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Wikipedia:WikiProject Chemicals/Chembox validation - Wikipedia

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vector-toc-level-2"> <a class="vector-toc-link" href="#{{cascite}}-set"> <div class="vector-toc-text"> <span class="vector-toc-numb">5.1</span> <span><span>{{cascite}}</span>-set</span> </div> </a> <ul id="toc-{{cascite}}-set-sublist" class="vector-toc-list"> </ul> </li> </ul> </li> <li id="toc-Problems_found_when_validating_the_Excel_file" class="vector-toc-list-item vector-toc-level-1 vector-toc-list-item-expanded"> <a class="vector-toc-link" href="#Problems_found_when_validating_the_Excel_file"> <div class="vector-toc-text"> <span class="vector-toc-numb">6</span> <span>Problems found when validating the Excel file</span> </div> </a> <span class="ext-discussiontools-init-sidebar-meta">13 comments</span> <button aria-controls="toc-Problems_found_when_validating_the_Excel_file-sublist" class="cdx-button cdx-button--weight-quiet cdx-button--icon-only vector-toc-toggle"> <span class="vector-icon mw-ui-icon-wikimedia-expand"></span> <span>Toggle Problems found when validating the Excel 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class="vector-toc-list-item vector-toc-level-2"> <a class="vector-toc-link" href="#301–400"> <div class="vector-toc-text"> <span class="vector-toc-numb">6.4</span> <span>301–400</span> </div> </a> <ul id="toc-301–400-sublist" class="vector-toc-list"> </ul> </li> <li id="toc-401–500" class="vector-toc-list-item vector-toc-level-2"> <a class="vector-toc-link" href="#401–500"> <div class="vector-toc-text"> <span class="vector-toc-numb">6.5</span> <span>401–500</span> </div> </a> <ul id="toc-401–500-sublist" class="vector-toc-list"> </ul> </li> <li id="toc-501–600" class="vector-toc-list-item vector-toc-level-2"> <a class="vector-toc-link" href="#501–600"> <div class="vector-toc-text"> <span class="vector-toc-numb">6.6</span> <span>501–600</span> </div> </a> <ul id="toc-501–600-sublist" class="vector-toc-list"> </ul> </li> <li id="toc-601–700" class="vector-toc-list-item vector-toc-level-2"> <a class="vector-toc-link" href="#601–700"> <div class="vector-toc-text"> <span class="vector-toc-numb">6.7</span> <span>601–700</span> </div> </a> <ul id="toc-601–700-sublist" class="vector-toc-list"> </ul> </li> <li id="toc-701–800" class="vector-toc-list-item vector-toc-level-2"> <a class="vector-toc-link" href="#701–800"> <div class="vector-toc-text"> <span class="vector-toc-numb">6.8</span> <span>701–800</span> </div> </a> <ul id="toc-701–800-sublist" class="vector-toc-list"> </ul> </li> <li id="toc-801–900" class="vector-toc-list-item vector-toc-level-2"> <a class="vector-toc-link" href="#801–900"> <div class="vector-toc-text"> <span class="vector-toc-numb">6.9</span> <span>801–900</span> </div> </a> <ul id="toc-801–900-sublist" class="vector-toc-list"> </ul> </li> <li id="toc-901–1000" class="vector-toc-list-item vector-toc-level-2"> <a class="vector-toc-link" href="#901–1000"> <div class="vector-toc-text"> <span class="vector-toc-numb">6.10</span> <span>901–1000</span> </div> </a> <ul id="toc-901–1000-sublist" class="vector-toc-list"> </ul> </li> <li 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.sidebar{width:100%!important;clear:both;float:none!important;margin-left:0!important;margin-right:0!important}}body.skin--responsive .mw-parser-output .sidebar a>img{max-width:none!important}@media screen{html.skin-theme-clientpref-night .mw-parser-output .sidebar:not(.notheme) .sidebar-list-title,html.skin-theme-clientpref-night .mw-parser-output .sidebar:not(.notheme) .sidebar-title-with-pretitle{background:transparent!important}html.skin-theme-clientpref-night .mw-parser-output .sidebar:not(.notheme) .sidebar-title-with-pretitle a{color:var(--color-progressive)!important}}@media screen and (prefers-color-scheme:dark){html.skin-theme-clientpref-os .mw-parser-output .sidebar:not(.notheme) .sidebar-list-title,html.skin-theme-clientpref-os .mw-parser-output .sidebar:not(.notheme) .sidebar-title-with-pretitle{background:transparent!important}html.skin-theme-clientpref-os .mw-parser-output .sidebar:not(.notheme) .sidebar-title-with-pretitle a{color:var(--color-progressive)!important}}@media print{body.ns-0 .mw-parser-output .sidebar{display:none!important}}</style><table class="sidebar nomobile nowraplinks" style="width:auto"><tbody><tr><th class="sidebar-title">Chemical data<br/>validation</th></tr><tr><td class="sidebar-image"><figure class="mw-halign-center" typeof="mw:File"><a href="/wiki/File:Icon_verified_chemical_structure.svg" class="mw-file-description"><img src="//upload.wikimedia.org/wikipedia/commons/thumb/b/be/Icon_verified_chemical_structure.svg/75px-Icon_verified_chemical_structure.svg.png" decoding="async" width="75" height="66" class="mw-file-element" srcset="//upload.wikimedia.org/wikipedia/commons/thumb/b/be/Icon_verified_chemical_structure.svg/113px-Icon_verified_chemical_structure.svg.png 1.5x, //upload.wikimedia.org/wikipedia/commons/thumb/b/be/Icon_verified_chemical_structure.svg/150px-Icon_verified_chemical_structure.svg.png 2x" data-file-width="280" data-file-height="245"/></a><figcaption></figcaption></figure></td></tr><tr><td class="sidebar-above" style="font-weight:normal;font-size:85%; max-width:22em; text-align:left;"> <div><ul><li><a href="/wiki/Wikipedia:WikiProject_Chemicals" title="Wikipedia:WikiProject Chemicals">WikiProject Chemicals</a> (<a href="/wiki/Wikipedia_talk:WikiProject_Chemicals" title="Wikipedia talk:WikiProject Chemicals">talk</a>) is curating &amp; validating content in <span class="nowrap">{{</span><a href="/wiki/Template:Chembox" title="Template:Chembox">Chembox</a><span class="nowrap">}}</span>, <span class="nowrap">{{</span><a href="/wiki/Template:Drugbox" class="mw-redirect" title="Template:Drugbox">Drugbox</a><span class="nowrap">}}</span>, <span class="nowrap">{{</span><a href="/wiki/Template:Reactionbox" title="Template:Reactionbox">Reactionbox</a><span class="nowrap">}}</span>, aided by <a href="/wiki/Wikipedia:WikiProject_Pharmacology" title="Wikipedia:WikiProject Pharmacology">WikiProject Pharmacology</a> (<a href="/wiki/Wikipedia_talk:WikiProject_Pharmacology" title="Wikipedia talk:WikiProject Pharmacology">talk</a>).</li><li><span style="font-weight:bold"><a class="mw-selflink selflink">Main validation page</a></span> <a href="/wiki/Wikipedia_talk:WikiProject_Chemicals/Chembox_validation" title="Wikipedia talk:WikiProject Chemicals/Chembox validation">(talk)</a> — <a href="/wiki/Wikipedia:WikiProject_Chemistry/CAS_validation" title="Wikipedia:WikiProject Chemistry/CAS validation">(older page)</a></li><li><a href="/wiki/User:Walkerma/Sandbox" title="User:Walkerma/Sandbox">Errors/actions flagged via SDF</a></li><li><a rel="nofollow" class="external text" href="http://www.chemspider.com/docs/wikipedia/Wikipedia_Review_project_020108.pdf">PDF of errors found via SDF</a></li></ul></div></td></tr><tr><th class="sidebar-heading" style="padding:3px; border-top:1px solid #aaa"> Bot Pages</th></tr><tr><td class="sidebar-content plainlist"> <ul><li><a href="/wiki/User:CheMoBot" title="User:CheMoBot">CheMoBot</a></li></ul> <ul><li><a href="/wiki/Wikipedia:WikiProject_Chemicals/Log" class="mw-redirect" title="Wikipedia:WikiProject Chemicals/Log">Chemicals log</a></li> <li><a href="/wiki/Wikipedia:WikiProject_Pharmacology/Log" title="Wikipedia:WikiProject Pharmacology/Log">Pharmacology log</a></li></ul> <ul><li><a href="/wiki/Wikipedia:WikiProject_Chemicals/Index" title="Wikipedia:WikiProject Chemicals/Index">Validated chemboxes</a></li> <li><a href="/wiki/Wikipedia:WikiProject_Pharmacology/Index" title="Wikipedia:WikiProject Pharmacology/Index">Validated drugboxes</a></li></ul> <ul><li><a href="/wiki/Wikipedia:WikiProject_Chemicals/ImageIndex" title="Wikipedia:WikiProject Chemicals/ImageIndex">Validated chembox Images</a></li> <li><a href="/wiki/Wikipedia:WikiProject_Pharmacology/ImageIndex" title="Wikipedia:WikiProject Pharmacology/ImageIndex">Validated drugbox Images</a></li></ul></td> </tr><tr><th class="sidebar-heading" style="padding:3px; border-top:1px solid #aaa"> <a href="/wiki/Category:Wikipedia_chemical_data_validation" title="Category:Wikipedia chemical data validation">Categories</a></th></tr><tr><td class="sidebar-content plainlist"> <ul><li><a href="/wiki/Category:Chemboxes_which_contain_changes_to_verified_fields" title="Category:Chemboxes which contain changes to verified fields">Chembox, verified fields</a></li> <li><a href="/wiki/Category:Chemboxes_which_contain_changes_to_watched_fields" title="Category:Chemboxes which contain changes to watched fields">Chembox, watched fields</a></li></ul> <ul><li><a href="/wiki/Category:Drugboxes_which_contain_changes_to_verified_fields" title="Category:Drugboxes which contain changes to verified fields">Drugbox, verified fields</a></li> <li><a href="/wiki/Category:Drugboxes_which_contain_changes_to_watched_fields" title="Category:Drugboxes which contain changes to watched fields">Drugbox, watched fields</a></li></ul> <ul><li><a href="/wiki/Category:Reactionboxes_which_contain_changes_to_verified_fields" title="Category:Reactionboxes which contain changes to verified fields">Reactionbox, verified fields</a></li> <li><a href="/wiki/Category:Reactionboxes_which_contain_changes_to_watched_fields" title="Category:Reactionboxes which contain changes to watched fields">Reactionbox, watched fields</a></li></ul> <ul><li><a href="/wiki/Category:Chembox_and_Drugbox_articles_with_a_broken_CheMoBot_template" title="Category:Chembox and Drugbox articles with a broken CheMoBot template">Pages with broken verification templates</a></li></ul></td> </tr><tr><th class="sidebar-heading" style="padding:3px; border-top:1px solid #aaa"> IRC-related</th></tr><tr><td class="sidebar-content plainlist"> <div style="font-size:85%">Discussions some Tuesdays<br/>on <a rel="nofollow" class="external text" href="irc://chat.freenode.net:8001/wikichem">#wikichem</a> at 1600h <a href="/wiki/Coordinated_Universal_Time" title="Coordinated Universal Time">UTC</a></div> <ul><li><a href="/wiki/Wikipedia:WikiProject_Chemistry/IRC_discussions" title="Wikipedia:WikiProject Chemistry/IRC discussions">IRC discussions</a></li></ul></td> </tr><tr><th class="sidebar-heading" style="padding:3px; border-top:1px solid #aaa"> Commons</th></tr><tr><td class="sidebar-content plainlist"> <ul><li><a href="https://commons.wikimedia.org/wiki/Commons:WikiProject_Chemistry/Structure_validation" class="extiw" title="commons:Commons:WikiProject Chemistry/Structure validation">Structure validation project</a></li></ul></td> </tr><tr><th class="sidebar-heading" style="padding:3px; border-top:1px solid #aaa"> Chemical Lists</th></tr><tr><td class="sidebar-content plainlist"> <ul><li><a href="/wiki/Wikipedia:WikiProject_Chemistry/Curation" title="Wikipedia:WikiProject Chemistry/Curation">Main SDF list</a></li> <li><a href="/wiki/Wikipedia:WikiProject_Chemicals/Inorganics" title="Wikipedia:WikiProject Chemicals/Inorganics">Inorganics list</a></li></ul> <ul><li><a href="/wiki/List_of_CAS_numbers_by_chemical_compound" title="List of CAS numbers by chemical compound">List of CAS nos.</a> (not validated)</li></ul></td> </tr><tr><th class="sidebar-heading" style="padding:3px; border-top:1px solid #aaa"> Style Guides</th></tr><tr><td class="sidebar-content plainlist"> <ul><li><a href="/wiki/Wikipedia:WikiProject_Chemicals/Style_guidelines" title="Wikipedia:WikiProject Chemicals/Style guidelines">Main style guide</a></li> <li><a href="/wiki/Wikipedia:WikiProject_Chemicals/Compound_classes_style_guidelines" class="mw-redirect" title="Wikipedia:WikiProject Chemicals/Compound classes style guidelines">Compound classes</a></li> <li><a href="/wiki/Wikipedia:WikiProject_Chemistry/Structure_drawing" class="mw-redirect" title="Wikipedia:WikiProject Chemistry/Structure drawing">Structure drawing</a></li></ul></td> </tr><tr><th class="sidebar-heading" style="padding:3px; border-top:1px solid #aaa"> Useful Links</th></tr><tr><td class="sidebar-content plainlist"> <ul><li><a rel="nofollow" class="external text" href="http://www.chemconnector.com/2008/01/09/dedicating-christmas-time-to-the-cause-of-curating-wikipedia/">Blog on starting the project</a></li> <li><a rel="nofollow" class="external text" href="http://depth-first.com/articles/2008/07/23/validating-cas-numbers">Tools for CAS No. checksums</a></li> <li><a rel="nofollow" class="external text" href="http://www.chemspider.com/blog/free-utilities-to-look-at-sdf-files.html">Blog list of SDF readers</a></li> <li><a class="external text" href="https://tools.wmflabs.org/magnustools/cas.php?cas=74-90-8&amp;language=en">Example of use of Magnus'<br/>tool for listing via CAS no.</a></li></ul></td> </tr><tr><td class="sidebar-navbar"><link rel="mw-deduplicated-inline-style" href="mw-data:TemplateStyles:r1129693374"><style data-mw-deduplicate="TemplateStyles:r1239400231">.mw-parser-output .navbar{display:inline;font-size:88%;font-weight:normal}.mw-parser-output .navbar-collapse{float:left;text-align:left}.mw-parser-output .navbar-boxtext{word-spacing:0}.mw-parser-output .navbar ul{display:inline-block;white-space:nowrap;line-height:inherit}.mw-parser-output .navbar-brackets::before{margin-right:-0.125em;content:"[ "}.mw-parser-output .navbar-brackets::after{margin-left:-0.125em;content:" ]"}.mw-parser-output .navbar li{word-spacing:-0.125em}.mw-parser-output .navbar a>span,.mw-parser-output .navbar a>abbr{text-decoration:inherit}.mw-parser-output .navbar-mini abbr{font-variant:small-caps;border-bottom:none;text-decoration:none;cursor:inherit}.mw-parser-output .navbar-ct-full{font-size:114%;margin:0 7em}.mw-parser-output .navbar-ct-mini{font-size:114%;margin:0 4em}html.skin-theme-clientpref-night .mw-parser-output .navbar li a abbr{color:var(--color-base)!important}@media(prefers-color-scheme:dark){html.skin-theme-clientpref-os .mw-parser-output .navbar li a abbr{color:var(--color-base)!important}}@media print{.mw-parser-output .navbar{display:none!important}}</style><div class="navbar plainlinks hlist navbar-mini"><ul><li class="nv-view"><a href="/wiki/Template:Chemical_data_validation" title="Template:Chemical data validation"><abbr title="View this template">v</abbr></a></li><li class="nv-talk"><a href="/wiki/Template_talk:Chemical_data_validation" class="mw-redirect" title="Template talk:Chemical data validation"><abbr title="Discuss this template">t</abbr></a></li><li class="nv-edit"><a href="/wiki/Special:EditPage/Template:Chemical_data_validation" title="Special:EditPage/Template:Chemical data validation"><abbr title="Edit this template">e</abbr></a></li></ul></div></td></tr></tbody></table> <p><a href="/wiki/Wikipedia:WikiProject_Chemicals" title="Wikipedia:WikiProject Chemicals">WikiProject Chemicals</a> and <a href="/wiki/Wikipedia:WikiProject_Pharmacology" title="Wikipedia:WikiProject Pharmacology">WikiProject Pharmacology</a> are validating the content in the infoboxes <span class="nowrap">{{</span><a href="/wiki/Template:Chembox" title="Template:Chembox">chembox</a><span class="nowrap">}}</span> and <span class="nowrap">{{</span><a href="/wiki/Template:Drugbox" class="mw-redirect" title="Template:Drugbox">drugbox</a><span class="nowrap">}}</span>. Values in the infobox are compared with values reported in literature, and when the values match, the revision is stored in the index for chembox and the index for drugbox, respectively. This is typically done for values that are 'immutable' (e.g., the boiling point of a chemical compound: the boiling point of <a href="/wiki/Water" title="Water">water</a> under standard conditions is 99.98 °C, and there is no plausible reason to suspect it will change). </p><p>We are verifying the <a href="/wiki/CAS_Registry_number" class="mw-redirect" title="CAS Registry number">CAS Registry number</a> (<code class="tpl-para" style="word-break:break-word;">|CASNo=</code> in <span class="nowrap">{{</span><a href="/wiki/Template:Chembox" title="Template:Chembox">chembox</a><span class="nowrap">}}</span>, <code class="tpl-para" style="word-break:break-word;">|CAS_number=</code> in <span class="nowrap">{{</span><a href="/wiki/Template:Drugbox" class="mw-redirect" title="Template:Drugbox">drugbox</a><span class="nowrap">}}</span>), <a href="/wiki/ChemSpider" title="ChemSpider">ChemSpider</a>ID (ChemSpiderID), <a href="/wiki/Unique_Ingredient_Identifier" title="Unique Ingredient Identifier">Unique Ingredient Identifier</a> (UNII), <a href="/wiki/InChI" class="mw-redirect" title="InChI">InChI</a>, <a href="/wiki/KEGG" title="KEGG">KEGG</a>, and <a href="/wiki/ChEMBL" title="ChEMBL">ChEMBL</a> by comparison with the data on <a rel="nofollow" class="external text" href="https://commonchemistry.cas.org/">CAS website</a>, <a rel="nofollow" class="external text" href="https://www.chemspider.com">ChemSpider</a> and <a rel="nofollow" class="external text" href="https://precision.fda.gov/uniisearch">FDA'S UNII Search Service</a> as well as from lists supplied by (CAS number, ChemSpiderID, InChI, UNII, ChEMBL and ChEBI) or downloaded from these websites (KEGG, DrugBank). In the meantime, we are trying to add, update and/or check as a number of other identifiers (InChI, InChIKey) by comparison of the data with the <a href="/wiki/ChemSpider" title="ChemSpider">ChemSpider</a> website. </p><p><a href="/wiki/User:CheMoBot" title="User:CheMoBot">CheMoBot</a> is following changes to these articles, and is set up to update the infoboxes. When it detects changes to values, it will change parameters in the infobox accordingly. These parameters are used by the template to show what the status of the fields are in the box. </p><p>Boxes that contain verified values that are the same as the values in the verified revision are tagged with <span typeof="mw:File"><span><img alt="check" src="//upload.wikimedia.org/wikipedia/en/thumb/f/fb/Yes_check.svg/12px-Yes_check.svg.png" decoding="async" width="12" height="12" class="mw-file-element" srcset="//upload.wikimedia.org/wikipedia/en/thumb/f/fb/Yes_check.svg/18px-Yes_check.svg.png 1.5x, //upload.wikimedia.org/wikipedia/en/thumb/f/fb/Yes_check.svg/24px-Yes_check.svg.png 2x" data-file-width="600" data-file-height="600"/></span></span><span style="display:none">Y</span> at the bottom, and boxes where some of these values are changed are tagged with <span typeof="mw:File"><span><img alt="☒" src="//upload.wikimedia.org/wikipedia/commons/thumb/a/a2/X_mark.svg/12px-X_mark.svg.png" decoding="async" width="12" height="14" class="mw-file-element" srcset="//upload.wikimedia.org/wikipedia/commons/thumb/a/a2/X_mark.svg/18px-X_mark.svg.png 1.5x, //upload.wikimedia.org/wikipedia/commons/thumb/a/a2/X_mark.svg/24px-X_mark.svg.png 2x" data-file-width="525" data-file-height="600"/></span></span><span style="display:none">N</span>. Moreover, the individual identifiers are tagged with <span typeof="mw:File"><span><img alt="check" src="//upload.wikimedia.org/wikipedia/en/thumb/f/fb/Yes_check.svg/12px-Yes_check.svg.png" decoding="async" width="12" height="12" class="mw-file-element" srcset="//upload.wikimedia.org/wikipedia/en/thumb/f/fb/Yes_check.svg/18px-Yes_check.svg.png 1.5x, //upload.wikimedia.org/wikipedia/en/thumb/f/fb/Yes_check.svg/24px-Yes_check.svg.png 2x" data-file-width="600" data-file-height="600"/></span></span><span style="display:none">Y</span> or <span typeof="mw:File"><span><img alt="☒" src="//upload.wikimedia.org/wikipedia/commons/thumb/a/a2/X_mark.svg/12px-X_mark.svg.png" decoding="async" width="12" height="14" class="mw-file-element" srcset="//upload.wikimedia.org/wikipedia/commons/thumb/a/a2/X_mark.svg/18px-X_mark.svg.png 1.5x, //upload.wikimedia.org/wikipedia/commons/thumb/a/a2/X_mark.svg/24px-X_mark.svg.png 2x" data-file-width="525" data-file-height="600"/></span></span><span style="display:none">N</span>. If the boxes contain changes to these verified fields, they are also categorized in <a href="/wiki/Category:Chemboxes_which_contain_changes_to_verified_fields" title="Category:Chemboxes which contain changes to verified fields">Category:Chemboxes which contain changes to verified fields</a>. Boxes that contain changes to other important fields are categorized in <a href="/wiki/Category:Chemboxes_which_contain_changes_to_watched_fields" title="Category:Chemboxes which contain changes to watched fields">Category:Chemboxes which contain changes to watched fields</a>. For an example, see <a class="external text" href="https://en.wikipedia.org/w/index.php?title=Sodium_laureth_sulfate&amp;diff=prev&amp;oldid=365742782">this vandalism</a>, quickly <a class="external text" href="https://en.wikipedia.org/w/index.php?title=Sodium_laureth_sulfate&amp;action=historysubmit&amp;diff=365744219&amp;oldid=365742868">flagged by CheMoBot</a>. </p><p>If you encounter a page with a <span class="nowrap">{{</span><a href="/wiki/Template:Chembox" title="Template:Chembox">chembox</a><span class="nowrap">}}</span> or <span class="nowrap">{{</span><a href="/wiki/Template:Drugbox" class="mw-redirect" title="Template:Drugbox">drugbox</a><span class="nowrap">}}</span> that shows an <span typeof="mw:File"><span><img alt="☒" src="//upload.wikimedia.org/wikipedia/commons/thumb/a/a2/X_mark.svg/12px-X_mark.svg.png" decoding="async" width="12" height="14" class="mw-file-element" srcset="//upload.wikimedia.org/wikipedia/commons/thumb/a/a2/X_mark.svg/18px-X_mark.svg.png 1.5x, //upload.wikimedia.org/wikipedia/commons/thumb/a/a2/X_mark.svg/24px-X_mark.svg.png 2x" data-file-width="525" data-file-height="600"/></span></span><span style="display:none">N</span>, then please check if the value is wrong (in which case, it can just be changed back to the value in the verified revision; the bot will do the rest), or if there is a mistake in the verified revision (if so, it may need an update of the index; if you need help with that, please ask the appropriate wikiproject). </p> <meta property="mw:PageProp/toc"/> <div class="mw-heading mw-heading2 ext-discussiontools-init-section"><h2 id="Verification_–_tagging_references" data-mw-thread-id="h-Verification_–_tagging_references"><span id="Verification_.E2.80.93_tagging_references"></span><span data-mw-comment-start="" id="h-Verification_–_tagging_references"></span>Verification – tagging references<span data-mw-comment-end="h-Verification_–_tagging_references"></span></h2><!--__DTELLIPSISBUTTON__{"threadItem":{"headingLevel":2,"name":"h-","type":"heading","level":0,"id":"h-Verification_\u2013_tagging_references","replies":[]}}--></div> <p>CheMoBot adds a template to a _Ref parameter (e.g. for CASNo, CASNo_Ref will be filled with <code>{{<a href="/wiki/Template:Cascite" title="Template:Cascite">cascite</a>|correct|XXX}}</code>) when the bot finds the field correct. The first parameter of the template is 'correct', or 'changed', and the box will show a tick or a cross accordingly on CASNo. The second parameter is a field that contains a reference for 'where' the parameter was verified. As we are at the moment verifying all fields against the CAS commonchemistry.org site, the bot replaces XXX with 'CAS' (i.e., <code>{{<a href="/wiki/Template:Cascite" title="Template:Cascite">cascite</a>|correct|CAS}}</code>). When using another place to verify the CASNo, please adapt this parameter accordingly and will try to retain this field throughout. When there will be significantly more verifications against non-commonchemistry.org-places, I will instruct the bot to fill the field standard with <code>{{<a href="/wiki/Template:Cascite" title="Template:Cascite">cascite</a>|correct|??}}</code> or something similar. </p> <div class="mw-heading mw-heading2 ext-discussiontools-init-section"><h2 id="Method_of_work" data-mw-thread-id="h-Method_of_work"><span data-mw-comment-start="" id="h-Method_of_work"></span>Method of work<span data-mw-comment-end="h-Method_of_work"></span></h2><!--__DTELLIPSISBUTTON__{"threadItem":{"headingLevel":2,"name":"h-","type":"heading","level":0,"id":"h-Method_of_work","replies":["h-First_1000-Method_of_work"]}}--></div> <p>Our approach is to start by checking that the CAS registry number and the structure match with the name. This will be used as a foundation upon which we can build a broader validation effort. Once we have the structure verified, we have the formula, and hence the molar mass, and we can also generate other machine representations such as SMILES, InChI and InChIKey. </p> <div class="mw-heading mw-heading3"><h3 id="First_1000" data-mw-thread-id="h-First_1000-Method_of_work"><span data-mw-comment-start="" id="h-First_1000-Method_of_work"></span>First 1000<span data-mw-comment-end="h-First_1000-Method_of_work"></span></h3></div> <p>After our <a href="/wiki/Wikipedia:WikiProject_Chemistry/IRC_discussions" title="Wikipedia:WikiProject Chemistry/IRC discussions">IRC meeting on January 13, 2009</a>, we used an Excel file to validate the first 1000 entries from the CAS XML file. This is available to project members <a rel="nofollow" class="external text" href="http://pluto.potsdam.edu/wikichem/index.php/File:CAS_Wikipedia_Combination_16Feb2009.xls">here</a>, on the password-protected site. Meanwhile, <a href="/wiki/User:Physchim62" title="User:Physchim62">User:Physchim62</a> validated the inorganics separately, and these can be found in the <a rel="nofollow" class="external text" href="http://pluto.potsdam.edu/wikichem/index.php/File:CAVer_0.7.mdb">CAVer file</a>. </p> <div class="mw-heading mw-heading2 ext-discussiontools-init-section"><h2 id="The_work" data-mw-thread-id="h-The_work"><span data-mw-comment-start="" id="h-The_work"></span>The work<span data-mw-comment-end="h-The_work"></span></h2><!--__DTELLIPSISBUTTON__{"threadItem":{"headingLevel":2,"name":"h-","type":"heading","level":0,"id":"h-The_work","replies":["h-Notes-The_work","h-Fields_to_check\/upload-The_work"]}}--></div> <p>We are now beginning to work through the list of "problem articles" found by User:Beetstra, and listed at <b><a href="/wiki/User:Beetstra/CASFoundCorrect" class="mw-redirect" title="User:Beetstra/CASFoundCorrect">User:Beetstra/CASFoundCorrect</a></b>. A description of the process will be added soon. </p> <div class="mw-heading mw-heading3"><h3 id="Notes" data-mw-thread-id="h-Notes-The_work"><span data-mw-comment-start="" id="h-Notes-The_work"></span>Notes<span data-mw-comment-end="h-Notes-The_work"></span></h3></div> <ul><li>Different <a href="/wiki/CAS_Registry_Number" title="CAS Registry Number">CAS Registry Numbers</a><sup id="cite_ref-CAS_dot_org_1-0" class="reference"><a href="#cite_note-CAS_dot_org-1"><span class="cite-bracket">[</span>1<span class="cite-bracket">]</span></a></sup> are used for each form of a substance. For example, something simple like <a href="/wiki/Alanine" title="Alanine">alanine</a> will have one CAS# for the D form, another for L, another for "unspecified" and a fourth one for racemic. There would be another four CAS#s for the hydrochloride, four for the (1:1) sulfate, four for the (2:1)sulfate, etc. It is very important that we match the correct form CAS# to our Chemboxes!</li> <li>Be aware that CAS uses an unusual system for representing some formulae, which may seem "wrong" to us. These involve describing salts such as sodium nitrate as HNO<sub>3</sub>·Na, and organic salts follow a similar system. Do not use such formulae on WP, but they are not "wrong" since they are merely a representation, not a formal structure. This also results in incorrect MolarMass in the FW section of the SDF file for salts.</li> <li>For complex chiral structures, such as <a href="/wiki/Bleomycin" title="Bleomycin">bleomycin</a>, which may be drawn very differently in WP than in Common Chemistry, I found it best to assign R/S for each center and compare that way. (And yes, Farseer drew bleomycin perfectly!)</li> <li>The CAS No. (that is, "<a href="/wiki/CAS_Registry_Number" title="CAS Registry Number">CAS Registry Number</a>"<sup id="cite_ref-CAS_dot_org_1-1" class="reference"><a href="#cite_note-CAS_dot_org-1"><span class="cite-bracket">[</span>1<span class="cite-bracket">]</span></a></sup>) in a Chembox will receive a green tick (check mark) once <span class="nowrap">{{</span><a href="/wiki/Template:Cascite" title="Template:Cascite">cascite</a><span class="nowrap">}}</span> is added. This does not happen yet in the Drugbox (there is no change at present), but we hope to enable a similar system there too, if <a href="/wiki/Wikipedia:PHARM" class="mw-redirect" title="Wikipedia:PHARM">WP:PHARM</a> is in agreement.</li></ul> <div class="mw-heading mw-heading3"><h3 id="Fields_to_check/upload" data-mw-thread-id="h-Fields_to_check/upload-The_work"><span id="Fields_to_check.2Fupload"></span><span data-mw-comment-start="" id="h-Fields_to_check/upload-The_work"></span>Fields to check/upload<span data-mw-comment-end="h-Fields_to_check/upload-The_work"></span></h3></div> <dl><dt>Chemboxes</dt></dl> <p>Check structure, CAS no., Formula, MolarMass. </p><p>Notes: </p> <ul><li>1. the bot 'divides' the fields in two sets, watched and unwatched; all changes are reported, but the watched fields are the ones we really want to take care of, those are the fields that contain hardcore, verifiable data that are very unlikely to change (as the boiling point of <a href="/wiki/Water_(molecule)" class="mw-redirect" title="Water (molecule)">water</a>, the CAS-number of <a href="/wiki/Benzene" title="Benzene">benzene</a>, the number of carbons in <a href="/wiki/Glucose" title="Glucose">glucose</a>. N.B. the list of 'watched' fields may need to be updated</li></ul> <ul><li>2. The bot regards an empty field as 'unknown'. It will report changes to this field, but will assign a lower 'warning level' to it.</li> <li>3. Things between &lt;!-- and --> are 'comments', they can be saved and appear in the editbox, but do not produce visible wikicode.</li> <li>When a 'better' version of a page comes up, change the number on the page. If there are two revids for the same page, it uses the one closest to the bottom of the index-page (the page gets parsed top to bottom, replacing values if duplicates occur).</li></ul> <div class="mw-heading mw-heading2 ext-discussiontools-init-section"><!--__DTSUBSCRIBEBUTTONDESKTOP__{&quot;headingLevel&quot;:2,&quot;name&quot;:&quot;h-Walkerma-2009-11-03T22:48:00.000Z&quot;,&quot;type&quot;:&quot;heading&quot;,&quot;level&quot;:0,&quot;id&quot;:&quot;h-The_workers-2009-11-03T22:48:00.000Z&quot;,&quot;replies&quot;:[&quot;c-Walkerma-2009-11-03T22:48:00.000Z-The_workers&quot;],&quot;text&quot;:&quot;The workers&quot;,&quot;linkableTitle&quot;:&quot;The workers&quot;}--><h2 id="The_workers" data-mw-thread-id="h-The_workers-2009-11-03T22:48:00.000Z"><span data-mw-comment-start="" id="h-The_workers-2009-11-03T22:48:00.000Z"></span>The workers<span data-mw-comment-end="h-The_workers-2009-11-03T22:48:00.000Z"></span></h2><!--__DTELLIPSISBUTTON__{"threadItem":{"headingLevel":2,"name":"h-Walkerma-2009-11-03T22:48:00.000Z","type":"heading","level":0,"id":"h-The_workers-2009-11-03T22:48:00.000Z","replies":["c-Walkerma-2009-11-03T22:48:00.000Z-The_workers"]}}--><div class="ext-discussiontools-init-section-bar"><div class="ext-discussiontools-init-section-metadata"><!--__DTLATESTCOMMENTTHREAD__{"id":"c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z","timestamp":"2016-12-21T07:12:00.000Z"}__--><!--__DTCOMMENTCOUNT__6__--><!--__DTAUTHORCOUNT__3__--></div><div class="ext-discussiontools-init-section-actions"><!--__DTSUBSCRIBEBUTTONMOBILE__{&quot;headingLevel&quot;:2,&quot;name&quot;:&quot;h-Walkerma-2009-11-03T22:48:00.000Z&quot;,&quot;type&quot;:&quot;heading&quot;,&quot;level&quot;:0,&quot;id&quot;:&quot;h-The_workers-2009-11-03T22:48:00.000Z&quot;,&quot;replies&quot;:[&quot;c-Walkerma-2009-11-03T22:48:00.000Z-The_workers&quot;],&quot;text&quot;:&quot;The workers&quot;,&quot;linkableTitle&quot;:&quot;The workers&quot;}--></div></div></div> <p><span data-mw-comment-start="" id="c-Walkerma-2009-11-03T22:48:00.000Z-The_workers"></span>Please sign up to work on some of the articles listed at <b><a href="/wiki/User:Beetstra/CASFoundCorrect" class="mw-redirect" title="User:Beetstra/CASFoundCorrect">User:Beetstra/CASFoundCorrect</a></b>. More information later. </p> <ul><li>1–1000 <a href="/wiki/User:Walkerma" title="User:Walkerma">Walkerma</a> (<a href="/wiki/User_talk:Walkerma" title="User talk:Walkerma">talk</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Walkerma-2009-11-03T22:48:00.000Z-The_workers" class="ext-discussiontools-init-timestamplink">22:48, 3 November 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Walkerma-2009-11-03T22:48:00.000Z-The_workers"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-11-03T22:48:00.000Z","author":"Walkerma","type":"comment","level":1,"id":"c-Walkerma-2009-11-03T22:48:00.000Z-The_workers","replies":["c-Ambix-2009-11-17T17:57:00.000Z-Walkerma-2009-11-03T22:48:00.000Z","c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z","c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-1","c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-2","c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-3"]}}--></span><span data-mw-comment-end="c-Walkerma-2009-11-03T22:48:00.000Z-The_workers"></span></li> <li><span data-mw-comment-start="" id="c-Ambix-2009-11-17T17:57:00.000Z-Walkerma-2009-11-03T22:48:00.000Z"></span>1001–2000 <a href="/wiki/User:Ambix" title="User:Ambix">Ambix</a> (<a href="/wiki/User_talk:Ambix" title="User talk:Ambix">talk</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Ambix-2009-11-17T17:57:00.000Z-Walkerma-2009-11-03T22:48:00.000Z" class="ext-discussiontools-init-timestamplink">17:57, 17 November 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Ambix-2009-11-17T17:57:00.000Z-Walkerma-2009-11-03T22:48:00.000Z"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-11-17T17:57:00.000Z","author":"Ambix","type":"comment","level":2,"id":"c-Ambix-2009-11-17T17:57:00.000Z-Walkerma-2009-11-03T22:48:00.000Z","replies":[]}}--></span><span data-mw-comment-end="c-Ambix-2009-11-17T17:57:00.000Z-Walkerma-2009-11-03T22:48:00.000Z"></span></li> <li><span data-mw-comment-start="" id="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z"></span>2001–3000 <a href="/wiki/User:Thisisnotcam" title="User:Thisisnotcam"> ɯɐɔ </a> (<a href="/wiki/User_talk:Thisisnotcam" title="User talk:Thisisnotcam">talk</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z" class="ext-discussiontools-init-timestamplink">07:12, 21 December 2016 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2016-12-21T07:12:00.000Z","author":"Thisisnotcam","type":"comment","level":2,"id":"c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z","replies":[],"displayName":"\u026f\u0250\u0254"}}--></span><span data-mw-comment-end="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z"></span></li> <li><span data-mw-comment-start="" id="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-1"></span>3001–4000 <a href="/wiki/User:Thisisnotcam" title="User:Thisisnotcam"> ɯɐɔ </a> (<a href="/wiki/User_talk:Thisisnotcam" title="User talk:Thisisnotcam">talk</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-1" class="ext-discussiontools-init-timestamplink">07:12, 21 December 2016 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-1"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2016-12-21T07:12:00.000Z","author":"Thisisnotcam","type":"comment","level":2,"id":"c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-1","replies":[],"displayName":"\u026f\u0250\u0254"}}--></span><span data-mw-comment-end="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-1"></span></li> <li><span data-mw-comment-start="" id="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-2"></span>4001–5000 <a href="/wiki/User:Thisisnotcam" title="User:Thisisnotcam"> ɯɐɔ </a> (<a href="/wiki/User_talk:Thisisnotcam" title="User talk:Thisisnotcam">talk</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-2" class="ext-discussiontools-init-timestamplink">07:12, 21 December 2016 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-2"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2016-12-21T07:12:00.000Z","author":"Thisisnotcam","type":"comment","level":2,"id":"c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-2","replies":[],"displayName":"\u026f\u0250\u0254"}}--></span><span data-mw-comment-end="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-2"></span></li> <li><span data-mw-comment-start="" id="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-3"></span>5001–end <a href="/wiki/User:Thisisnotcam" title="User:Thisisnotcam"> ɯɐɔ </a> (<a href="/wiki/User_talk:Thisisnotcam" title="User talk:Thisisnotcam">talk</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-3" class="ext-discussiontools-init-timestamplink">07:12, 21 December 2016 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-3"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2016-12-21T07:12:00.000Z","author":"Thisisnotcam","type":"comment","level":2,"id":"c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-3","replies":[],"displayName":"\u026f\u0250\u0254"}}--></span><span data-mw-comment-end="c-Thisisnotcam-2016-12-21T07:12:00.000Z-Walkerma-2009-11-03T22:48:00.000Z-3"></span></li></ul> <div class="mw-heading mw-heading2 ext-discussiontools-init-section"><h2 id="The_software" data-mw-thread-id="h-The_software"><span data-mw-comment-start="" id="h-The_software"></span>The software<span data-mw-comment-end="h-The_software"></span></h2><!--__DTELLIPSISBUTTON__{"threadItem":{"headingLevel":2,"name":"h-","type":"heading","level":0,"id":"h-The_software","replies":["h-{{cascite}}-set-The_software"]}}--></div> <div class="mw-heading mw-heading3"><h3 id="{{cascite}}-set" data-mw-thread-id="h-{{cascite}}-set-The_software"><span id=".7B.7Bcascite.7D.7D-set"></span><span data-mw-comment-start="" id="h-{{cascite}}-set-The_software"></span><span class="nowrap">{{cascite}}</span>-set<span data-mw-comment-end="h-{{cascite}}-set-The_software"></span></h3></div> <ul><li><span class="nowrap">{{</span><a href="/wiki/Template:Cascite" title="Template:Cascite">Cascite</a><span class="nowrap">}}</span> set of bot-handled templates, used for <i>verified</i> parameters</li></ul> <div class="mw-heading mw-heading2 ext-discussiontools-init-section"><!--__DTSUBSCRIBEBUTTONDESKTOP__{&quot;headingLevel&quot;:2,&quot;name&quot;:&quot;h-Physchim62-2009-01-23T22:35:00.000Z&quot;,&quot;type&quot;:&quot;heading&quot;,&quot;level&quot;:0,&quot;id&quot;:&quot;h-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z&quot;,&quot;replies&quot;:[&quot;h-1\u2013100-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-101\u2013200-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-201\u2013300-Problems_found_when_validating_the_Excel_file-2009-02-10T11:48:00.000Z&quot;,&quot;h-301\u2013400-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z&quot;,&quot;h-401\u2013500-Problems_found_when_validating_the_Excel_file-2009-02-06T23:27:00.000Z&quot;,&quot;h-501\u2013600-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-601\u2013700-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-701\u2013800-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-801\u2013900-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-901\u20131000-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-Inorganics-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-Elements_and_ions-Problems_found_when_validating_the_Excel_file&quot;],&quot;text&quot;:&quot;Problems found when validating the Excel file&quot;,&quot;linkableTitle&quot;:&quot;Problems found when validating the Excel file&quot;}--><h2 id="Problems_found_when_validating_the_Excel_file" data-mw-thread-id="h-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z"><span data-mw-comment-start="" id="h-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z"></span>Problems found when validating the Excel file<span data-mw-comment-end="h-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z"></span></h2><!--__DTELLIPSISBUTTON__{"threadItem":{"headingLevel":2,"name":"h-Physchim62-2009-01-23T22:35:00.000Z","type":"heading","level":0,"id":"h-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z","replies":["h-1\u2013100-Problems_found_when_validating_the_Excel_file","h-101\u2013200-Problems_found_when_validating_the_Excel_file","h-201\u2013300-Problems_found_when_validating_the_Excel_file-2009-02-10T11:48:00.000Z","h-301\u2013400-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z","h-401\u2013500-Problems_found_when_validating_the_Excel_file-2009-02-06T23:27:00.000Z","h-501\u2013600-Problems_found_when_validating_the_Excel_file","h-601\u2013700-Problems_found_when_validating_the_Excel_file","h-701\u2013800-Problems_found_when_validating_the_Excel_file","h-801\u2013900-Problems_found_when_validating_the_Excel_file","h-901\u20131000-Problems_found_when_validating_the_Excel_file","h-Inorganics-Problems_found_when_validating_the_Excel_file","h-Elements_and_ions-Problems_found_when_validating_the_Excel_file"]}}--><div class="ext-discussiontools-init-section-bar"><div class="ext-discussiontools-init-section-metadata"><!--__DTLATESTCOMMENTTHREAD__{"id":"c-Tweenk-2009-11-15T21:41:00.000Z-201\u2013300","timestamp":"2009-11-15T21:41:00.000Z"}__--><!--__DTCOMMENTCOUNT__13__--><!--__DTAUTHORCOUNT__6__--></div><div class="ext-discussiontools-init-section-actions"><!--__DTSUBSCRIBEBUTTONMOBILE__{&quot;headingLevel&quot;:2,&quot;name&quot;:&quot;h-Physchim62-2009-01-23T22:35:00.000Z&quot;,&quot;type&quot;:&quot;heading&quot;,&quot;level&quot;:0,&quot;id&quot;:&quot;h-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z&quot;,&quot;replies&quot;:[&quot;h-1\u2013100-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-101\u2013200-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-201\u2013300-Problems_found_when_validating_the_Excel_file-2009-02-10T11:48:00.000Z&quot;,&quot;h-301\u2013400-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z&quot;,&quot;h-401\u2013500-Problems_found_when_validating_the_Excel_file-2009-02-06T23:27:00.000Z&quot;,&quot;h-501\u2013600-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-601\u2013700-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-701\u2013800-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-801\u2013900-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-901\u20131000-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-Inorganics-Problems_found_when_validating_the_Excel_file&quot;,&quot;h-Elements_and_ions-Problems_found_when_validating_the_Excel_file&quot;],&quot;text&quot;:&quot;Problems found when validating the Excel file&quot;,&quot;linkableTitle&quot;:&quot;Problems found when validating the Excel file&quot;}--></div></div></div> <p>Please note any "to be checked" entries here. </p> <div class="mw-heading mw-heading3"><h3 id="1–100" data-mw-thread-id="h-1–100-Problems_found_when_validating_the_Excel_file"><span id="1.E2.80.93100"></span><span data-mw-comment-start="" id="h-1–100-Problems_found_when_validating_the_Excel_file"></span>1–100<span data-mw-comment-end="h-1–100-Problems_found_when_validating_the_Excel_file"></span></h3></div> <div class="mw-heading mw-heading3"><h3 id="101–200" data-mw-thread-id="h-101–200-Problems_found_when_validating_the_Excel_file"><span id="101.E2.80.93200"></span><span data-mw-comment-start="" id="h-101–200-Problems_found_when_validating_the_Excel_file"></span>101–200<span data-mw-comment-end="h-101–200-Problems_found_when_validating_the_Excel_file"></span></h3></div> <div class="mw-heading mw-heading3"><h3 id="201–300" data-mw-thread-id="h-201–300-Problems_found_when_validating_the_Excel_file-2009-02-10T11:48:00.000Z"><span id="201.E2.80.93300"></span><span data-mw-comment-start="" id="h-201–300-Problems_found_when_validating_the_Excel_file-2009-02-10T11:48:00.000Z"></span>201–300<span data-mw-comment-end="h-201–300-Problems_found_when_validating_the_Excel_file-2009-02-10T11:48:00.000Z"></span></h3></div> <ul><li><a href="/wiki/Kanamycin" class="mw-redirect" title="Kanamycin"><span data-mw-comment-start="" id="c-Fvasconcellos-2009-02-10T11:48:00.000Z-201–300"></span>Kanamycin</a> One chiral center seems to not match CAS. Are there multiple forms of this? Structure says Kanamycin A. <ul><li>Yes, there are multiple forms (A, B, C, D, X) and several derivatives, but the difference is in the side chains. <a href="/wiki/User:Fvasconcellos" title="User:Fvasconcellos">Fvasconcellos</a><small> (<a href="/wiki/User_talk:Fvasconcellos" title="User talk:Fvasconcellos">t</a>·<a href="/wiki/Special:Contributions/Fvasconcellos" title="Special:Contributions/Fvasconcellos">c</a>)</small> <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Fvasconcellos-2009-02-10T11:48:00.000Z-201–300" class="ext-discussiontools-init-timestamplink">11:48, 10 February 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Fvasconcellos-2009-02-10T11:48:00.000Z-201–300"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-02-10T11:48:00.000Z","author":"Fvasconcellos","type":"comment","level":2,"id":"c-Fvasconcellos-2009-02-10T11:48:00.000Z-201\u2013300","replies":[]}}--></span><span data-mw-comment-end="c-Fvasconcellos-2009-02-10T11:48:00.000Z-201–300"></span></li></ul></li> <li><a href="/wiki/Tocopherol" title="Tocopherol"><span data-mw-comment-start="" id="c-TimVickers-2009-09-10T04:28:00.000Z-201–300"></span>Tocopherol</a> One chiral center seems not to match, multiple forms? a-tocopherol, CAS just says tocopherol.</li></ul> <dl><dd><dl><dd>There are multiple isomers. <a href="/wiki/File:RRR_alpha-tocopherol.png" title="File:RRR alpha-tocopherol.png">File:RRR alpha-tocopherol.png</a> shows the most common isomer. <a href="/wiki/User:TimVickers" title="User:TimVickers">Tim Vickers</a> (<a href="/wiki/User_talk:TimVickers" title="User talk:TimVickers">talk</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-TimVickers-2009-09-10T04:28:00.000Z-201–300" class="ext-discussiontools-init-timestamplink">04:28, 10 September 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-TimVickers-2009-09-10T04:28:00.000Z-201–300"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-09-10T04:28:00.000Z","author":"TimVickers","type":"comment","level":2,"id":"c-TimVickers-2009-09-10T04:28:00.000Z-201\u2013300","replies":[],"displayName":"Tim Vickers"}}--></span><span data-mw-comment-end="c-TimVickers-2009-09-10T04:28:00.000Z-201–300"></span></dd></dl></dd></dl> <ul><li><a href="/wiki/Acetylcholine" title="Acetylcholine"><span data-mw-comment-start="" id="c-Fvasconcellos-2009-02-10T11:52:00.000Z-201–300"></span>Acetylcholine</a> Parent ion, infobox not chembox.</li> <li><a href="/wiki/Linoleic_acid" title="Linoleic acid">Linoleic_acid</a> WP says cis, cis, CAS says trans trans 'linoelaidic acid', the whole world says linoleic acid is 60-33-3 including the spreadsheet and sigma. <ul><li>60-33-3 <a rel="nofollow" class="external text" href="http://www.chemspider.com/Chemical-Structure.4444105.html">appears</a> to refer to all-<i>cis</i>. <a href="/wiki/User:Fvasconcellos" title="User:Fvasconcellos">Fvasconcellos</a><small> (<a href="/wiki/User_talk:Fvasconcellos" title="User talk:Fvasconcellos">t</a>·<a href="/wiki/Special:Contributions/Fvasconcellos" title="Special:Contributions/Fvasconcellos">c</a>)</small> <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Fvasconcellos-2009-02-10T11:52:00.000Z-201–300" class="ext-discussiontools-init-timestamplink">11:52, 10 February 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Fvasconcellos-2009-02-10T11:52:00.000Z-201–300"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-02-10T11:52:00.000Z","author":"Fvasconcellos","type":"comment","level":2,"id":"c-Fvasconcellos-2009-02-10T11:52:00.000Z-201\u2013300","replies":["c-Ambix-2009-02-12T12:47:00.000Z-Fvasconcellos-2009-02-10T11:52:00.000Z"]}}--></span><span data-mw-comment-end="c-Fvasconcellos-2009-02-10T11:52:00.000Z-201–300"></span> <ul><li><span data-mw-comment-start="" id="c-Ambix-2009-02-12T12:47:00.000Z-Fvasconcellos-2009-02-10T11:52:00.000Z"></span>This is very strange, it is trans,trans in the union file and cis,cis in the wikichem file (I have been using the union file to verify CAS numbers). I need to look into this. <a href="/wiki/User:Ambix" title="User:Ambix">Ambix</a> (<a href="/wiki/User_talk:Ambix" title="User talk:Ambix">talk</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Ambix-2009-02-12T12:47:00.000Z-Fvasconcellos-2009-02-10T11:52:00.000Z" class="ext-discussiontools-init-timestamplink">12:47, 12 February 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Ambix-2009-02-12T12:47:00.000Z-Fvasconcellos-2009-02-10T11:52:00.000Z"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-02-12T12:47:00.000Z","author":"Ambix","type":"comment","level":4,"id":"c-Ambix-2009-02-12T12:47:00.000Z-Fvasconcellos-2009-02-10T11:52:00.000Z","replies":[]}}--></span><span data-mw-comment-end="c-Ambix-2009-02-12T12:47:00.000Z-Fvasconcellos-2009-02-10T11:52:00.000Z"></span></li></ul></li></ul></li> <li><a href="/wiki/Glucose_1-phosphate" title="Glucose 1-phosphate"><span data-mw-comment-start="" id="c-Tweenk-2009-11-15T21:41:00.000Z-201–300"></span>Glucose 1-phosphate</a> One chiral center is not specified (should be up to match CAS). (probably a result of copying glucose skeleton, in which this atom is not chiral?). <ul><li>See <a href="/wiki/Anomer" title="Anomer">anomer</a>. It is likely that both forms (alpha and beta-glucopyranoside) are described by this CAS number. --<a href="/wiki/User:Tweenk" title="User:Tweenk">Tweenk</a> (<a href="/wiki/User_talk:Tweenk" title="User talk:Tweenk">talk</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Tweenk-2009-11-15T21:41:00.000Z-201–300" class="ext-discussiontools-init-timestamplink">21:41, 15 November 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Tweenk-2009-11-15T21:41:00.000Z-201–300"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-11-15T21:41:00.000Z","author":"Tweenk","type":"comment","level":2,"id":"c-Tweenk-2009-11-15T21:41:00.000Z-201\u2013300","replies":[]}}--></span><span data-mw-comment-end="c-Tweenk-2009-11-15T21:41:00.000Z-201–300"></span></li></ul></li> <li><a href="/wiki/Streptomycin" title="Streptomycin">Streptomycin</a> 57-92-1 Seems to be mirror image of WP structure.</li> <li><a href="/wiki/Tubocurarine" class="mw-redirect" title="Tubocurarine">Tubocurarine</a> 57-94-3 and 57-95-4 Structure is messed up in union file. I can't make sense of it.</li></ul> <div class="mw-heading mw-heading3"><h3 id="301–400" data-mw-thread-id="h-301–400-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z"><span id="301.E2.80.93400"></span><span data-mw-comment-start="" id="h-301–400-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z"></span>301–400<span data-mw-comment-end="h-301–400-Problems_found_when_validating_the_Excel_file-2009-01-23T22:35:00.000Z"></span></h3></div> <ul><li><a href="/wiki/Cephalosporin" title="Cephalosporin"><span data-mw-comment-start="" id="c-Fvasconcellos-2009-01-24T19:54:00.000Z-301–400"></span>Cephalosporin</a> No chembox and other issues. <ul><li>This is a class article, I don't think there should be a chembox. <a href="/wiki/User:Fvasconcellos" title="User:Fvasconcellos">Fvasconcellos</a><small> (<a href="/wiki/User_talk:Fvasconcellos" title="User talk:Fvasconcellos">t</a>·<a href="/wiki/Special:Contributions/Fvasconcellos" title="Special:Contributions/Fvasconcellos">c</a>)</small> <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Fvasconcellos-2009-01-24T19:54:00.000Z-301–400" class="ext-discussiontools-init-timestamplink">19:54, 24 January 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Fvasconcellos-2009-01-24T19:54:00.000Z-301–400"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-01-24T19:54:00.000Z","author":"Fvasconcellos","type":"comment","level":2,"id":"c-Fvasconcellos-2009-01-24T19:54:00.000Z-301\u2013400","replies":["c-Physchim62-2009-01-25T20:19:00.000Z-Fvasconcellos-2009-01-24T19:54:00.000Z"]}}--></span><span data-mw-comment-end="c-Fvasconcellos-2009-01-24T19:54:00.000Z-301–400"></span></li> <li><span data-mw-comment-start="" id="c-Physchim62-2009-01-25T20:19:00.000Z-Fvasconcellos-2009-01-24T19:54:00.000Z"></span>The CASRN refers to <a href="/wiki/Cephalosporin_C" title="Cephalosporin C">Cephalosporin C</a>, for which we don't seem to have an article. <a href="/wiki/User:Physchim62" title="User:Physchim62">Physchim62</a> <a href="/wiki/User_talk:Physchim62" title="User talk:Physchim62">(talk)</a> <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Physchim62-2009-01-25T20:19:00.000Z-Fvasconcellos-2009-01-24T19:54:00.000Z" class="ext-discussiontools-init-timestamplink">20:19, 25 January 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Physchim62-2009-01-25T20:19:00.000Z-Fvasconcellos-2009-01-24T19:54:00.000Z"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-01-25T20:19:00.000Z","author":"Physchim62","type":"comment","level":3,"id":"c-Physchim62-2009-01-25T20:19:00.000Z-Fvasconcellos-2009-01-24T19:54:00.000Z","replies":[]}}--></span><span data-mw-comment-end="c-Physchim62-2009-01-25T20:19:00.000Z-Fvasconcellos-2009-01-24T19:54:00.000Z"></span></li></ul></li> <li><a href="/wiki/Lactose" title="Lactose"><span data-mw-comment-start="" id="c-Physchim62-2009-01-23T22:35:00.000Z-301–400"></span>Lactose</a> CAS is for open chain aldehyde form, is this significant? <ul><li>I don't think so, but we're checking. <a href="/wiki/User:Physchim62" title="User:Physchim62">Physchim62</a> <a href="/wiki/User_talk:Physchim62" title="User talk:Physchim62">(talk)</a> <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Physchim62-2009-01-23T22:35:00.000Z-301–400" class="ext-discussiontools-init-timestamplink">22:35, 23 January 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Physchim62-2009-01-23T22:35:00.000Z-301–400"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-01-23T22:35:00.000Z","author":"Physchim62","type":"comment","level":2,"id":"c-Physchim62-2009-01-23T22:35:00.000Z-301\u2013400","replies":[]}}--></span><span data-mw-comment-end="c-Physchim62-2009-01-23T22:35:00.000Z-301–400"></span></li></ul></li> <li><a href="/wiki/Methionine" title="Methionine"><span data-mw-comment-start="" id="c-Physchim62-2009-01-23T22:35:00.000Z-301–400-1"></span>Methionine</a> Chiral issues. <ul><li>as per talk page <a href="/wiki/User:Physchim62" title="User:Physchim62">Physchim62</a> <a href="/wiki/User_talk:Physchim62" title="User talk:Physchim62">(talk)</a> <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Physchim62-2009-01-23T22:35:00.000Z-301–400-1" class="ext-discussiontools-init-timestamplink">22:35, 23 January 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Physchim62-2009-01-23T22:35:00.000Z-301–400-1"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-01-23T22:35:00.000Z","author":"Physchim62","type":"comment","level":2,"id":"c-Physchim62-2009-01-23T22:35:00.000Z-301\u2013400-1","replies":[]}}--></span><span data-mw-comment-end="c-Physchim62-2009-01-23T22:35:00.000Z-301–400-1"></span></li></ul></li> <li><a href="/wiki/Evans_blue" class="mw-disambig" title="Evans blue">Evans_blue</a> KEGG is marked as incorrect but is correct at current value of C19422. <a rel="nofollow" class="external free" href="http://www.kegg.jp/entry/C19422">http://www.kegg.jp/entry/C19422</a></li></ul> <div class="mw-heading mw-heading3"><h3 id="401–500" data-mw-thread-id="h-401–500-Problems_found_when_validating_the_Excel_file-2009-02-06T23:27:00.000Z"><span id="401.E2.80.93500"></span><span data-mw-comment-start="" id="h-401–500-Problems_found_when_validating_the_Excel_file-2009-02-06T23:27:00.000Z"></span>401–500<span data-mw-comment-end="h-401–500-Problems_found_when_validating_the_Excel_file-2009-02-06T23:27:00.000Z"></span></h3></div> <ul><li><a href="/wiki/Cholecalciferol" title="Cholecalciferol"><span data-mw-comment-start="" id="c-Edgar181-2009-02-11T19:12:00.000Z-401–500"></span>Cholecalciferol</a>: The structure diagram has one carbon atom with two wedge bonds attached, making verification difficult (the stereochemistry should be <i>R</i> here, and I think it is)</li> <li><a href="/wiki/Vitamin_B12" title="Vitamin B12">Vitamin B12</a>: The structure diagram does not adequately specify the stereochemistry of the Corrin ring</li> <li><a href="/wiki/Ellman%27s_reagent" title="Ellman's reagent">Ellman's reagent</a>: no chembox, and needs text cleanup <ul><li>I added a chembox. -- <a href="/wiki/User:Edgar181" title="User:Edgar181">Ed</a> (<a href="/wiki/User_talk:Edgar181" title="User talk:Edgar181">Edgar181</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Edgar181-2009-02-11T19:12:00.000Z-401–500" class="ext-discussiontools-init-timestamplink">19:12, 11 February 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Edgar181-2009-02-11T19:12:00.000Z-401–500"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-02-11T19:12:00.000Z","author":"Edgar181","type":"comment","level":2,"id":"c-Edgar181-2009-02-11T19:12:00.000Z-401\u2013500","replies":[],"displayName":"Ed"}}--></span><span data-mw-comment-end="c-Edgar181-2009-02-11T19:12:00.000Z-401–500"></span></li></ul></li> <li><a href="/wiki/Sanger%27s_reagent" class="mw-redirect" title="Sanger's reagent"><span data-mw-comment-start="" id="c-Ambix-2009-02-06T23:27:00.000Z-401–500"></span>Sanger's reagent</a>: no chembox</li> <li><a href="/wiki/Asparagine" title="Asparagine">Asparagine</a>: The structure diagram has one carbon atom with two wedge bonds attached, making verification difficult (the stereochemistry should be <i>S</i> here, and is)</li> <li><a href="/wiki/Histidine" title="Histidine">Histidine</a>: Structure needs to show stereochemistry</li> <li><a href="/wiki/Medroxyprogesterone_acetate" title="Medroxyprogesterone acetate">Medroxyprogesterone acetate</a>: Redirects to <a href="/wiki/Medroxyprogesterone" title="Medroxyprogesterone">Medroxyprogesterone</a></li> <li><a href="/wiki/Veratridine" title="Veratridine">Veratridine</a>: still to be verified, the structure displays badly in ChemFileBrowser</li> <li><a href="/wiki/Sodium_lactate" title="Sodium lactate">Sodium lactate</a>: old-style chembox; note that CASRN is for unspecified stereochemistry</li> <li><a href="/wiki/Valine" title="Valine">Valine</a>: The structure diagram has one carbon atom with two wedge bonds attached, making verification difficult (the stereochemistry should be <i>S</i> here, and is)</li> <li><a href="/wiki/Threonine" title="Threonine">Threonine</a>: The structure diagram does not specify the stereochemistry at the two chiral centres (should be 2<i>S</i>,3<i>R</i>)</li> <li><a href="/wiki/Endrin" title="Endrin">Endrin</a>: The structure diagram appears to show the <i>endo</i>-isomer whereas the CASRN is for the <i>exo</i>-isomer (or vice versa, I never was very good at this particular bit of nomenclature! in any case, it's not the same compound!) We should recheck with <a href="/wiki/Dieldrin" title="Dieldrin">Dieldrin</a> (CASRN [60-57-1]) as well. Neither compound has the stereochemistry correctly specified. <ul><li>I've rechecked Dieldrin, adding the implicit hydrogens to the WP structure and drawing in chemsketch, I also copied the CAS structure exactly and had the program assign stereo labels. They match, which leads me to think my initial verify is OK. It maybe should be noted that while the carbon skeletons look to be the same projection, WP is from above and CAS (turns out to be) from below. If you are still unhappy could you describe your assignment in more detail? I'll try the chemsketch method with Endrin and hopefully we can compare notes <a href="/wiki/User:Ambix" title="User:Ambix">Ambix</a> (<a href="/wiki/User_talk:Ambix" title="User talk:Ambix">talk</a>) <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Ambix-2009-02-06T23:27:00.000Z-401–500" class="ext-discussiontools-init-timestamplink">23:27, 6 February 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Ambix-2009-02-06T23:27:00.000Z-401–500"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-02-06T23:27:00.000Z","author":"Ambix","type":"comment","level":2,"id":"c-Ambix-2009-02-06T23:27:00.000Z-401\u2013500","replies":["c-Physchim62-2009-02-09T23:23:00.000Z-Ambix-2009-02-06T23:27:00.000Z"]}}--></span><span data-mw-comment-end="c-Ambix-2009-02-06T23:27:00.000Z-401–500"></span></li> <li><span data-mw-comment-start="" id="c-Physchim62-2009-02-09T23:23:00.000Z-Ambix-2009-02-06T23:27:00.000Z"></span>I have checked Endrin with the same process and it does not match. There is an older version of this image <a class="external text" href="https://upload.wikimedia.org/wikipedia/commons/archive/7/7a/20060104083339!Endrin.png">Endrin.png</a> and this does match. Given the difficulties of transposing a 3D structure to more conventional form it would probably be better to have a more conventional structure as well for compounds like this but I would suggest we avoid removing 3D structures providing it is possible to validate them. I will investigate further. <ul><li>I suggest that for our <a href="https://commons.wikimedia.org/wiki/Commons:WikiProject_Chemistry/Structure_validation" class="extiw" title="commons:Commons:WikiProject Chemistry/Structure validation"><i>validated</i> structure</a> on such compounds, we should explicitly show the stereochemistry of each chiral centre, which is not the case at present on Endrin and Dieldrin (even if a knowledgeable chemist can figure out what it <i>must</i> be from the diagram). That doesn't <i>necessarily</i> mean changing the structures in the chemboxes (our images for inorganics don't always give a clear idea of the structure), but we should insist on the chembox information being correct and not-misleading, and that the full details be available in the article (maybe in a separate image). <a href="/wiki/User:Physchim62" title="User:Physchim62">Physchim62</a> <a href="/wiki/User_talk:Physchim62" title="User talk:Physchim62">(talk)</a> <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Physchim62-2009-02-09T23:23:00.000Z-Ambix-2009-02-06T23:27:00.000Z" class="ext-discussiontools-init-timestamplink">23:23, 9 February 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Physchim62-2009-02-09T23:23:00.000Z-Ambix-2009-02-06T23:27:00.000Z"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-02-09T23:23:00.000Z","author":"Physchim62","type":"comment","level":3,"id":"c-Physchim62-2009-02-09T23:23:00.000Z-Ambix-2009-02-06T23:27:00.000Z","replies":[]}}--></span><span data-mw-comment-end="c-Physchim62-2009-02-09T23:23:00.000Z-Ambix-2009-02-06T23:27:00.000Z"></span></li></ul></li></ul></li> <li><a href="/wiki/Dichlorodiphenyldichloroethylene" title="Dichlorodiphenyldichloroethylene"><span data-mw-comment-start="" id="c-Fvasconcellos-2009-02-09T23:42:00.000Z-401–500"></span>Dichlorodiphenyldichloroethylene</a>: short-form chembox</li> <li><a href="/wiki/Trypan_blue" title="Trypan blue">Trypan blue</a>: Structure diagram shows free acid whereas CASRN is for tetrasodium salt</li> <li><a href="/wiki/Isoleucine" title="Isoleucine">Isoleucine</a>: The structure diagram does not specify the stereochemistry at the two chiral centres (should be 2<i>S</i>,3<i>S</i>)</li> <li><a href="/wiki/Ethambutol" title="Ethambutol">Ethambutol</a>: The structure diagram does not specify the stereochemistry at the two chiral centres (should be 2<i>S</i>,2'<i>S</i>) <ul><li>Done. <a href="/wiki/User:Fvasconcellos" title="User:Fvasconcellos">Fvasconcellos</a><small> (<a href="/wiki/User_talk:Fvasconcellos" title="User talk:Fvasconcellos">t</a>·<a href="/wiki/Special:Contributions/Fvasconcellos" title="Special:Contributions/Fvasconcellos">c</a>)</small> <a href="https://en.wikipedia.org/wiki/Wikipedia:WikiProject_Chemicals/Chembox_validation#c-Fvasconcellos-2009-02-09T23:42:00.000Z-401–500" class="ext-discussiontools-init-timestamplink">23:42, 9 February 2009 (UTC)</a><span class="ext-discussiontools-init-replylink-buttons" data-mw-thread-id="c-Fvasconcellos-2009-02-09T23:42:00.000Z-401–500"><span class="ext-discussiontools-init-replylink-bracket">[</span><a class="ext-discussiontools-init-replylink-reply" role="button" tabindex="0" href="">reply</a><span class="ext-discussiontools-init-replylink-bracket">]</span><!--__DTELLIPSISBUTTON__{"threadItem":{"timestamp":"2009-02-09T23:42:00.000Z","author":"Fvasconcellos","type":"comment","level":2,"id":"c-Fvasconcellos-2009-02-09T23:42:00.000Z-401\u2013500","replies":[]}}--></span><span data-mw-comment-end="c-Fvasconcellos-2009-02-09T23:42:00.000Z-401–500"></span></li></ul></li> <li><a href="/wiki/Arginine" title="Arginine">Arginine</a>: Structure needs to show stereochemistry</li> <li><a href="/wiki/Ethylene" title="Ethylene">Ethylene</a>: old-style chembox</li> <li>Missing articles: <a href="/wiki/3,5-Dimethylpyrazole" title="3,5-Dimethylpyrazole">3,5-Dimethylpyrazole</a>, <a href="/w/index.php?title=O-Methylhydroxylamine&amp;action=edit&amp;redlink=1" class="new" title="O-Methylhydroxylamine (page does not exist)">O-Methylhydroxylamine</a>, <a href="/wiki/Tetraethylammonium_iodide" title="Tetraethylammonium iodide">Tetraethylammonium iodide</a>, <a href="/w/index.php?title=Ethyl_3-bromopyruvate&amp;action=edit&amp;redlink=1" class="new" title="Ethyl 3-bromopyruvate (page does not exist)">Ethyl 3-bromopyruvate</a>, <a href="/w/index.php?title=1-Methyl-3-nitro-1-nitrosoguanidine&amp;action=edit&amp;redlink=1" class="new" title="1-Methyl-3-nitro-1-nitrosoguanidine (page does not exist)">1-Methyl-3-nitro-1-nitrosoguanidine</a>, <a href="/wiki/Mercaptosuccinic_acid" class="mw-redirect" title="Mercaptosuccinic acid">Mercaptosuccinic acid</a>, <a href="/w/index.php?title=P-Toluenesulfonamide&amp;action=edit&amp;redlink=1" class="new" title="P-Toluenesulfonamide (page does not exist)">p-Toluenesulfonamide</a>, <a href="/wiki/4-Chlorobenzoic_acid" title="4-Chlorobenzoic acid">4-Chlorobenzoic acid</a>, <a href="/w/index.php?title=N,N%27-Diphenyl-1,4-phenylenediamine&amp;action=edit&amp;redlink=1" class="new" title="N,N'-Diphenyl-1,4-phenylenediamine (page does not exist)">N,N'-Diphenyl-1,4-phenylenediamine</a></li> <li>Ions: <a href="/wiki/Acetate" title="Acetate">Acetate</a>, <a href="/wiki/Bicarbonate" title="Bicarbonate">Bicarbonate</a></li></ul> <div class="mw-heading mw-heading3"><h3 id="501–600" data-mw-thread-id="h-501–600-Problems_found_when_validating_the_Excel_file"><span id="501.E2.80.93600"></span><span data-mw-comment-start="" id="h-501–600-Problems_found_when_validating_the_Excel_file"></span>501–600<span data-mw-comment-end="h-501–600-Problems_found_when_validating_the_Excel_file"></span></h3></div> <ul><li><a href="/wiki/Trimethylaluminium" title="Trimethylaluminium">Trimethylaluminium</a> is dimer, CAS is monomer. Is this significant, will CAS have a dimer listed?</li> <li><a href="/wiki/Camphor" title="Camphor">Camphor</a> Both the WP page and the CAS are for unspecified stereoisomers however if we follow the naturally occurring rule, should the WP page be changed for the natural isomer and the unspecified CAS be relegated to an 'other'?</li></ul> <div class="mw-heading mw-heading3"><h3 id="601–700" data-mw-thread-id="h-601–700-Problems_found_when_validating_the_Excel_file"><span id="601.E2.80.93700"></span><span data-mw-comment-start="" id="h-601–700-Problems_found_when_validating_the_Excel_file"></span>601–700<span data-mw-comment-end="h-601–700-Problems_found_when_validating_the_Excel_file"></span></h3></div> <ul><li><a href="/wiki/Aprobarbital" title="Aprobarbital">Aprobarbital</a> CAS 77-02-1 is unspecified.</li> <li><s><a href="/wiki/2,3-Dimethylbutane" title="2,3-Dimethylbutane">2,3-Dimethylbutane</a> redirects to <a href="/wiki/Dimethylbutane" title="Dimethylbutane">Dimethylbutane</a> only 2,2 has an article.</s> Generic name is now DAB, both 2,2 and 2,3 have articles.</li></ul> <div class="mw-heading mw-heading3"><h3 id="701–800" data-mw-thread-id="h-701–800-Problems_found_when_validating_the_Excel_file"><span id="701.E2.80.93800"></span><span data-mw-comment-start="" id="h-701–800-Problems_found_when_validating_the_Excel_file"></span>701–800<span data-mw-comment-end="h-701–800-Problems_found_when_validating_the_Excel_file"></span></h3></div> <div class="mw-heading mw-heading3"><h3 id="801–900" data-mw-thread-id="h-801–900-Problems_found_when_validating_the_Excel_file"><span id="801.E2.80.93900"></span><span data-mw-comment-start="" id="h-801–900-Problems_found_when_validating_the_Excel_file"></span>801–900<span data-mw-comment-end="h-801–900-Problems_found_when_validating_the_Excel_file"></span></h3></div> <div class="mw-heading mw-heading3"><h3 id="901–1000" data-mw-thread-id="h-901–1000-Problems_found_when_validating_the_Excel_file"><span id="901.E2.80.931000"></span><span data-mw-comment-start="" id="h-901–1000-Problems_found_when_validating_the_Excel_file"></span>901–1000<span data-mw-comment-end="h-901–1000-Problems_found_when_validating_the_Excel_file"></span></h3></div> <div class="mw-heading mw-heading3"><h3 id="Inorganics" data-mw-thread-id="h-Inorganics-Problems_found_when_validating_the_Excel_file"><span data-mw-comment-start="" id="h-Inorganics-Problems_found_when_validating_the_Excel_file"></span>Inorganics<span data-mw-comment-end="h-Inorganics-Problems_found_when_validating_the_Excel_file"></span></h3></div> <p>The 677 "inorganics" (neutral compounds without C–C or C–H bonds) have now all been checked. 496 entries gave a perfect match, 74 entries had some sort of problem in the article (often minor and already fixed) and 100 entries had no appropriate corresponding article on Wikipedia. A full report will be available in due course. </p> <div class="mw-heading mw-heading3"><h3 id="Elements_and_ions" data-mw-thread-id="h-Elements_and_ions-Problems_found_when_validating_the_Excel_file"><span data-mw-comment-start="" id="h-Elements_and_ions-Problems_found_when_validating_the_Excel_file"></span>Elements and ions<span data-mw-comment-end="h-Elements_and_ions-Problems_found_when_validating_the_Excel_file"></span></h3></div> <p>These will require special treatment: please contact <a href="/wiki/User:Physchim62" title="User:Physchim62">Physchim62</a> for more details. </p> <div class="mw-references-wrap"><ol class="references"> <li id="cite_note-CAS_dot_org-1"><span class="mw-cite-backlink">^ <a href="#cite_ref-CAS_dot_org_1-0"><sup><i><b>a</b></i></sup></a> <a href="#cite_ref-CAS_dot_org_1-1"><sup><i><b>b</b></i></sup></a></span> <span class="reference-text"> See [the explanation about the term "CAS Registry Number" on the main page of] <style data-mw-deduplicate="TemplateStyles:r1238218222">.mw-parser-output cite.citation{font-style:inherit;word-wrap:break-word}.mw-parser-output .citation q{quotes:"\"""\"""'""'"}.mw-parser-output .citation:target{background-color:rgba(0,127,255,0.133)}.mw-parser-output .id-lock-free.id-lock-free a{background:url("//upload.wikimedia.org/wikipedia/commons/6/65/Lock-green.svg")right 0.1em center/9px no-repeat}.mw-parser-output .id-lock-limited.id-lock-limited a,.mw-parser-output .id-lock-registration.id-lock-registration a{background:url("//upload.wikimedia.org/wikipedia/commons/d/d6/Lock-gray-alt-2.svg")right 0.1em center/9px no-repeat}.mw-parser-output .id-lock-subscription.id-lock-subscription a{background:url("//upload.wikimedia.org/wikipedia/commons/a/aa/Lock-red-alt-2.svg")right 0.1em center/9px no-repeat}.mw-parser-output .cs1-ws-icon a{background:url("//upload.wikimedia.org/wikipedia/commons/4/4c/Wikisource-logo.svg")right 0.1em center/12px no-repeat}body:not(.skin-timeless):not(.skin-minerva) .mw-parser-output .id-lock-free a,body:not(.skin-timeless):not(.skin-minerva) .mw-parser-output .id-lock-limited a,body:not(.skin-timeless):not(.skin-minerva) .mw-parser-output .id-lock-registration a,body:not(.skin-timeless):not(.skin-minerva) .mw-parser-output .id-lock-subscription a,body:not(.skin-timeless):not(.skin-minerva) .mw-parser-output .cs1-ws-icon a{background-size:contain;padding:0 1em 0 0}.mw-parser-output .cs1-code{color:inherit;background:inherit;border:none;padding:inherit}.mw-parser-output .cs1-hidden-error{display:none;color:var(--color-error,#d33)}.mw-parser-output .cs1-visible-error{color:var(--color-error,#d33)}.mw-parser-output .cs1-maint{display:none;color:#085;margin-left:0.3em}.mw-parser-output .cs1-kern-left{padding-left:0.2em}.mw-parser-output .cs1-kern-right{padding-right:0.2em}.mw-parser-output .citation .mw-selflink{font-weight:inherit}@media screen{.mw-parser-output .cs1-format{font-size:95%}html.skin-theme-clientpref-night .mw-parser-output .cs1-maint{color:#18911f}}@media screen and (prefers-color-scheme:dark){html.skin-theme-clientpref-os .mw-parser-output .cs1-maint{color:#18911f}}</style><cite class="citation web cs1"><a rel="nofollow" class="external text" href="https://commonchemistry.cas.org/">"The "Common Chemistry" website"</a>. published by: the <a href="/wiki/Chemical_Abstracts_Service" title="Chemical Abstracts Service">Chemical Abstracts Service</a> (CAS) of the <a href="/wiki/American_Chemical_Society" title="American Chemical Society">ACS</a>.</cite><span title="ctx_ver=Z39.88-2004&amp;rft_val_fmt=info%3Aofi%2Ffmt%3Akev%3Amtx%3Abook&amp;rft.genre=unknown&amp;rft.btitle=The+%22Common+Chemistry%22+website&amp;rft.pub=published+by%3A+the+Chemical+Abstracts+Service+%28CAS%29+of+the+ACS&amp;rft_id=https%3A%2F%2Fcommonchemistry.cas.org%2F&amp;rfr_id=info%3Asid%2Fen.wikipedia.org%3AWikipedia%3AWikiProject+Chemicals%2FChembox+validation" 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