#METABOLOMICS WORKBENCH jmhoffm_20210901_060953 DATATRACK_ID:2819 STUDY_ID:ST001926 ANALYSIS_ID:AN003131 VERSION 1 CREATED_ON 02-08-2024 #PROJECT PR:PROJECT_TITLE Modular evolution of the Drosophila metabolome PR:PROJECT_SUMMARY Analyze targeted and untargeted metabolomic profiles of 11 species of Drosophila PR:INSTITUTE University of Washington PR:LAST_NAME Hoffman PR:FIRST_NAME Jessica PR:ADDRESS 1300 University Blvd, CH464 PR:EMAIL jmhoffm@uab.edu PR:PHONE 6789100585 PR:DOI http://dx.doi.org/10.21228/M8J11K #STUDY ST:STUDY_TITLE Modular evolution of the Drosophila metabolome ST:STUDY_SUMMARY In this study, we look at both targeted and untargeted metabolomic data from ST:STUDY_SUMMARY both sexes and 11 species of Drosophila. For the targeted analysis, we also ST:STUDY_SUMMARY looked at two ages to understand conserved changes with age in the Drosophila ST:STUDY_SUMMARY genus. ST:INSTITUTE University of Washington ST:LAST_NAME Promislow ST:FIRST_NAME Daniel ST:ADDRESS 1959 NE Pacific Street, Seattle, Washington, 98195, USA ST:EMAIL promislo@uw.edu ST:PHONE 206-616-6994 ST:SUBMIT_DATE 2021-09-01 #SUBJECT SU:SUBJECT_TYPE Invertebrate SU:SUBJECT_SPECIES Drosophila melanogaster SU:TAXONOMY_ID 7227 SU:GENDER Male and female #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS - 119 Line:Ana-00 | Sex:females | Species:ananassae | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-119.mzXML Neg-FLY-119.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 74 Line:Ana-00 | Sex:females | Species:ananassae | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-074.mzXML Neg-FLY-074.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 76 Line:Ana-00 | Sex:females | Species:ananassae | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-076.mzXML Neg-FLY-076.mzXML; 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RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.60 Line:ana-12 | Sex:M | Species:ananassae | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.60; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.4 Line:ana-12 | Sex:M | Species:ananassae | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.4; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 117 Line:Ana-15 | Sex:females | Species:ananassae | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-117.mzXML Neg-FLY-117.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 143 Line:Ana-15 | Sex:females | Species:ananassae | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-143.mzXML Neg-FLY-143.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 152 Line:Ana-15 | Sex:females | Species:ananassae | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-152.mzXML Neg-FLY-152.mzXML; RAW_FILE_NAME=POS mzXML.zip; 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RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.63 Line:ere-00 | Sex:F | Species:erecta | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.63; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.7 Line:ere-00 | Sex:F | Species:erecta | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.7; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 11 Line:Ere-00 | Sex:males | Species:erecta | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-011.mzXML Neg-FLY-011.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 123 Line:Ere-00 | Sex:males | Species:erecta | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-123.mzXML Neg-FLY-123.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 130 Line:Ere-00 | Sex:males | Species:erecta | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-130.mzXML Neg-FLY-130.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.64 Line:ere-00 | Sex:M | Species:erecta | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.64; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.8 Line:ere-00 | Sex:M | Species:erecta | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.8; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 154 Line:Mel-14 | Sex:females | Species:melanogaster | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-154.mzXML Neg-FLY-154.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 163 Line:Mel-14 | Sex:females | Species:melanogaster | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-163.mzXML Neg-FLY-163.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 62 Line:Mel-14 | Sex:females | Species:melanogaster | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-062.mzXML Neg-FLY-062.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.97 Line:mel-14 | Sex:F | Species:melanogaster | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.97; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.9 Line:mel-14 | Sex:F | Species:melanogaster | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.9; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 104 Line:Mel-14 | Sex:males | Species:melanogaster | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-104.mzXML Neg-FLY-104.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 148 Line:Mel-14 | Sex:males | Species:melanogaster | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-148.mzXML Neg-FLY-148.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 84 Line:Mel-14 | Sex:males | Species:melanogaster | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-084.mzXML Neg-FLY-084.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.10 Line:mel-14 | Sex:M | Species:melanogaster | Age:5 Dataset=Targeted; 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RAW_FILE_NAME=Pos-FLY-004.mzXML Neg-FLY-004.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 51 Line:MJCI-2008 | Sex:females | Species:mojavensis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-051.mzXML Neg-FLY-051.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 121 Line:MJCI-2008 | Sex:males | Species:mojavensis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-121.mzXML Neg-FLY-121.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 147 Line:MJCI-2008 | Sex:males | Species:mojavensis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-147.mzXML Neg-FLY-147.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 9 Line:MJCI-2008 | Sex:males | Species:mojavensis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-009.mzXML Neg-FLY-009.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.85 Line:moj-1002 | Sex:F | Species:mojavensis | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.85; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.15 Line:moj-1002 | Sex:F | Species:mojavensis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.15; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.16 Line:moj-1002 | Sex:M | Species:mojavensis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.16; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.86 Line:moj-2008 | Sex:F | Species:mojavensis | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.86; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.17 Line:moj-2008 | Sex:F | Species:mojavensis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.17; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.87 Line:moj-2008 | Sex:M | Species:mojavensis | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.87; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.18 Line:moj-2008 | Sex:M | Species:mojavensis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.18; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 110 Line:Per-02 | Sex:females | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-110.mzXML Neg-FLY-110.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 137 Line:Per-02 | Sex:females | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-137.mzXML Neg-FLY-137.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 157 Line:Per-02 | Sex:females | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-157.mzXML Neg-FLY-157.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.19 Line:per-02 | Sex:F | Species:persimilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.19; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 156 Line:Per-02 | Sex:males | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-156.mzXML Neg-FLY-156.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 24 Line:Per-02 | Sex:males | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-024.mzXML Neg-FLY-024.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 3 Line:Per-02 | Sex:males | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-003.mzXML Neg-FLY-003.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.20 Line:per-02 | Sex:M | Species:persimilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.20; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 102 Line:Per-17 | Sex:females | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-102.mzXML Neg-FLY-102.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 109 Line:Per-17 | Sex:females | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-109.mzXML Neg-FLY-109.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 52 Line:Per-17 | Sex:females | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-052.mzXML Neg-FLY-052.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.21 Line:per-17 | Sex:F | Species:persimilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.21; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 32 Line:Per-17 | Sex:males | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-032.mzXML Neg-FLY-032.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 68 Line:Per-17 | Sex:males | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-068.mzXML Neg-FLY-068.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 71 Line:Per-17 | Sex:males | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-071.mzXML Neg-FLY-071.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.22 Line:per-17 | Sex:M | Species:persimilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.22; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 106 Line:Per-23 | Sex:females | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-106.mzXML Neg-FLY-106.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 44 Line:Per-23 | Sex:females | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-044.mzXML Neg-FLY-044.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 97 Line:Per-23 | Sex:females | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-097.mzXML Neg-FLY-097.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.23 Line:per-23 | Sex:F | Species:persimilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.23; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 141 Line:Per-23 | Sex:males | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-141.mzXML Neg-FLY-141.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 146 Line:Per-23 | Sex:males | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-146.mzXML Neg-FLY-146.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 8 Line:Per-23 | Sex:males | Species:persimilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-008.mzXML Neg-FLY-008.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.24 Line:per-23 | Sex:M | Species:persimilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.24; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 66 Line:Pse-217 | Sex:females | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-066.mzXML Neg-FLY-066.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 69 Line:Pse-217 | Sex:females | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-069.mzXML Neg-FLY-069.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 88 Line:Pse-217 | Sex:females | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-088.mzXML Neg-FLY-088.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.69 Line:pse-217 | Sex:F | Species:pseudoobscura | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.69; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.25 Line:pse-217 | Sex:F | Species:pseudoobscura | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.25; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 125 Line:Pse-217 | Sex:males | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-125.mzXML Neg-FLY-125.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 20 Line:Pse-217 | Sex:males | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-020.mzXML Neg-FLY-020.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 91 Line:Pse-217 | Sex:males | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-091.mzXML Neg-FLY-091.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.70 Line:pse-217 | Sex:M | Species:pseudoobscura | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.70; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.26 Line:pse-217 | Sex:M | Species:pseudoobscura | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.26; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 114 Line:Pse-33 | Sex:females | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-114.mzXML Neg-FLY-114.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 120 Line:Pse-33 | Sex:females | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-120.mzXML Neg-FLY-120.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 57 Line:Pse-33 | Sex:females | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-057.mzXML Neg-FLY-057.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.67 Line:pse-33 | Sex:F | Species:pseudoobscura | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.67; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.27 Line:pse-33 | Sex:F | Species:pseudoobscura | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.27; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 101 Line:Pse-33 | Sex:males | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-101.mzXML Neg-FLY-101.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 118 Line:Pse-33 | Sex:males | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-118.mzXML Neg-FLY-118.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 33 Line:Pse-33 | Sex:males | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-033.mzXML Neg-FLY-033.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.28 Line:pse-33 | Sex:M | Species:pseudoobscura | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.28; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 15 Line:Pse-96 | Sex:females | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-015.mzXML Neg-FLY-015.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 159 Line:Pse-96 | Sex:females | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-159.mzXML Neg-FLY-159.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 18 Line:Pse-96 | Sex:females | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-018.mzXML Neg-FLY-018.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.68 Line:pse-96 | Sex:F | Species:pseudoobscura | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.68; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.29 Line:pse-96 | Sex:F | Species:pseudoobscura | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.29; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 26 Line:Pse-96 | Sex:males | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-026.mzXML Neg-FLY-026.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 28 Line:Pse-96 | Sex:males | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-028.mzXML Neg-FLY-028.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 67 Line:Pse-96 | Sex:males | Species:pseudoobscura | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-067.mzXML Neg-FLY-067.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.30 Line:pse-96 | Sex:M | Species:pseudoobscura | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.30; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 48 Line:Sec-07 | Sex:females | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-048.mzXML Neg-FLY-048.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 60 Line:Sec-07 | Sex:females | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-060.mzXML Neg-FLY-060.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 90 Line:Sec-07 | Sex:females | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-090.mzXML Neg-FLY-090.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.71 Line:sec-07 | Sex:F | Species:sechellia | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.71; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.31 Line:sec-07 | Sex:F | Species:sechellia | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.31; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 129 Line:Sec-07 | Sex:males | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-129.mzXML Neg-FLY-129.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 149 Line:Sec-07 | Sex:males | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-149.mzXML Neg-FLY-149.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 85 Line:Sec-07 | Sex:males | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-085.mzXML Neg-FLY-085.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.72 Line:sec-07 | Sex:M | Species:sechellia | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.72; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.32 Line:sec-07 | Sex:M | Species:sechellia | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.32; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 116 Line:Sec-28 | Sex:females | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-116.mzXML Neg-FLY-116.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 35 Line:Sec-28 | Sex:females | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-035.mzXML Neg-FLY-035.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 39 Line:Sec-28 | Sex:females | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-039.mzXML Neg-FLY-039.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.73 Line:sec-28 | Sex:F | Species:sechellia | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.73; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.33 Line:sec-28 | Sex:F | Species:sechellia | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.33; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 170 Line:Sec-28 | Sex:males | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-170.mzXML Neg-FLY-170.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 36 Line:Sec-28 | Sex:males | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-036.mzXML Neg-FLY-036.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 53 Line:Sec-28 | Sex:males | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-053.mzXML Neg-FLY-053.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.74 Line:sec-28 | Sex:M | Species:sechellia | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.74; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.34 Line:sec-28 | Sex:M | Species:sechellia | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.34; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 30 Line:Sec-31 | Sex:females | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-030.mzXML Neg-FLY-030.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 5 Line:Sec-31 | Sex:females | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-005.mzXML Neg-FLY-005.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 65 Line:Sec-31 | Sex:females | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-065.mzXML Neg-FLY-065.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.75 Line:sec-31 | Sex:F | Species:sechellia | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.75; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.35 Line:sec-31 | Sex:F | Species:sechellia | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.35; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 139 Line:Sec-31 | Sex:males | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-139.mzXML Neg-FLY-139.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 29 Line:Sec-31 | Sex:males | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-029.mzXML Neg-FLY-029.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 31 Line:Sec-31 | Sex:males | Species:sechellia | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-031.mzXML Neg-FLY-031.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.36 Line:sec-31 | Sex:M | Species:sechellia | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.36; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 127 Line:Sim-006 | Sex:females | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-127.mzXML Neg-FLY-127.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 150 Line:Sim-006 | Sex:females | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-150.mzXML Neg-FLY-150.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 49 Line:Sim-006 | Sex:females | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-049.mzXML Neg-FLY-049.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.88 Line:sim-006 | Sex:F | Species:simulans | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.88; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.37 Line:sim-006 | Sex:F | Species:simulans | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.37; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 171 Line:Sim-006 | Sex:males | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-171.mzXML Neg-FLY-171.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 46 Line:Sim-006 | Sex:males | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-046.mzXML Neg-FLY-046.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.89 Line:sim-006 | Sex:M | Species:simulans | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.89; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.38 Line:sim-006 | Sex:M | Species:simulans | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.38; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 128 Line:Sim-286 | Sex:females | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-128.mzXML Neg-FLY-128.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 59 Line:Sim-286 | Sex:females | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-059.mzXML Neg-FLY-059.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 98 Line:Sim-286 | Sex:females | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-098.mzXML Neg-FLY-098.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.76 Line:sim-286 | Sex:F | Species:simulans | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.76; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.39 Line:sim-286 | Sex:F | Species:simulans | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.39; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 108 Line:Sim-286 | Sex:males | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-108.mzXML Neg-FLY-108.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 2 Line:Sim-286 | Sex:males | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-002.mzXML Neg-FLY-002.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 6 Line:Sim-286 | Sex:males | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-006.mzXML Neg-FLY-006.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.77 Line:sim-286 | Sex:M | Species:simulans | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.77; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.40 Line:sim-286 | Sex:M | Species:simulans | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.40; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 103 Line:Sim-287 | Sex:females | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-103.mzXML Neg-FLY-103.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 124 Line:Sim-287 | Sex:females | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-124.mzXML Neg-FLY-124.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 94 Line:Sim-287 | Sex:females | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-094.mzXML Neg-FLY-094.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.78 Line:sim-287 | Sex:F | Species:simulans | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.78; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.41 Line:sim-287 | Sex:F | Species:simulans | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.41; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 133 Line:Sim-287 | Sex:males | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-133.mzXML Neg-FLY-133.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 38 Line:Sim-287 | Sex:males | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-038.mzXML Neg-FLY-038.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 89 Line:Sim-287 | Sex:males | Species:simulans | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-089.mzXML Neg-FLY-089.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.79 Line:sim-287 | Sex:M | Species:simulans | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.79; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.42 Line:sim-287 | Sex:M | Species:simulans | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.42; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 115 Line:Vir-00 | Sex:females | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-115.mzXML Neg-FLY-115.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 56 Line:Vir-00 | Sex:females | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-056.mzXML Neg-FLY-056.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 79 Line:Vir-00 | Sex:females | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-079.mzXML Neg-FLY-079.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.80 Line:vir-00 | Sex:F | Species:virilis | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.80; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.43 Line:vir-00 | Sex:F | Species:virilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.43; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 126 Line:Vir-00 | Sex:males | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-126.mzXML Neg-FLY-126.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 21 Line:Vir-00 | Sex:males | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-021.mzXML Neg-FLY-021.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 86 Line:Vir-00 | Sex:males | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-086.mzXML Neg-FLY-086.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.90 Line:vir-00 | Sex:M | Species:virilis | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.90; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.44 Line:vir-00 | Sex:M | Species:virilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.44; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 168 Line:Vir-08 | Sex:females | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-168.mzXML Neg-FLY-168.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 47 Line:Vir-08 | Sex:females | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-047.mzXML Neg-FLY-047.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 78 Line:Vir-08 | Sex:females | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-078.mzXML Neg-FLY-078.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.45 Line:vir-08 | Sex:F | Species:virilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.45; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 17 Line:Vir-08 | Sex:males | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-017.mzXML Neg-FLY-017.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 25 Line:Vir-08 | Sex:males | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-025.mzXML Neg-FLY-025.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 81 Line:Vir-08 | Sex:males | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-081.mzXML Neg-FLY-081.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.81 Line:vir-08 | Sex:M | Species:virilis | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.81; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.46 Line:vir-08 | Sex:M | Species:virilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.46; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 10 Line:Vir-48 | Sex:females | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-010.mzXML Neg-FLY-010.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 142 Line:Vir-48 | Sex:females | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-142.mzXML Neg-FLY-142.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 82 Line:Vir-48 | Sex:females | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-082.mzXML Neg-FLY-082.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.82 Line:vir-48 | Sex:F | Species:virilis | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.82; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.47 Line:vir-48 | Sex:F | Species:virilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.47; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 165 Line:Vir-48 | Sex:males | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-165.mzXML Neg-FLY-165.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 99 Line:Vir-48 | Sex:males | Species:virilis | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-099.mzXML Neg-FLY-099.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.83 Line:vir-48 | Sex:M | Species:virilis | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.83; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.48 Line:vir-48 | Sex:M | Species:virilis | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.48; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 144 Line:Wil-02 | Sex:females | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-144.mzXML Neg-FLY-144.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 54 Line:Wil-02 | Sex:females | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-054.mzXML Neg-FLY-054.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 63 Line:Wil-02 | Sex:females | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-063.mzXML Neg-FLY-063.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.92 Line:wil-02 | Sex:F | Species:willistoni | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.92; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.49 Line:wil-02 | Sex:F | Species:willistoni | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.49; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 155 Line:Wil-02 | Sex:males | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-155.mzXML Neg-FLY-155.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 40 Line:Wil-02 | Sex:males | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-040.mzXML Neg-FLY-040.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 95 Line:Wil-02 | Sex:males | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-095.mzXML Neg-FLY-095.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 23 Line:Wil-03 | Sex:females | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-023.mzXML Neg-FLY-023.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 93 Line:Wil-03 | Sex:females | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-093.mzXML Neg-FLY-093.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 1 Line:Wil-03 | Sex:males | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-001.mzXML Neg-FLY-001.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 58 Line:Wil-03 | Sex:males | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-058.mzXML Neg-FLY-058.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 92 Line:Wil-03 | Sex:males | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-092.mzXML Neg-FLY-092.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 153 Line:Wil-15 | Sex:females | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-153.mzXML Neg-FLY-153.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 45 Line:Wil-15 | Sex:females | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-045.mzXML Neg-FLY-045.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 55 Line:Wil-15 | Sex:females | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-055.mzXML Neg-FLY-055.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.93 Line:wil-15 | Sex:F | Species:willistoni | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.93; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.53 Line:wil-15 | Sex:F | Species:willistoni | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.53; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 100 Line:Wil-15 | Sex:males | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-100.mzXML Neg-FLY-100.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 161 Line:Wil-15 | Sex:males | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-161.mzXML Neg-FLY-161.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 172 Line:Wil-15 | Sex:males | Species:willistoni | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-172.mzXML Neg-FLY-172.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.94 Line:wil-15 | Sex:M | Species:willistoni | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.94; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.54 Line:wil-15 | Sex:M | Species:willistoni | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.54; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 131 Line:Yak-00 | Sex:females | Species:yakuba | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-131.mzXML Neg-FLY-131.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 160 Line:Yak-00 | Sex:females | Species:yakuba | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-160.mzXML Neg-FLY-160.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 72 Line:Yak-00 | Sex:females | Species:yakuba | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-072.mzXML Neg-FLY-072.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.95 Line:yak-00 | Sex:F | Species:yakuba | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.95; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.55 Line:yak-00 | Sex:F | Species:yakuba | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.55; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - 140 Line:Yak-00 | Sex:males | Species:yakuba | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-140.mzXML Neg-FLY-140.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 16 Line:Yak-00 | Sex:males | Species:yakuba | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-016.mzXML Neg-FLY-016.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - 22 Line:Yak-00 | Sex:males | Species:yakuba | Age:- Dataset=Untargeted; RAW_FILE_NAME=Pos-FLY-022.mzXML Neg-FLY-022.mzXML; RAW_FILE_NAME=POS mzXML.zip; RAW_FILE_NAME=NEG mzXML.zip SUBJECT_SAMPLE_FACTORS - tube.96 Line:yak-00 | Sex:M | Species:yakuba | Age:31 Dataset=Targeted; RAW_FILE_NAME=tube.96; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- SUBJECT_SAMPLE_FACTORS - tube.56 Line:yak-00 | Sex:M | Species:yakuba | Age:5 Dataset=Targeted; RAW_FILE_NAME=tube.56; RAW_FILE_NAME=June23-2015.wiff.scan June23-15.wiff; RAW_FILE_NAME=- #COLLECTION CO:COLLECTION_SUMMARY We collected virgin males and females into vials with banana medium under light CO:COLLECTION_SUMMARY CO2 anesthesia within 8 hours of eclosion, except D. virilis, which was CO:COLLECTION_SUMMARY collected within 12 hours of eclosion. Flies were reared on banana media. For CO:COLLECTION_SUMMARY targeted analysis 3 flies from each sex/genotype combination at 5 and 31 days of CO:COLLECTION_SUMMARY age were flash frozen and stored at -80°C. For untargeted analysis five days CO:COLLECTION_SUMMARY old flies in groups of 10 flies were flash frozen in 1.5 mL tubes in liquid N2 CO:COLLECTION_SUMMARY and stored at -80°C until metabolite extraction CO:SAMPLE_TYPE Insect tissue CO:STORAGE_CONDITIONS -80℃ #TREATMENT TR:TREATMENT_SUMMARY Sex, genotype, and age. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Metabolites were extracted by homogenizing samples in 200uL HPLC water (Sigma) SP:SAMPLEPREP_SUMMARY using a TissueLyser (TissueLyser II, Qiagen) for 6 minutes at 25 Hz at 4°C. We SP:SAMPLEPREP_SUMMARY then added 800uL methanol and incubated for 30 minutes on dry ice. The SP:SAMPLEPREP_SUMMARY suspension was homogenized again for 10 minutes at 25Hz, then spun at 14,000rcf SP:SAMPLEPREP_SUMMARY for 10 minutes at 4°C. The supernatant was transferred to a new tube and dried SP:SAMPLEPREP_SUMMARY in a Speed-Vac at 30°C. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY Targeted LC/MS-MS 1st column. LC-MS/MS experiments were performed on an Agilent CH:CHROMATOGRAPHY_SUMMARY 1260 LC (Agilent Technologies, Santa Clara, CA)-AB Sciex QTrap 5500 mass CH:CHROMATOGRAPHY_SUMMARY spectrometer (AB Sciex, Toronto, ON, Canada) system at the University of CH:CHROMATOGRAPHY_SUMMARY Washington Northwest Metabolomics Research Center (UWNMRC). Each sample was CH:CHROMATOGRAPHY_SUMMARY injected twice, 10 µL for analysis using negative ionization mode and 2 µL for CH:CHROMATOGRAPHY_SUMMARY analysis using positive ionization mode. Both chromatographic separations were CH:CHROMATOGRAPHY_SUMMARY performed in hydrophilic interaction chromatography (HILIC) mode on two Waters CH:CHROMATOGRAPHY_SUMMARY XBridge BEH Amide columns (150 x 2.1 mm, 2.5 µm particle size, Waters CH:CHROMATOGRAPHY_SUMMARY Corporation, Milford, MA) connected in parallel. The flow rate was 0.300 mL/min, CH:CHROMATOGRAPHY_SUMMARY auto-sampler temperature was kept at 4 °C, and the column compartment was set CH:CHROMATOGRAPHY_SUMMARY at 40 °C. The mobile phase was composed of Solvents A (5 mM ammonium acetate in CH:CHROMATOGRAPHY_SUMMARY 90%H2O/ 10% acetonitrile + 0.2% acetic acid) and B (5 mM ammonium acetate in CH:CHROMATOGRAPHY_SUMMARY 90%acetonitrile/ 10% H2O + 0.2% acetic acid). After the initial 2 min isocratic CH:CHROMATOGRAPHY_SUMMARY elution of 90% B, the percentage of Solvent B decreased to 50% at t=5 min. The CH:CHROMATOGRAPHY_SUMMARY composition of Solvent B maintained at 50% for 4 min (t=9 min), and then the CH:CHROMATOGRAPHY_SUMMARY percentage of B gradually went back to 90%, to prepare for the next injection. CH:CHROMATOGRAPHY_SUMMARY Targeted data acquisition was performed in multiple-reaction-monitoring (MRM) CH:CHROMATOGRAPHY_SUMMARY mode. The LC-MS system was controlled by Analyst 1.5 software (AB Sciex). The CH:CHROMATOGRAPHY_SUMMARY extracted MRM peaks were integrated using MultiQuant 2.1 software (AB Sciex). CH:CHROMATOGRAPHY_SUMMARY Samples were spiked with 13C internal standards, and two types of LC-MS/MS CH:CHROMATOGRAPHY_SUMMARY quality control (QC) samples were run at 11 evenly-spaced intervals throughout CH:CHROMATOGRAPHY_SUMMARY the run to track potential drift in the assay. One QC sample was a pool of 10 CH:CHROMATOGRAPHY_SUMMARY fly samples, and the other was a sample of human serum. The CV for these QCs was CH:CHROMATOGRAPHY_SUMMARY 8.2% and 7.7% respectively CH:INSTRUMENT_NAME Agilent 1260 CH:COLUMN_NAME Waters Xbridge BEH HILIC (75 x 2.1mm,2.5um) CH:COLUMN_TEMPERATURE 40 CH:FLOW_RATE 0.300 mL/min CH:INTERNAL_STANDARD 13C CH:SOLVENT_A 90% water/10% acetonitrile; 0.2% acetic acid; 5 mM ammonium acetate CH:SOLVENT_B 90% acetonitrile/ 10% water; 0.2% acetic acid; 5 mM ammonium acetate CH:CHROMATOGRAPHY_TYPE HILIC #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Agilent 6520 QTOF MS:INSTRUMENT_TYPE QTOF MS:MS_TYPE ESI MS:MS_COMMENTS The ESI voltage was 3.8 kV, and the m/z scan range was 60-1000. The Q-TOF data MS:MS_COMMENTS were extracted using Agilent MassHunter Qualitative Analysis (version B.07.00), MS:MS_COMMENTS Quantitative Analysis (version B.07.01), and Mass Profiler Professional (MPP, MS:MS_COMMENTS version B.13.00) software. The absolute intensity threshold for the LC-Q-TOF MS:MS_COMMENTS data extraction was 1000, and the mass accuracy limit was set to 10 ppm. Both MS:MS_COMMENTS positive and negative ionization modes were analyzed. MS:ION_MODE POSITIVE MS:MS_RESULTS_FILE ST001926_AN003131_Results.txt UNITS:Peak counts Has m/z:Yes Has RT:Yes RT units:Minutes #END