Validation Log 2025-12-15 01:25:41.684121 mwtab Python Library Version: 2.0.0 Source: https://www.metabolomicsworkbench.org/rest/study/analysis_id/AN004600/mwtab/json Study ID: ST002822 Analysis ID: AN004600 File format: json Status: Contains Validation Issues Number of Issues: 17 Number of Warnings: 12 Number of Value Errors: 17 Number of Consistency Errors: 0 Number of Format Errors: 0 Issue Log: Error: An empty value or a null value was detected in ["CHROMATOGRAPHY"]["FLOW_GRADIENT"]. A legitimate value should be provided for this required key. Error: The value, "-", in ["CHROMATOGRAPHY"]["FLOW_RATE"] 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, "-", in ["CHROMATOGRAPHY"]["COLUMN_TEMPERATURE"] 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: An empty value or a null value was detected in ["CHROMATOGRAPHY"]["SOLVENT_A"]. A legitimate value should be provided for this required key. Error: An empty value or a null value was detected in ["CHROMATOGRAPHY"]["SOLVENT_B"]. A legitimate value should be provided for this required key. Warning: The "INCHIKEY" column at position 6 in the ["MS_METABOLITE_DATA"]["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" column at position 6 in the ["MS_METABOLITE_DATA"]["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 IOYKZPNDXIIXLN-LOQSCQKMBD 2 UUYSKERSKRMYME-MAIXUNBTBG 3 QLEHHUPUHJPURI-PWYDUFMYBJ 6 ZVVYJAAMWXATNY-PRWZWGSOBE 8 HTZINLFNXLXRBC-CQLBIITFBS 9 QYTPGOPLNFESQC-RLHAVTDZBD 10 URPXXNCTXCOATD-FXMFQVEGBH 12 XVYPOHCSLJZFED-QZEVRULJBC 14 FVXDQWZBHIXIEJ-LNDKUQBDBA 16 KILNVBDSWZSGLL-KXQOOQHDBV 18 BIABMEZBCHDPBV-BEBVUIBBBA 20 JWPHORDRFVRZPP-KUBAVDMBBG 21 4000 26 SPJFYYJXNPEZDW-UTJQPWESBU 27 DBHKHNGBVGWQJE-HZJYTTRNBF 29 RFVFQQWKPSOBED-PSXMRANNBM 36 MXJMOLQIXMJUEL-KRVWYVMSBN 37 YAMUFBLWGFFICM-PTGWMXDIBX 38 PYVRVRFVLRNJLY-MZMPXXGTBD 41 LFUDDCMNKWEORN-KHPPLWFEBO 42 IIZPXYDJLKNOIY-JXPKJXOSBS 43 DRIVXEVMDWCWLI-CAQMIEAIBF 44 KIQYUSYSJTUGFZ-GWAZTMTOBN 45 IESVDEZGAHUQJU-ZLBXKVHBBA 46 MPWUZHVZZKSTPV-MADBQMNMBW 48 JLPULHDHAOZNQI-ZTIMHPMXBU 49 HBZNVZIRJWODIB-NHCUFCNUBC 50 ATBOMIWRCZXYSZ-DLPCDOJJBW 51 WTJKGGKOPKCXLL-MRCUWXFGBH 52 FHQVHHIBKUMWTI-OTMQOFQLBI 53 PAZGBAOHGQRCBP-DDDNOICHBU 56 PZNPLUBHRSSFHT-RRHRGVEJBV 58 ASWBNKHCZGQVJV-UHFFFAOYAM 59 YVYMBNSKXOXSKW-HXUWFJFHBX 60 BVJSKAUUFXBDOB-UHFFFAOYAJ 61 PSVRFUPOQYJOOZ-QNPWAGBNBV 62 ANRKEHNWXKCXDB-BHFWLYLHBY 63 KRTOMQDUKGRFDJ-OALUUITLBO 67 XYYHNDVKALDFHQ-OXHZBIAZBI 69 YDTWOEYVDRKKCR-KNERPIHHBL 71 KZVRAFHIKMDULK-PDPKURFXBD 72 AGTPCXBHIGMTEU-NREGDSCDBU 73 ATHVAWFAEPLPPQ-VRDBWYNSBX 76 IHNKQIMGVNPMTC-RUZDIDTEBJ 77 BBYWOYAFBUOUFP-JOCHJYFZBR 78 HFJVKBVEKQHVTO-OZAIVSQSBD 79 LXUGKKVCSTYZFK-DYLKWFMLBW 80 ZPDQFUYPBVXUKS-KEKNWZKVBV 81 AKVBCGQVQXPRLD-UHFFFAOYAX 83 VCRSQDIROUELAR-UHFFFAOYAT 84 YBCVTTMMURGSEY-LMLDZDDJBA 86 NYOXRYYXRWJDKP-UHFFFAOYAV 89 GVJHHUAWPYXKBD-IEOSBIPEBS 90 YZXBAPSDXZZRGB-DOFZRALJBE 91 LGEQQWMQCRIYKG-DOFZRALJBA 94 SVJLJQBGUITFLI-UHFFFAOYAV 95 FONAXCRWZQFJHY-JCGOJSMZBF 97 IUMXSSOVGPXXJL-UHFFFAOYAY 98 KZJWDPNRJALLNS-VJSFXXLFBZ 99 BPYKTIZUTYGOLE-IFADSCNNBS 100 QBUVFDKTZJNUPP-BBROENKCBK 101 SGNBVLSWZMBQTH-PODYLUTMBW 105 HVYWMOMLDIMFJA-LBHVWCRMBB 107 LZOSYCMHQXPBFU-UHFFFAOYAC 108 GZIFEOYASATJEH-VHFRWLAGBS 114 GEEHOLRSGZPBSM-KUBAVDMBBA 121 OTXNTMVVOOBZCV-WAZJVIJMBV 127 RBEJCQPPFCKTRZ-LHMZYYNSBN 128 BTUSGZZCQZACPT-YYZTVXDQBI 129 VVPRQWTYSNDTEA-UHFFFAOYAN 131 FUJLYHJROOYKRA-UHFFFAOYAK 132 QEDPUVGSSDPBMD-XTAIVQBEBF 137 MJLXQSQYKZWZCB-DQFWFXSYBW 146 PSHXNVGSVNEJBD-UHFFFAOYAV 147 YWZGQPJRQXHVQX-HOXYDHSRBV 148 XWBWIAOWSABHFI-NUKVNZTCBQ 151 MPSPNFAQQQMFLK-UHFFFAOYAZ 153 GCGTXOVNNFGTPQ-JHOUSYSJBP 154 YDNKGFDKKRUKPY-TURZORIXBD 156 KZTJQXAANJHSCE-OIDHKYIRBS 157 VODZWWMEJITOND-NXCSZAMKBA 158 CXTATJFJDMJMIY-UHFFFAOYAP 159 BOWVQLFMWHZBEF-KTKRTIGZBW 161 IPOLTUVFXFHAHI-WHIOSMTNBE 163 BLZVZPYMHLXLHG-RQOIEFAZBI 167 JFAGPSOZZSTLRF-KHPPLWFEBO 170 QHZIGNLCLJPLCU-QPPIDDCLBH 171 HXYVTAGFYLMHSO-UHFFFAOYAE 172 RWKUXQNLWDTSLO-GWQJGLRPBP 175 XOMRRQXKHMYMOC-UHFFFAOYAU 179 SVXWJFFKLMLOHO-YAIZGCQRBM 184 AERBNCYCJBRYDG-FGTMMUONBE 185 FPIPGXGPPPQFEQ-OVSJKPMPBW 186 KWDXKYNWAKMLKK-YQMRQDNGBF 187 OTKJDMGTUTTYMP-UHFFFAOYAS 188 LQINJRUGTUOHGS-YPDYIYJKBT 191 KYICBZWZQPCUMO-PSALXKTOBW 193 NBEADXWAAWCCDG-QDDWGVBQBP 195 AADLTHQNYQJHQV-SVLGDMRNBJ 198 VBFKEZGCUWHGSK-ADSSWVSQBB 200 WKZHECFHXLTOLJ-QYKFWSDSBN 201 JONXXLXMISNQNG-BXMSAMRLBO 209 WWUZIQQURGPMPG-CCEZHUSRBL 210 OTGQIQQTPXJQRG-UHFFFAOYAF 211 LKQLRGMMMAHREN-YJFXYUILBI 214 FNPHNLNTJNMAEE-HSZRJFAPBW Warning: The "SUPER_PATHWAY" column at position 2 in the ["MS_METABOLITE_DATA"]["Metabolites"] table, matches a standard column name, "pathway". 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 "SUB_PATHWAY" column at position 3 in the ["MS_METABOLITE_DATA"]["Metabolites"] table, matches a standard column name, "pathway". 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 "PUBCHEM" column at position 12 in the ["MS_METABOLITE_DATA"]["Metabolites"] table, matches a standard column name, "pubchem_id". 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 "KEGG" column at position 11 in the ["MS_METABOLITE_DATA"]["Metabolites"] table, matches a standard column name, "kegg_id". 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 "HMDB" column at position 10 in the ["MS_METABOLITE_DATA"]["Metabolites"] table, matches a standard column name, "hmdb_id". 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 "CHEMSPIDER" column at position 9 in the ["MS_METABOLITE_DATA"]["Metabolites"] table, matches a standard column name, "chemspider_id". 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 "CAS" column at position 8 in the ["MS_METABOLITE_DATA"]["Metabolites"] table, matches a standard column name, "cas_number". 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 "CAS" column at position 8 in the ["MS_METABOLITE_DATA"]["Metabolites"] table, matches a standard column name, "cas_number", and some of the values in the column do not match the expected type or format for that column. The non-matching values are: 51 26853-31-6,26853-31-6 89 10191-41-0,59-02-9 100 55482-27-4,55482-27-4 159 111-58-0,11-58-0 211 85187-10-6,85187-10-6 Warning: The "SUPER_PATHWAY" column at position 2 in the ["MS_METABOLITE_DATA"]["Metabolites"] table may have incorrect values. 90% or more of the values are the same, but 10% or less are different. Warning: The "TYPE" column at position 5 in the ["MS_METABOLITE_DATA"]["Metabolites"] table may have incorrect values. 90% or more of the values are the same, but 10% or less are different.