{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,5,14]],"date-time":"2025-05-14T00:54:46Z","timestamp":1747184086084,"version":"3.40.5"},"reference-count":17,"publisher":"Wiley","issue":"1","license":[{"start":{"date-parts":[[2023,11,8]],"date-time":"2023-11-08T00:00:00Z","timestamp":1699401600000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/creativecommons.org\/licenses\/by-nc\/4.0\/"}],"content-domain":{"domain":["onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Contact Dermatitis"],"published-print":{"date-parts":[[2024,1]]},"abstract":"Abstract<\/jats:title>Background<\/jats:title>Several methyl esters of sulphonic acids are listed in murine local lymph node assay (LLNA) databases, with dose\u2013response data and EC3 values. However, some of these entries are questionable\u2014in one case the chemical tested is not the chemical named in the databases and in others the EC3 value has been derived by extrapolation from data that do not meet the applicability criteria for the approved extrapolation method.<\/jats:p><\/jats:sec>Objectives<\/jats:title>To consider how LLNA data came to be attributed to the wrong chemical and to address the inappropriate extrapolated EC3 values.<\/jats:p><\/jats:sec>Methods<\/jats:title>Dose\u2013response data for methyl hexadec\u20103\u2010enesulphonate (wrongly named as methyl hexadec\u20101\u2010enesulphonate), two other methyl sulphonates and hexadec\u20101\u2010ene\u20101,3\u2010sultone are re\u2010evaluated using the single dose probit extrapolation method (SDPEM). The different reaction chemistry profiles of methyl hexadec\u20103\u2010enesulphonate and methyl hexadec\u20101\u2010enesulphonate are discussed.<\/jats:p><\/jats:sec>Results<\/jats:title>Extrapolated EC3 values for hexadec\u20101\u2010ene\u20101,3\u2010sultone are the same by both methods but for the methyl sulphonates the differences are substantial.<\/jats:p><\/jats:sec>Conclusions<\/jats:title>Current databases should be corrected and further analysed to identify other cases where EC3 values are likely to be unreliable due to inappropriate estimation by extrapolation.<\/jats:p><\/jats:sec>","DOI":"10.1111\/cod.14455","type":"journal-article","created":{"date-parts":[[2023,11,8]],"date-time":"2023-11-08T11:34:03Z","timestamp":1699443243000},"page":"84-88","update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":0,"title":["Skin sensitization data for methyl esters of sulphonic acids\u2014Corrections to published databases required"],"prefix":"10.1111","volume":"90","author":[{"ORCID":"https:\/\/orcid.org\/0000-0001-6112-5868","authenticated-orcid":false,"given":"David W.","family":"Roberts","sequence":"first","affiliation":[{"name":"School of Pharmacy and Biomolecular Sciences Liverpool John Moores University Liverpool UK"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"311","published-online":{"date-parts":[[2023,11,8]]},"reference":[{"key":"e_1_2_9_2_1","doi-asserted-by":"publisher","DOI":"10.1111\/cod.12167"},{"key":"e_1_2_9_3_1","doi-asserted-by":"publisher","DOI":"10.2310\/6620.2005.05040"},{"key":"e_1_2_9_4_1","doi-asserted-by":"publisher","DOI":"10.1080\/10408444.2018.1429385"},{"key":"e_1_2_9_5_1","doi-asserted-by":"publisher","DOI":"10.1021\/op9700439"},{"key":"e_1_2_9_6_1","doi-asserted-by":"publisher","DOI":"10.1016\/0300-483X(95)03132-Y"},{"key":"e_1_2_9_7_1","doi-asserted-by":"publisher","DOI":"10.1111\/j.1600-0536.1988.tb02807.x"},{"key":"e_1_2_9_8_1","doi-asserted-by":"publisher","DOI":"10.1111\/j.1467-2494.1990.tb00523.x"},{"key":"e_1_2_9_9_1","doi-asserted-by":"publisher","DOI":"10.1080\/15569520701212258"},{"key":"e_1_2_9_10_1","doi-asserted-by":"publisher","DOI":"10.1080\/10408444.2021.2020212"},{"key":"e_1_2_9_11_1","doi-asserted-by":"publisher","DOI":"10.1002\/jat.1289"},{"key":"e_1_2_9_12_1","doi-asserted-by":"publisher","DOI":"10.1002\/anie.196503001"},{"key":"e_1_2_9_13_1","unstructured":"OECD.Series on testing and assessment No. 336. Annex 3: report of the sub\u2010group on the curation and evaluation of the local lymph node assay reference data and the derivation of associated substance classifications according to the UN GHS. ENV\/CBC\/MONO(2021)11\/ANN3; 2021."},{"key":"e_1_2_9_14_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.yrtph.2015.01.009"},{"key":"e_1_2_9_15_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.crtox.2021.01.004"},{"key":"e_1_2_9_16_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.yrtph.2020.104732"},{"key":"e_1_2_9_17_1","unstructured":"BasketterDA RobertsDW.Unpublished.1997."},{"key":"e_1_2_9_18_1","doi-asserted-by":"publisher","DOI":"10.1021\/tx600330u"}],"container-title":["Contact Dermatitis"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/onlinelibrary.wiley.com\/doi\/pdf\/10.1111\/cod.14455","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,12,28]],"date-time":"2023-12-28T02:11:36Z","timestamp":1703729496000},"score":1,"resource":{"primary":{"URL":"https:\/\/onlinelibrary.wiley.com\/doi\/10.1111\/cod.14455"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023,11,8]]},"references-count":17,"journal-issue":{"issue":"1","published-print":{"date-parts":[[2024,1]]}},"alternative-id":["10.1111\/cod.14455"],"URL":"https:\/\/doi.org\/10.1111\/cod.14455","archive":["Portico"],"relation":{},"ISSN":["0105-1873","1600-0536"],"issn-type":[{"type":"print","value":"0105-1873"},{"type":"electronic","value":"1600-0536"}],"subject":[],"published":{"date-parts":[[2023,11,8]]},"assertion":[{"value":"2023-09-20","order":0,"name":"received","label":"Received","group":{"name":"publication_history","label":"Publication History"}},{"value":"2023-10-23","order":1,"name":"accepted","label":"Accepted","group":{"name":"publication_history","label":"Publication History"}},{"value":"2023-11-08","order":2,"name":"published","label":"Published","group":{"name":"publication_history","label":"Publication History"}}]}}