84989 0 124842 0 204956 0 UDP_C12 PARENT 365232 109904 3007029 4886488 490681 557449 448635 863777 4589995 4143381 2572197 2401536 4049299 3524469 38273 2696229 1429798 294773 3858962 3524985 5144662 269843 3814189 4675582 410576 481725 477904 299163 4264565 4004963 3974716 2247443 2738426 338716 5189182 3995972 428006 3690194 5435269 4905322 1218393 90204 36739 1025027 6274995 3261043 447241 UDP_C13-label-1 391327 66425 512327 348161 0 0 0 0 572433 480667 394206 286555 324022 402147 73097 270489 76938 447594 444299 331229 510954 320865 518261 511098 0 0 0 74619 445239 622156 38263 24225 369736 74517 670245 478663 0 422474 628153 394631 78784 73262 0 80246 618178 351599 0 Ornithine_C12 PARENT 17988067 1141371 7895556 5248747 1279945 1506636 2772879 17975961 6728946 15678738 3333454 4090807 17350442 17589698 1090672 16547795 1562439 7048205 29235109 18933652 15006483 19066048 13872473 1010894 683829 872267 12610 11084149 9506171 8966959 7279056 9319227 734812 7495616 13383095 10799106 783657 14778188 25794262 31544416 1433756 15218483 10756137 8854154 13345666 8181295 9299975 Arginine_C12 PARENT 114124362 99101225 783500 2104410 263450175 239627725 2282533 244293175 304543125 2943278 94425319 1170496 112308775 102001056 136614938 143046612 29389391 170851888 191648262 248889375 22454015 253382825 17481745 24065545 202841338 257474375 4031336 376802675 323073925 331635475 270211775 406363225 261934025 268853975 2740794 287582475 3103500 278564475 224239375 201453038 241845025 218269725 147326638 255432825 265441375 242402425 349351175 Arginine_C13-label-1 8242683 6810925 524685 1406932 19380895 16216702 15454928 16056105 19141486 19370405 6562818 810969 7020041 6924077 762861 9926521 2062788 11503388 13244452 16929177 14015225 17534312 11331905 16453505 14426398 16826564 29289234 2604518 2192478 23240831 18601188 28099025 1775645 18273464 19234988 202889 21475155 194314 14805812 14007533 15968312 15083081 10141309 18842155 17694644 1724622 24144894 CDP_C12 PARENT 175065 110433 104321 957686 103924 237413 273683 210701 272065 273925 125646 282098 7543 236825 136977 300738 116956 491355 674888 51226 260931 327916 628554 284465 141382 140571 234498 131692 109382 128019 1668177 1461565 245395 117602 330052 0 190226 537194 205023 371828 575849 391069 87234 56039 207799 233414 226362 CDP_C13-label-2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 80117 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 GDP_C12 PARENT 604013 102026 296339 1469968 615937 661196 523621 741447 807904 680297 541807 366576 566935 589982 444949 518581 231954 1075893 744113 1034914 746548 626144 1110617 762299 432491 640785 620201 476915 1000518 678122 2136884 1822677 303757 328943 77839 87046 215724 609569 506151 748563 1191745 692236 3591 844553 896872 60862 46697 GDP_C13-label-3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ATP_C12 PARENT 7431274 2304127 3347738 499058 2289885 2973466 2414938 2547006 8212659 9040472 3065227 2373755 6305362 7441513 622807 3087905 881883 6222313 2740435 4051736 6003549 3876275 5765751 7101214 7193941 4184502 2315721 5379795 9994309 5946545 2436849 860472 2647992 2604995 7533365 24147 1942097 4252536 7473699 4521911 2834657 2822035 4807752 1394629 961055 3779835 285835 NADP_C12 PARENT 281963 289789 245249 1284433 1038621 948556 994594 939424 734386 719938 72918 603365 545052 529996 58666 54931 226388 760059 497264 754787 497869 434216 801182 684073 1023529 949449 950572 1353313 884953 736498 2070363 2207203 416785 503273 401592 281512 807051 744918 28801 546002 936764 726634 593519 654471 674438 580734 889967 NADP_C13-label-1 82206 0 0 272923 150731 19173 104754 22326 112679 132365 85107 180799 87447 70758 73145 7213 0 28996 74084 97156 94281 82356 112486 193529 268566 180019 235997 28005 24028 173762 530168 704119 0 0 75175 81173 92283 868 0 92523 84022 84371 107353 197931 82487 0 0 Lysine_C12 PARENT 70448725 4594265 46138534 68525606 148380838 160633438 1138166 123621425 102357544 135623412 25666727 27891941 54702944 62763481 48180641 5698315 14038864 47600616 134930412 122722638 95702794 120443062 7509265 76215644 69460738 98893331 137467725 1074786 95471019 98338194 90708369 124124038 118774912 108850512 105906612 96128525 111114138 107929338 1194607 1194580 68377656 80563725 50739991 64369831 104811819 80464694 103055319 Glutathione Disulfide_C12 PARENT 8134965 3478446 8383458 14370459 9237544 6611607 6146025 8599199 7070168 9517173 294432 3010472 5983334 5251207 2525508 5165109 1421898 4407938 7702371 9588915 5910569 7545803 4072616 6028112 3898462 748642 6612587 6131731 4204696 5830596 11427128 15101936 6899685 5745607 7872827 20570469 6315272 6508676 6877184 902309 8298166 6852576 4206684 4443273 8307115 5911769 821923 Glutathione Disulfide_C13-label-1 2213289 968175 2350819 3484002 2248231 1934667 1625734 2088627 1861152 2440279 792951 834885 1364493 1262604 896031 1234936 302693 1264561 1822842 2449855 1653032 2122821 108436 1615519 751947 2334659 1803752 1562097 131909 1872274 2928466 3875402 1990292 1566617 2159604 5287275 1631083 2003451 2210567 2333788 211532 1355156 1119921 1154611 2132671 1643233 2163531 Glutathione Disulfide_C13-label-2 104493 105661 0 324902 305298 322007 130199 325995 113377 106053 78719 119102 73937 99328 114135 117744 911 173571 283068 0 127577 302367 108981 32164 77252 10038 1903 156087 115879 235672 159893 407277 123886 129887 278148 317661 211051 286828 258943 191859 136298 321899 125238 122421 293143 172503 145308 Glutathione Disulfide_C13-label-3 68615 0 0 120106 73339 0 0 94257 7696 73442 0 60843 0 61079 0 67112 0 0 64585 61442 7183 0 0 0 0 0 87261 72507 0 75593 54675 0 144039 62784 72235 91721 84731 87976 71314 6537 0 86664 0 0 0 0 81935 Glutathione Disulfide_C13-label-5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 68669 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 UTP_C12 PARENT 401029 132698 207861 405291 468182 496921 271344 439428 574201 397162 195046 95103 383003 412888 0 294825 0 384107 117363 129076 439253 290567 312409 470357 634429 73297 372332 488658 43541 252026 171794 125016 240873 306276 566499 0 448457 345449 283941 10891 544265 942999 528654 295484 650813 160748 553448 UTP_C13-label-1 0 0 0 0 79075 69453 0 0 74938 71188 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 72843 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 88378 0 0 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name medMz medRt Glycine_C12 PARENT 76.039764 6.953 Glycine_C13-label-1 77.043015 6.946 Glycine_C13-label-2 78.046455 6.946 Phenylacetaldehyde_C12 PARENT 121.064781 1.222 Phenylacetaldehyde_C13-label-1 122.068039 1.221 Phenylacetaldehyde_C13-label-2 123.071571 1.214 Phenylacetaldehyde_C13-label-8 129.090836 1.282 Tryptophanamide_C12 PARENT 204.112564 1.955 Tryptophanamide_C13-label-1 205.117676 1.973 Tryptophanamide_C13-label-3 207.122513 1.939 Tryptophanamide_C13-label-4 208.126114 1.947 Tryptophanamide_C13-label-5 209.12796 1.972 5-Deoxy-5-(methylthio)adenosine_C12 PARENT 298.095917 1.933 5-Deoxy-5-(methylthio)adenosine_C13-label-1 299.09964 1.948 5-Deoxy-5-(methylthio)adenosine_C13-label-10 308.132568 1.908 Nicotinamide_C12 PARENT 123.055168 1.948 Nicotinamide_C13-label-1 124.05854 1.948 Nicotinamide_C13-label-2 125.061668 1.948 N-Acetyl-Leucine_C12 PARENT 174.112213 1.998 N-Acetyl-Leucine_C13-label-1 175.115311 2.023 Adenine_C12 PARENT 136.061508 2.519 Adenine_C13-label-1 137.064835 2.521 Adenine_C13-label-2 138.068237 2.554 Adenosine_C12 PARENT 268.103424 2.648 Adenosine_C13-label-1 269.106537 2.65 Adenosine_C13-label-2 270.109528 2.659 Adenosine_C13-label-3 271.113647 2.664 Adenosine_C13-label-4 272.116669 2.654 Adenosine_C13-label-5 273.119995 2.662 Creatinine_C12 PARENT 114.066261 2.782 Creatinine_C13-label-1 115.069473 2.781 5-Methylcytosine_C12 PARENT 126.065979 2.859 Hypoxanthine_C12 PARENT 137.045441 3.447 Hypoxanthine_C13-label-1 138.048828 3.45 Hypoxanthine_C13-label-2 139.05217 3.472 Hypoxanthine_C13-label-4 141.060516 3.307 Cytosine_C12 PARENT 112.050636 3.132 Cytosine_C13-label-1 113.053879 3.142 Deoxycytidine_C12 PARENT 228.097366 3.139 Deoxycytidine_C13-label-1 229.100403 3.165 Tryptophan_C12 PARENT 205.096634 3.353 Tryptophan_C13-label-1 206.100601 3.345 Tryptophan_C13-label-2 207.103424 3.375 Guanine_C12 PARENT 152.056305 3.367 Guanine_C13-label-1 153.059601 3.375 Guanine_C13-label-2 154.063263 3.312 Acetylcholine_C12 PARENT 146.117188 2.544 Acetylcholine_C13-label-1 147.120529 2.546 Acetylcholine_C13-label-2 148.123978 2.535 Acetylcholine_C13-label-3 149.127533 2.542 Inosine_C12 PARENT 269.087189 3.453 Inosine_C13-label-1 270.09079 3.461 Inosine_C13-label-2 271.093903 3.479 Inosine_C13-label-3 272.097382 3.456 Inosine_C13-label-4 273.100647 3.458 Kynurenine_C12 PARENT 209.091675 3.551 Kynurenine_C13-label-1 210.095703 3.633 Phenylalanine_C12 PARENT 166.085907 3.549 Phenylalanine_C13-label-1 167.089264 3.576 Phenylalanine_C13-label-2 168.092789 3.556 Leucine_C12 PARENT 132.101593 3.569 Leucine_C13-label-1 133.104965 3.623 Leucine_C13-label-2 134.108414 3.677 Cytidine_C12 PARENT 244.092056 3.913 Cytidine_C13-label-1 245.095795 3.918 Cytidine_C13-label-2 246.098206 3.927 Cytidine_C13-label-3 247.101654 3.936 Cytidine_C13-label-5 249.109558 4.093 Isoleucine_C12 PARENT 132.101578 3.892 Isoleucine_C13-label-1 133.10498 3.891 Isoleucine_C13-label-2 134.108383 3.889 Methionine_C12 PARENT 150.057999 4.557 Methionine_C13-label-1 151.061096 4.552 Methionine_C13-label-2 152.064285 4.348 N-Acetylglycine_C12 PARENT 118.050056 4.709 Trimethylglycine (Betaine)_C12 PARENT 118.086082 4.696 Trimethylglycine (Betaine)_C13-label-1 119.089409 4.696 Trimethylglycine (Betaine)_C13-label-2 120.092743 4.7 Tyrosine_C12 PARENT 182.08075 5.027 Tyrosine_C13-label-1 183.084061 5.026 Choline_+Hac_C12 PARENT 164.127792 5.201 Choline_+Hac_C13-label-1 165.131073 5.201 Taurine_C12 PARENT 126.02182 5.437 Taurine_C13-label-1 127.025017 5.437 Methylnicotinamide_C12 PARENT 137.070541 5.097 Methylnicotinamide_C13-label-1 138.07402 5.099 Methylnicotinamide_C13-label-2 139.077316 5.078 Pipecolate_C12 PARENT 130.085953 5.457 Pipecolate_C13-label-1 131.089035 5.46 Proline_C12 PARENT 116.070625 5.655 Proline_C13-label-1 117.073868 5.655 Proline_C13-label-2 118.077179 5.652 Proline_C13-label-3 119.080917 5.705 Proline_C13-label-4 120.084221 5.672 Creatine_C12 PARENT 132.076538 6.42 Creatine_C13-label-1 133.079468 6.419 Creatine_C13-label-2 134.083023 6.42 Alanine_C12 PARENT 90.055214 6.455 Alanine_C13-label-1 91.058586 6.46 Alanine_C13-label-2 92.061958 6.464 Alanine_C13-label-3 93.065247 6.461 Hypotaurine_C12 PARENT 110.027046 6.426 Hypotaurine_C13-label-1 111.030411 6.427 trans-4-Hydroxy-L-proline_C12 PARENT 132.065521 6.462 trans-4-Hydroxy-L-proline_C13-label-1 133.06842 6.441 Threonine_C12 PARENT 120.06543 6.755 Threonine_C13-label-1 121.06881 6.757 Histamine_C12 PARENT 112.086922 6.174 Histamine_C13-label-1 113.090332 6.172 Carnitine_C12 PARENT 162.111938 6.596 Carnitine_C13-label-1 163.115234 6.596 Carnitine_C13-label-2 164.118774 6.596 Acetyl-arginine_C12 PARENT 217.128937 6.971 Acetyl-arginine_C13-label-1 218.132446 6.976 Glutamine_C12 PARENT 147.076065 7.321 Glutamine_C13-label-1 148.079285 7.321 Glutamine_C13-label-2 149.082825 7.322 Glutamine_C13-label-3 150.086014 7.325 Glutamine_C13-label-4 151.089584 7.333 Glutamine_C13-label-5 152.092758 7.272 S-Adenosyl-homocysteine_C12 PARENT 385.127716 7.436 S-Adenosyl-homocysteine_C13-label-1 386.131134 7.432 Serine_C12 PARENT 106.04995 7.467 Serine_C13-label-1 107.053253 7.472 Serine_C13-label-2 108.056465 7.464 Serine_C13-label-3 109.060028 7.473 Deoxycarnitine_C12 PARENT 146.117203 7.233 Deoxycarnitine_C13-label-1 147.120483 7.232 Deoxycarnitine_C13-label-2 148.123917 7.242 Deoxycarnitine_C13-label-5 151.13324 7.532 Asparagine_C12 PARENT 133.060272 7.601 Asparagine_C13-label-1 134.063446 7.606 Asparagine_C13-label-2 135.066956 7.621 Asparagine_C13-label-3 136.070419 7.628 Methyl-histidine_C12 PARENT 170.091904 7.822 Itaconic acid_C12 PARENT 131.033676 8.746 Itaconic acid_C13-label-1 132.03688 8.536 Itaconic acid_C13-label-2 133.040222 8.567 Citrulline_C12 PARENT 176.10257 7.884 Citrulline_C13-label-1 177.105835 7.881 Citrulline_C13-label-2 178.109451 7.885 Citrulline_C13-label-3 179.112839 7.845 Glycerophosphocholine_C12 PARENT 258.109406 7.72 Glycerophosphocholine_C13-label-1 259.113342 7.72 Glycerophosphocholine_C13-label-3 261.119171 7.736 Glycerophosphocholine_C13-label-4 262.123138 7.726 Glycerophosphocholine_C13-label-5 263.124512 7.736 N-Acetylneuraminic acid_C12 PARENT 310.112335 8.077 N-Acetylneuraminic acid_C13-label-1 311.115936 8.077 N-Acetylneuraminic acid_C13-label-2 312.118134 8.073 N-Acetylneuraminic acid_C13-label-3 313.122253 8.077 N-Acetylneuraminic acid_C13-label-4 314.12561 8.053 FAD_C12 PARENT 786.160278 8.728 FAD_C13-label-1 787.164856 8.703 N-Acetyl-aspartate_C12 PARENT 176.054962 8.699 Histidine_C12 PARENT 156.076309 8.817 Histidine_C13-label-1 157.079773 8.809 Glutamate_C12 PARENT 148.060028 8.746 Glutamate_C13-label-1 149.063446 8.745 Glutamate_C13-label-2 150.066696 8.753 Glutamate_C13-label-3 151.070114 8.743 Glutamate_C13-label-4 152.073334 8.754 Ophthalmate_C12 PARENT 290.13382 8.763 Ophthalmate_C13-label-1 291.137573 8.77 Ophthalmate_C13-label-2 292.139648 8.771 Ophthalmate_C13-label-3 293.143585 8.769 Glutathione_C12 PARENT 308.090027 8.844 Glutathione_C13-label-1 309.09375 8.818 Glutathione_C13-label-2 310.095764 8.829 Glutathione_C13-label-3 311.099457 8.839 Glutathione_C13-label-4 312.103333 8.829 Glutathione_C13-label-5 313.105286 8.757 NADH_C12 PARENT 666.129211 8.944 NADH_C13-label-1 667.132385 8.929 NADH_C13-label-19 685.198486 8.947 NADH_C13-label-3 669.142212 8.858 NADH_C13-label-4 670.14209 8.914 Aspartate_C12 PARENT 134.044464 8.913 Aspartate_C13-label-1 135.047836 8.914 Aspartate_C13-label-2 136.051132 8.9 Aspartate_C13-label-3 137.054611 8.903 Glutaryl-Carnitine_C12 PARENT 276.143463 8.8 Glutaryl-Carnitine_C13-label-1 277.146759 8.794 2-Aminoadipic acid_C12 PARENT 162.075607 9.031 2-Aminoadipic acid_C13-label-1 163.078812 9.025 Acetyl CoA_C12 PARENT 810.129028 9.493 Acetyl CoA_C13-label-1 811.131775 9.52 Acetyl CoA_C13-label-12 822.172668 9.589 Acetyl CoA_C13-label-18 828.192322 9.621 ADP-ribose_C12 PARENT 560.077637 9.553 ADP-ribose_C13-label-1 561.0802 9.556 ADP-ribose_C13-label-2 562.082642 9.561 ADP-ribose_C13-label-3 563.086548 9.543 ADP-ribose_C13-label-5 565.090942 9.765 AMP_C12 PARENT 348.069427 9.618 AMP_C13-label-1 349.07309 9.608 AMP_C13-label-2 350.07486 9.615 AMP_C13-label-3 351.079132 9.622 AMP_C13-label-4 352.082672 9.624 AMP_C13-label-5 353.085999 9.62 Glycerol 3-phosphate_C12 PARENT 173.020523 9.725 Glycerol 3-phosphate_C13-label-1 174.023926 9.72 Glycerol 3-phosphate_C13-label-2 175.027664 9.722 Glycerol 3-phosphate_C13-label-3 176.030624 9.717 UDP-N-acetylglucosamine_C12 PARENT 608.087585 9.951 UDP-N-acetylglucosamine_C13-label-1 609.09021 9.955 UDP-N-acetylglucosamine_C13-label-2 610.093079 9.957 UDP-N-acetylglucosamine_C13-label-3 611.096558 9.961 UDP-N-acetylglucosamine_C13-label-4 612.099609 9.958 UDP-N-acetylglucosamine_C13-label-5 613.102966 9.963 UDP-N-acetylglucosamine_C13-label-6 614.106995 9.96 UDP-N-acetylglucosamine_C13-label-9 617.115479 9.697 NAD_C12 PARENT 664.114319 9.713 NAD_C13-label-1 665.117188 9.713 NAD_C13-label-14 678.166992 9.751 NAD_C13-label-2 666.119873 9.711 NAD_C13-label-3 667.123291 9.713 NAD_C13-label-4 668.126831 9.716 NAD_C13-label-5 669.130188 9.711 NAD_C13-label-7 671.135498 9.483 UMP_C12 PARENT 325.042175 10.021 UMP_C13-label-1 326.045776 10.033 UMP_C13-label-2 327.047729 10.037 UMP_C13-label-3 328.051971 10.021 UMP_C13-label-4 329.055573 10.067 UMP_C13-label-5 330.059387 10.024 Creatine phosphate_C12 PARENT 212.042694 10.175 Creatine phosphate_C13-label-1 213.045914 10.174 IMP_C12 PARENT 349.053467 10.164 IMP_C13-label-1 350.056976 10.165 IMP_C13-label-2 351.058746 10.168 IMP_C13-label-3 352.063263 10.206 IMP_C13-label-5 354.070312 10.064 CDP-choline_C12 PARENT 489.113251 9.965 CDP-choline_C13-label-1 490.117004 9.977 CDP-choline_C13-label-2 491.118683 9.98 CDP-choline_C13-label-3 492.122101 9.972 CDP-choline_C13-label-4 493.12616 10.015 CDP-choline_C13-label-5 494.130646 9.908 Cystathionine_C12 PARENT 223.07431 9.987 Aconitate_C12 PARENT 175.024323 9.734 Aconitate_C13-label-1 176.027023 9.827 Ribose 5-phosphate_C12 PARENT 231.026016 10.076 Ribose 5-phosphate_C13-label-1 232.029251 10.068 Ribose 5-phosphate_C13-label-2 233.0327 10.152 Glyceraldehyde-3-phosphate_C12 PARENT 171.004883 9.76 CDP-ethanolamine_C12 PARENT 447.066406 10.154 CDP-ethanolamine_C13-label-1 448.070129 10.157 CDP-ethanolamine_C13-label-2 449.071289 10.151 CDP-ethanolamine_C13-label-3 450.075592 10.091 Fructose 6-phosphate_C12 PARENT 261.036255 11.165 Fructose 6-phosphate_C13-label-1 262.039825 11.145 Fructose 6-phosphate_C13-label-2 263.042847 11.138 S-Adenosylmethionine_C12 PARENT 399.143524 10.13 S-Adenosylmethionine_C13-label-1 400.147064 10.122 S-Adenosylmethionine_C13-label-2 401.150391 10.132 CMP_C12 PARENT 324.058411 10.405 O-Phosphorylethanolamine_C12 PARENT 142.026001 10.403 O-Phosphorylethanolamine_C13-label-1 143.029373 10.398 Dimethyl-arginine_C12 PARENT 203.14975 9.305 Dimethyl-arginine_C13-label-1 204.153229 9.388 GMP_C12 PARENT 364.064392 10.846 GMP_C13-label-1 365.068176 10.841 GMP_C13-label-2 366.070007 10.848 GMP_C13-label-3 367.074249 10.839 GMP_C13-label-4 368.077881 10.871 GMP_C13-label-5 369.080841 10.763 ADP_C12 PARENT 428.035675 10.764 ADP_C13-label-1 429.039093 10.756 ADP_C13-label-2 430.040771 10.757 ADP_C13-label-3 431.04483 10.759 Arginino-succinate_C12 PARENT 291.128967 11.113 Arginino-succinate_C13-label-1 292.132294 11.115 Glucose 6-phosphate_C12 PARENT 261.036285 11.777 Glucose 6-phosphate_C13-label-1 262.039703 11.734 Glucose 6-phosphate_C13-label-2 263.042664 11.743 Glucose 6-phosphate_C13-label-3 264.046417 11.766 Phosphocholine_C12 PARENT 184.072952 11.023 Phosphocholine_C13-label-1 185.076218 11.023 Phosphocholine_C13-label-2 186.080353 11.062 UDP_C12 PARENT 405.008362 10.779 UDP_C13-label-1 406.011719 10.773 Ornithine_C12 PARENT 133.096786 10.786 Arginine_C12 PARENT 175.1185 10.328 Arginine_C13-label-1 176.121964 10.339 CDP_C12 PARENT 404.024323 12.2 CDP_C13-label-2 406.029388 11.648 GDP_C12 PARENT 444.030334 12.462 GDP_C13-label-3 447.039734 12.756 ATP_C12 PARENT 508.001831 12.542 NADP_C12 PARENT 744.079285 12.942 NADP_C13-label-1 745.082825 12.934 Lysine_C12 PARENT 147.112381 10.969 Glutathione Disulfide_C12 PARENT 613.157288 13.139 Glutathione Disulfide_C13-label-1 614.160156 13.128 Glutathione Disulfide_C13-label-2 615.16156 13.145 Glutathione Disulfide_C13-label-3 616.165955 13.13 Glutathione Disulfide_C13-label-5 618.181091 13.156 UTP_C12 PARENT 484.974426 12.908 UTP_C13-label-1 485.977539 12.89 METABOLITES_END #END