Validation Log 2025-12-15 01:02:30.905641 mwtab Python Library Version: 2.0.0 Source: https://www.metabolomicsworkbench.org/rest/study/analysis_id/AN005613/mwtab/txt Study ID: ST002576 Analysis ID: AN005613 File format: txt Status: Contains Validation Issues Number of Issues: 188 Number of Warnings: 187 Number of Value Errors: 188 Number of Consistency Errors: 0 Number of Format Errors: 0 Issue Log: Error: The value, "30", for the subsection, "COLUMN_TEMPERATURE", in the "CHROMATOGRAPHY" section should be a number or range (ex. "5-6") followed by a space with a unit (ex. "5 V") from the following list: ['°C', 'C']. Ignore this when more complicated descriptions are required. Warning: SUBJECT_SAMPLE_FACTORS entry #1 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #2 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #3 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #4 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #5 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #6 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #7 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #8 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #9 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #10 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #11 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #12 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #13 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #14 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #15 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #16 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #17 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #18 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #19 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #20 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #21 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #22 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #23 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #24 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #25 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #26 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #27 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #28 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #29 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #30 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #31 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #32 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #33 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #34 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #35 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #36 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #37 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #38 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #39 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #40 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #41 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #42 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #43 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #44 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #45 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #46 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #47 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #48 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #49 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #50 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #51 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #52 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #53 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #54 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #55 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #56 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #57 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #58 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #59 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #60 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #61 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #62 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #63 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #64 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #65 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #66 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #67 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #68 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #69 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #70 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #71 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #72 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #73 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #74 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #75 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #76 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #77 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #78 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #79 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #80 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #81 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #82 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #83 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #84 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #85 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #86 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #87 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #88 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #89 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #90 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #91 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #92 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #93 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #94 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #95 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #96 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #97 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #98 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #99 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #100 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #101 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #102 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #103 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #104 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #105 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #106 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #107 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #108 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #109 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #110 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #111 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #112 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #113 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #114 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #115 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #116 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #117 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #118 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #119 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #120 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #121 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #122 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #123 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #124 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #125 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #126 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #127 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #128 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #129 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #130 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #131 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #132 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #133 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #134 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #135 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #136 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #137 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #138 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #139 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #140 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #141 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #142 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #143 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #144 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #145 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #146 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #147 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #148 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #149 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #150 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #151 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #152 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #153 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #154 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #155 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #156 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #157 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #158 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #159 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #160 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #161 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #162 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #163 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #164 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #165 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #166 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #167 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #168 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #169 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #170 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #171 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #172 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #173 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #174 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #175 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: SUBJECT_SAMPLE_FACTORS entry #176 has the following duplicate keys in its Additional sample data: "RAW_FILE_NAME" "RAW_FILE_NAME" "RAW_FILE_NAME" Warning: The "mz" column at position 7 in the METABOLITES table, matches a standard column name, "moverz_quant". If this match was not in error, the column should be renamed to the standard name or a name that doesn't resemble the standard name. Warning: The "Neutral mass" column at position 6 in the METABOLITES table, matches a standard column name, "mass". If this match was not in error, the column should be renamed to the standard name or a name that doesn't resemble the standard name. Warning: The "InChiKey_14" column at position 3 in the METABOLITES table, matches a standard column name, "inchi_key". If this match was not in error, the column should be renamed to the standard name or a name that doesn't resemble the standard name. Warning: The "InChiKey_14" column at position 3 in the METABOLITES table, matches a standard column name, "inchi_key", and some of the values in the column do not match the expected type or format for that column. The non-matching values are: 1 FIOHTMQGSFVHEZ 2 DKPMWHFRUGMUKF 3 XHXUANMFYXWVNG 4 UDIUFGIXIGLRSM 5 DJQYBVLXBVJHMU 6 JGUNZIWGNMQSBM 7 LIDBLDQVAYHNE 8 DNWUYCUUEGGVPR 9 BYPXGAVDTZXOLE 10 OYNBXMWIXBFNAJ 11 OSCCDBFHNMXNME 12 WTIIULQJLZEHGZ 13 YWWVWXASSLXJHU 14 OYDCCWNLILCHDJ 15 HWXBTNAVRSUOJR 16 JVGVDSSUAVXRDY 17 WHBMMWSBFZVSSR 18 JVTAAEKCZFNVCJ 19 BJEPYKJPYRNKOW 20 SERHXTVXHNVDKA 21 NMDWGEGFJUBKLB 22 VOKUMXABRRXHAR 23 XKLJLHAPJBUBNL 24 INMKWUNQKOWGEZ 25 NELZMZLNTYWIPD 26 OTSBKHHWSQYEHK 27 MPCAJMNYNOGXPB 28 LXBIFEVIBLOUGU 29 PZLZEXRSLQTBJE 30 LCSBQXXSNDOFFD 31 KWNBDPJHEKVDAW 32 BVQVLAIMHVDZEL 33 AOMLMYXPXUTBQH 34 JUSMHIGDXPKSID 35 AXKZIDYFAMKWSA 36 QHBZHVUGQROELI 37 YJCJVMMDTBEITC 38 FYURGFQVSMALOD 39 BITHHVVYSMSWAG 40 XSXIVVZCUAHUJO 41 ZDHCZVWCTKTBRY 42 ZDHCZVWCTKTBRY 43 ICTIYYVVZNILKD 44 UGAGPNKCDRTDHP 45 MGAAHPXIGWJLPX 46 UZIIAZIXTSAEPN 47 AQTKXCPRNZDOJU 48 AAKDPDFZMNYDLR 49 ADVGKWPZRIDURE 50 JDWYRSDDJVCWPB 51 SXCLPOXHBILXEY 52 PMOWTIHVNWZYFI 53 VBUYCZFBVCCYFD 54 MNRBGFKCVTVNBA 55 JGHSBPIZNUXPLA 56 WJSNOGSNIHAQKB 57 WCJYZUFKKTYNLB 58 NYHNVHGFPZAZGA 59 CTXGTHVAWRBISV 60 ZASFWGOMAIPHLN 61 CDUUKBXTEOFITR 62 COJBGNAUUSNXHX 63 MVJLYXCJBPXRCY 64 KGRVJHAUYBGFFP 65 PCEJMSIIDXUDSN 66 FOGJPHRWJKZCAO 67 KLAKIAVEMQMVBT 68 NADRVFUNXRGAII 69 IHJUECRFYCQBMW 70 NOUMDGXCGDQQOD 71 ZUKLXLKVCGZHAA 72 HOOWCUZPEFNHDT 73 LZRUJECSWOAXOK 74 LZRUJECSWOAXOK 75 ACWBBAGYTKWBCD 76 WVMWZWGZRAXUBK 77 IBGYNIRCYXIAON 78 SEOVTRFCIGRIMH 79 GOLXRNDWAUTYKT 80 ZFRKQXVRDFCRJG 81 DZHSPYMHDVROSM 82 PHENTZNALBMCQD 83 RGHMISIYKIHAJW 84 AULKDLUOQCUNOK 85 UYEMGAFJOZZIFP 86 VGFDFWZBUWIRGA 87 VCRXMIQBQGCAAL 88 BTCSSZJGUNDROE 89 PTNLHDGQWUGONS 90 PTNLHDGQWUGONS 91 MKBJQFWSHNXYFZ 92 OUIKMDRGUNIXSP 93 CEVQXWMPODOBRM 94 FEPBITJSIHRMRT 95 KCHAXAGQVCJPN 96 IETVQHUKTKKBFF 97 DBTLNKQGKRKJBT 98 RDZNZFGKEVDNPK 99 PHPQIPPBBQUFII 100 LTQYPAVLAYVKTK 101 CZWARROQQFCFJB 102 COCNDHOPIHDTHK 103 HRQKXMSCZPCUSK 104 CUBKHJDNGLGYAG 105 WVMJEBICTINBRO 106 NKXYOIJDQPQELO 107 ZMITXKRGXGRMKS 108 JHFAETDERBWUOO 109 MXAFHAYQTYCNNT 110 WPGZVCKWXQHYGF 111 GSIHBOIIJFLKIL 112 RVEKLXYYCHAMDF 113 JBYXPOFIGCOSSB 114 OAIJQUCVLFETGX 115 YGCFIWIQZPHFLU 116 NNPWPZGBFIMYHW 117 TWSWSIQAPQLDBP 118 DTHSUAKYTFUSQU 119 AVKOENOBFIYBSA 120 XUHLIQGRKRUKPH 121 OFCNXPDARWKPPY 122 CUGVBZDXUTZXJO 123 JFLIEFSWGNOPJJ 124 MKIFOPBVDBXRTO 125 WEKGHNWYEFXAQP 126 MPSNEAHFGOEKBI 127 RDOXTESZEPMUJZ 128 XDBMXUKHMOFBPJ 129 BLFLLBZGZJTVJG 130 UCMIRNVEIXFBKS 131 MQCPOLNSJCWPGT 132 MXJWRABVEGLYDG 133 XUPYJHCZDLZNFP 134 PRPNUZWHFGSGRV 135 YCIMNLLNPGFGHC 136 BHYOQNUELFTYRT 137 GTZCVFVGUGFEME 138 OGUCZBIQSYYWEF 139 NKEXCFKOKFWDAA 140 JYGXADMDTFJGBT 141 KQUGQXNYBWYGAI 142 DDRJAANPRJIHGJ 143 IRPJCUWMPPZCJN 144 NOKPBJYHPHHWAN 145 QXKAIJAYHKCRRA 146 HEBKCHPVOIAQTA 147 HEBKCHPVOIAQTA 148 DCXYFEDJOCDNAF 149 CKLJMWTZIZZHCS 150 FBPFZTCFMRRESA 151 HXEACLLIILLPRG 152 ONIBWKKTOPOVIA 153 MTCFGRXMJLQNBG 154 FBPFZTCFMRRESA 155 QIVBCDIJIAJPQS 156 JJHHIJFTHRNPIK 157 GYSCBCSGKXNZRH 158 CHNSJWFYRAXVMQ 159 KXGVEGMKQFWNSR 160 DOIRQSBPFJWKBE 161 MSLRDZDDYDCKDD 162 HOBAELRKJCKHQD 163 SCCDDNKJYDZXMM 164 OWZPCEFYPSAJFR 165 QQVHEQUEHCEAKS 166 SGMJBNSHAZVGMC 167 ODBLHEXUDAPZAU 168 MBMBGCFOFBJSGT 169 YUFFSWGQGVEMMI 170 VCCBEIPGXKNHFW 171 YRAPWMYACXYABW 172 PHMBVCPLDPDESM 173 VKOBVWXKNCXXDE 174 RCTQPWJZZZLMBI 175 SHWUXGHQECDXLJ 176 NUVBSKCKDOMJSU 177 LYRIITRHDCNUHV 178 KQWWVLVLVYYYDT 179 XWAZTQUZONPJEW 180 QISOBCMNUJQOJU 181 BTCSSZJGUNDROE 182 ZMJBYMUCKBYSCP 183 HIGQPQRQIQDZMP 184 WHUUTDBJXJRKMK 185 AAYACJGHNRIFCT 186 RFDAIACWWDREDC 187 WVULKSPCQVQLCU 188 AQTYXAPIHMXAAV 189 UDZRBDXBUYNBCW 190 CATSNJVOTSVZJV 191 IPCSVZSSVZVIGE 192 QIAFMBKCNZACKA 193 JEJNWEREQWMOHB 194 RSTKLPZEZYGQPY 195 BXFFHSIDQOFMLE 196 SAUCHDKDCUROAO 197 LEVWYRKDKASIDU 198 AGPKZVBTJJNPAG 199 FFEARJCKVFRZRR 200 OUYCCCASQSFEME 201 RHGKLRLOHDJJDR 202 POULHZVOKOAJMA 203 WKZWTZTZWGWEGE 204 SMEROWZSTRWXGI 205 UNUKMHHAQBXDMO 206 ZZUMXQCSMJCDDC 207 HQAXXRWVFPWZIL 208 KEMQGTRYUADPNZ 209 GATINKBJRDIBBW 210 AWVGVHUVOTVOAQ 211 GCMVATDSSHTCOS 212 HBLUGHSSFJXCOA 213 TWJNQYPJQDRXPH 214 WJFVEEAIYIOATH 215 OTCCIMWXFLJLIA 216 BKAYIFDRRZZKNF 217 PWATWSYOIIXYMA 218 PQBAWAQIRZIWIV 219 JLEBZPBDRKPWTD 220 DATAGRPVKZEWHA 221 JBIJLHTVPXGSAM 222 PVNIIMVLHYAWGP 223 MBZNUFZCBLXJOY 224 IFAWYXIHOVRGHQ 225 YJCJVMMDTBEITC 226 GWQOOADXMVQEFT 227 HOUSDILKOJMENG 228 SUBDBMMJDZJVOS 229 DSWLRNLRVBAVFC 230 WGNAKZGUSRVWRH 231 SECPZKHBENQXJG 232 USQVRFZEIYYKND 233 DTKXGPUQRVDFCG 234 GHOKWGTUZJEAQD 235 IGTYILLPRJOVFY 236 QUNWUDVFRNGTCO 237 YVYMBNSKXOXSKW 238 BBYWOYAFBUOUFP 239 GEWUBFCXNZWHKH 240 HEQMDGOBDIGJOC 241 QJHRNPQXCMXOOH 242 JPNPIRVRGLGTRE 243 MPVZXVXIZMIJFZ 244 YFSUTJLHUFNCNZ 245 PAZGBAOHGQRCBP 246 DTUQWGWMVIHBKE 247 MQHNKCZKNAJROC 248 MNSQZCUZCDASJO 249 IHFWVIPLEXWUCY 250 VCMMXZQDRFWYSE 251 DIJBBUIOWGGQOP 252 ULFMNSXBTYDMFI 253 SJGBVXPXTMNDDG 254 BUHPPQFOKKRDPX 255 NHZMQXZHNVQTQA 256 WUEVZLPTHXVTBC 257 AAWZDTNXLSGCEK 258 FPXPQMOQWJZYBL 259 JTEYKUFKXGDTEU 260 LMGKXMPKANQKTB 261 XSCYYIVXGBKTOC 262 ZZLHPCSGGOGHFW 263 HGTBAIVLETUVCG 264 JZNWSCPGTDBMEW 265 KDYFGRWQOYBRFD 266 YCPXWRQRBFJBPZ 267 UHRCUSBDMVNETF 268 XOAAWQZATWQOTB 269 IOUNJEVHPQCKKE 270 WAQBISPOEAOCOG 271 ODJQKYXPKWQWNK 272 NODSEPOUFZPJEQ 273 NNPTVHABBUVOGA 274 ZPFYUMPBKRRSTR 275 LEHOTFFKMJEONL 276 DRTQHJPVMGBUCF 277 MKLWBFOSJJEDLZ 278 KCMITHMNVLRGJU 279 WBZPMFHFKXZDRZ 280 POULHZVOKOAJMA 281 LRFVTYWOQMYALW Warning: The "Formula" column at position 4 in the METABOLITES table, matches a standard column name, "formula", and some of the values in the column do not match the expected type or format for that column. The non-matching values are: 1 C6 H11 N O4 11 C6 H13 N O3 28 C6 H13 N O4 33 C5 H7 N O3 48 C7 H15 N O4 49 C8 H9 N O2 50 C9 H9 N O4 51 C8 H7 Cl O3 61 C4 H9 N O3 62 C5 H7 N O4 72 C8 H9 N O4 75 C9 H10 Cl N O3 78 C10 H9 N O2 79 C11 H11 N O2 88 C4 H9 N O2 101 C5 H11 N O3 102 C11 H11 N O3 109 C9 H9 N O4 S 115 C4 H5 N O4 S 120 C6 H11 N O3 S 125 C7 H11 N O5 126 C10 H15 N O2 129 C9 H11 N O2 130 C3 H7 N O2 132 C12 H17 N O3 138 C18 H19 Cl N4 O 144 C3 H7 N O5 S2 149 C4 H7 N O4 151 C6 H11 N O2 152 C5 H9 N O2 153 C3 H7 N O3 156 C12 H10 O S 158 C10 H11 N O2 163 C13 H18 Cl N O2 172 C9 H15 N O3 175 C30 H47 N O5 S 181 C4 H9 N O2 184 C5 H9 N O4 185 C26 H43 N O5 186 C26 H43 N O6 187 C26 H43 N O5 192 C9 H9 N O3 194 C11 H9 N O3 195 C8 H7 N O4 S 196 C4 H7 N O3 198 C6 H13 N O2 199 C5 H11 N O2 S 200 C9 H11 N O3 214 C8 H15 N O9 S 215 C6 H9 N O5 222 C6 H5 N O2 227 C16 H31 N O3 229 C8 H9 N O2 S 234 C9 H17 N O5 235 C8 H9 N O5 S 237 C21 H44 N O7 P 238 C23 H48 N O7 P 239 C24 H50 N O7 P 240 C25 H52 N O7 P 241 C25 H48 N O7 P 242 C25 H44 N O7 P 244 C8 H F17 O3 S 256 C23 H29 N O9 262 C4 H9 N O3 S 264 C5 H14 N O6 P 268 C2 H7 N O3 S Warning: The "RefMet" column at position 2 in the METABOLITES table, matches a standard column name, "refmet", and some of the values in the column do not match the expected type or format for that column. The non-matching values are: 2 Muricholic acid 3 Menthyl acetate 4 Bornane-2,5-dione 7 Abscisic acid 13 Myristoleic acid 14 4-Hydroxycinnamate sulfate 15 2-Hydroxyglutaric acid 17 3R-Hydroxybutyric acid 18 Lactic acid 19 D-Malic acid 20 Pantolactone 21 (S)-2-Acetolactate 22 (S)-Methylmalonic acid semialdehyde 24 Traumatin 26 1,3-Dimethyluric acid 27 1,5-Anhydro-mannitol 31 1-Methyluric acid 33 1-Pyrroline-4-hydroxy-2-carboxylate 37 10-Hydroxydecanoic acid 38 10-Oxodecanoic acid 39 cis-Gondoic acid 40 11Z,14Z-Eicosadienoic acid 41 12-Hydroxy lauric acid 42 12-Hydroxy lauric acid 43 14-Hydroxy-12-tetradecenoic acid 44 Juniperic acid 50 Leucodopachrome 53 2-Dehydro-D-gluconic acid 55 2-Hydroxy palmitic acid 58 2-Hydroxyhexanoic acid 61 2-Methylserine 62 2-Keto-glutaramic acid 75 3-Chlorotyrosine 76 3-Dehydroquinate 78 Indoleacetic acid 79 3-Indolepropionic acid 80 3-Methylindole 81 3-Oxododecanoic acid 82 Ureidoisobutyric acid 83 3,4-Dihydroxymandelic acid 85 3,5-Dihydroxybenzoic acid 86 3beta,16alpha-Dihydroxyandrostenone sulfate 88 gamma-Aminobutyric acid 89 4-Coumaryl alcohol 90 4-Coumaryl alcohol 93 4-Methylene-glutamine 96 4-Hydroxystyrene 98 5-Acetylamino-6-formylamino-3-methyluracil 100 5-Hydroxyisouric acid 102 5-Methoxyindoleacetic acid 103 5-Methyl-2E-tridecenoic acid 106 5S-HpEPE 107 5alpha-Androstane-3alpha-ol-17-one sulfate 112 9,12-Hexadecadienoic acid 115 Acesulfame 117 Adrenic acid 120 Alliin 121 Allopurinol 123 alpha-N-Phenylacetylglutamine 124 Ambrettolic acid 125 AminoDHQ 127 Anisole 129 Benzocaine 130 beta-Alanine 131 Bisphenol F 132 Bufexamac 133 Butyl butanoate 135 Pyrocatechol 136 Cholesterol sulfate 137 cis-Aconitic acid 140 Cortisol 142 Creatinine 144 Cysteine-S-sulfate 145 Arabinonic acid 146 Arabitol 147 Arabitol 148 D-Asparagine 149 D-Aspartic acid 151 Pipecolic acid 152 D-Proline 153 D-Serine 154 Sorbitol 155 D-Tryptophan 157 Capric acid 159 Deoxycholic acid 160 Dibutyl phthalate 162 Bishomo-gamma-linolenic acid 164 2-(1-Methylpropyl)-4,6-dinitrophenol 165 Diundecyl phthalate 166 Erythrono-1,4-lactone 167 Isocitric Acid 168 Docosahexaenoic acid 169 Docosapentaenoic acid 172 Ecgonine 173 Arachidic acid 176 Ethyl paraben 177 Ethyl (R)-3-hydroxyhexanoate 178 Ethyl 3-oxohexanoate 179 Eugenol sulfate 180 Fumaric acid 181 gamma-Aminobutyric acid 182 Garcinia acid 183 Geranyl acetate 184 Glutamic acid 186 Glycocholic acid 187 Glycodeoxycholic acid 188 Guaiacol sulfate 190 2-Heptanone 191 Palmitic acid 192 Hippuric acid 194 Indolepyruvate 195 Indoxyl sulfate 196 L-2-Amino-3-oxobutanoic acid 197 Cystine 198 Isoleucine 199 Methionine 200 Tyrosine 201 Citrulline 202 Lauric acid 204 Lithocholic acid 208 Margaric acid 212 Mucronine B 213 Myristic acid 215 N-Acetylaspartic acid 216 N-Acetylcarnosine 218 N-Methylpyridinium 220 N(5)-Ethyl-glutamine 221 2-Aminonaphthalene 222 Nicotinic acid 225 10-Hydroxydecanoic acid 228 Omeprazole 230 p-Cresol sulfate 231 Palmitoleic acid 234 Pantothenic acid 235 Paracetamol sulfate 236 Paraxanthine 237 LPE 16:0/0:0 238 LPE 18:0/0:0 239 LPE 19:0/0:0* 240 LPE 20:0/0:0 241 PE 20:2(11Z,14Z)/0:0* 242 PE 20:4(8Z,11Z,14Z,17Z)/0:0* 244 Perfluorooctanesulfonic acid 245 PG 16:0/18:1(9Z)* 246 Phenylacetaldehyde 248 PI 15:0/22:1(11Z)* 249 PI 16:0/22:1(11Z)* 250 Plumbagin 251 Pregnenolone sulfate 254 Pulcherriminic acid 255 Pyridoxamine 257 Quinic acid 258 Quinol sulfate 259 (R)-2,3-Dihydroxy-isovalerate 261 Rishitin 262 S-Methylcysteine S-oxide 264 sn-Glycero-3-phosphoethanolamine 265 Succinic acid 268 Taurine 270 Testosterone sulfate 271 3,3'-Thiobispropanoic acid 272 Thymol 275 Uric acid 276 Uridine 280 Lauric acid 281 Xanthine Warning: The "RT_sec" column at position 8 in the METABOLITES table, matches a standard column name, "retention_time". If this match was not in error, the column should be renamed to the standard name or a name that doesn't resemble the standard name. Warning: The "MS1_RT_std" column at position 13 in the METABOLITES table, matches a standard column name, "retention_time". If this match was not in error, the column should be renamed to the standard name or a name that doesn't resemble the standard name. Warning: The "Neutral mass" column at position 6 in the METABOLITES table has all null values. Warning: The "Adduct" column at position 9 in the METABOLITES table may have incorrect values. 90% or more of the values are the same, but 10% or less are different. Warning: The "MS2_db_exp" column at position 15 in the METABOLITES table may have incorrect values. 90% or more of the values are the same, but 10% or less are different.