Validation Log 2025-12-15 01:07:04.975101 mwtab Python Library Version: 2.0.0 Source: https://www.metabolomicsworkbench.org/rest/study/analysis_id/AN004328/mwtab/txt Study ID: ST002656 Analysis ID: AN004328 File format: txt Status: Contains Validation Issues Number of Issues: 10 Number of Warnings: 5 Number of Value Errors: 8 Number of Consistency Errors: 1 Number of Format Errors: 1 Issue Log: Error: The required property, "COLLECTION_SUMMARY", in the "COLLECTION" section is missing. Error: An empty value or a null value was detected for the subsection, "TREATMENT_SUMMARY", in the "TREATMENT" section. A legitimate value should be provided for this required subsection. Error: The value, "0.4 ml/min", for the subsection, "FLOW_RATE", 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: ['mL/min', 'uL/min', 'μL/min']. Ignore this when more complicated descriptions are required. Error: The value, "50C", 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. Error: The following metabolites in the METABOLITES table were not found in the MS_METABOLITE_DATA table: "new_SM(d44:2)_M+H2CO2" "new_SM(d40:1) M + HCl" "new_SM(d40:0-OH)_M+H2CO2" "new_PS(36:4)>PS(16:0_20:4)" "new_CL(74:9)_feature1" "new_CL(74:9)_feature2" "new_CL(74:10)" Warning: The "mz" column at position 3 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 4 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 "formula" column at position 2 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: 2 C38 H67 D7 N O8 P 3 C23 H39 D7 N O7 P 4 C42 H75 D7 N O10 P 5 C27 H47 D7 N O9 P 6 C42 H75 D7 N O13 P 7 C50 H97 N O11 S 8 C48 H91 N O12 S 9 C48 H93 N O12 S 10 C48 H93 N O11 S 11 C47 H91 N O12 S 12 C47 H91 N O11 S 13 C46 H89 N O12 S 31 C48 H82 N O9 P 32 C46 H78 N O9 P 33 C46 H78 N O9 P 34 C46 H74 N O10 P 35 C46 H78 N O10 P 36 C46 H80 N O10 P 37 C46 H82 N O10 P 38 C44 H74 N O10 P 39 C44 H76 N O10 P 40 C44 H78 N O10 P 41 C44 H80 N O10 P 42 C42 H74 N O10 P 43 C42 H78 N O10 P 44 C42 H78 N O10 P 45 C42 H80 N O10 P 46 C40 H76 N O10 P 47 C40 H77 N Na O10 P 64 C45 H82 N O7 P 65 C45 H76 N O7 P 66 C45 H78 N O7 P 67 C45 H80 N O7 P 68 C45 H82 N O7 P 69 C45 H84 N O7 P 70 C44 H80 N O7 P 71 C43 H74 N O7 P 72 C43 H74 N O7 P 73 C43 H76 N O7 P 74 C43 H76 N O7 P 75 C43 H78 N O7 P 76 C43 H78 N O7 P 77 C43 H78 N O7 P 78 C43 H80 N O7 P 79 C41 H74 N O7 P 80 C41 H80 N O7 P 81 C41 H76 N O7 P 82 C41 H82 N O7 P 83 C41 H78 N O7 P 84 C42 H76 N O7 P 85 C42 H76 N O7 P 86 C39 H74 N O7 P 87 C39 H76 N O7 P 88 C39 H78 N O7 P 89 C39 H78 N O7 P 90 C47 H86 N O8 P 91 C45 H74 N O8 P 92 C45 H76 N O8 P 93 C45 H78 N O8 P 94 C45 H80 N O8 P 95 C45 H82 N O8 P 96 C45 H82 N O8 P 97 C44 H80 N O8 P 98 C44 H80 N O8 P 99 C43 H74 N O8 P 100 C43 H74 N O8 P 101 C43 H76 N O8 P 102 C43 H76 N O8 P 103 C43 H78 N O8 P 104 C43 H78 N O8 P 105 C43 H80 N O8 P 106 C43 H84 N O8 P 107 C42 H76 N O8 P 108 C41 H72 N O8 P 109 C41 H72 N O8 P 110 C41 H74 N O8 P 111 C41 H74 N O8 P 112 C41 H76 N O8 P 113 C41 H78 N O8 P 114 C41 H78 N O8 P 115 C41 H80 N O8 P 116 C40 H76 N O8 P 117 C39 H72 N O8 P 118 C39 H74 N O8 P 119 C39 H76 N O8 P 120 C39 H78 N O8 P 121 C37 H72 N O8 P 122 C37 H74 N O8 P 123 C47 H86 N O9 P 124 C47 H86 N O9 P 125 C49 H82 N O9 P 126 C45 H82 N O9 P 127 C45 H84 N O9 P 128 C43 H86 N O9 P 129 C41 H82 N O9 P 130 C51 H82 N O10 P 131 C49 H82 N O10 P 132 C49 H84 N O10 P 133 C49 H86 N O10 P 134 C49 H88 N O10 P 135 C49 H90 N O10 P 136 C47 H82 N O10 P 137 C47 H82 N O10 P 138 C47 H84 N O10 P 139 C47 H84 N O10 P 140 C47 H86 N O10 P 141 C47 H86 N O10 P 142 C47 H88 N O10 P 143 C47 H90 N O10 P 144 C46 H84 N O10 P 145 C45 H80 N O10 P 146 C45 H80 N O10 P 147 C45 H82 N O10 P 148 C45 H82 N O10 P 149 C45 H84 N O10 P 150 C45 H84 N O10 P 151 C45 H86 N O10 P 152 C45 H86 N O10 P 153 C45 H88 N O10 P 154 C45 H90 N O10 P 155 C44 H80 N O10 P 156 C44 H84 N O10 P 157 C44 H86 N O10 P 158 C43 H78 N O10 P 159 C43 H80 N O10 P 160 C43 H82 N O10 P 161 C43 H84 N O10 P 162 C43 H86 N O10 P 163 C41 H78 N O10 P 164 C41 H80 N O10 P 165 C41 H82 N O10 P 166 C39 H78 N O10 P 167 C20 H44 N O6 P 168 C25 H44 N O7 P 169 C25 H52 N O7 P 170 C23 H48 N O7 P 171 C21 H44 N O7 P 172 C29 H52 N O9 P 173 C27 H54 N O9 P 174 C27 H56 N O9 P 175 C27 H56 N O9 P 177 C49 H93 N O10 178 C49 H97 N O11 179 C47 H91 N O10 190 C45 H89 N O5 191 C42 H81 N O3 192 C42 H81 N O3 193 C42 H83 N O3 194 C43 H87 N O6 195 C42 H83 N O5 196 C41 H79 N O5 197 C41 H81 N O5 198 C37 H73 N O5 199 C35 H69 N O5 Warning: The "refmet_name" column at position 5 in the METABOLITES table, matches a standard column name, "name". 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 "rt" column at position 6 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.