S69 | LUXPEST | Pesticide Screening List for Luxembourg

This is the collection associated with list S69 LUXPEST Pesticide Screening List for Luxembourg on the NORMAN Suspect List Exchange. https://www.norman-network.com/nds/SLE/ A pesticide screening list for Luxembourg, compiled from multiple sources by Jessy Krier, uni.lu. Dataset DOI: 10.5281/zenodo.3862688. NOTE: the presence of pesticides on this list means that they are potentially relevant for Luxembourg and surrounding regions, but does not imply that they have been detected in Luxembourg. This list has been compiled to enable the efficient screening of data using the background knowledge contained within this list. The sources used were: Classification links &amp; Authorization in Luxembourg https://ec.europa.eu/food/plant/pesticides/eu-pesticides-database/public/?event=activesubstance.selection&amp;language=EN https://sitem.herts.ac.uk/aeru/bpdb/search.htm https://sitem.herts.ac.uk/aeru/ppdb/en/search.htm<br> <br> Origin: ASTA: https://saturn.etat.lu/tapes/tapes_de_lst_pdt.jsp?sel=_ SWISSPEST16: https://comptox.epa.gov/dashboard/chemical_lists/swisspest Structure mapping: CompTox Batch Search with CID mapping via PubChem; InChIs were generated from SMILES by OpenBabel. MS_READY SMILES were used for mass spectral screening; parent forms were used for structural information and to map classification content.<br>本数据集关联NORMAN可疑名录交换平台（NORMAN Suspect List Exchange）上的S69 LUXPEST卢森堡农药筛查名录（list S69 LUXPEST Pesticide Screening List for Luxembourg），相关平台网址为：https://www.norman-network.com/nds/SLE/。 该名录为卢森堡专属农药筛查名录，由来自卢森堡大学（uni.lu）的Jessy Krier整合多源数据编制而成。数据集数字对象标识符（DOI）：10.5281/zenodo.3862688。 注：本名录收录的农药仅表明其与卢森堡及周边区域存在潜在相关性，并不代表已在卢森堡境内检出。编制该名录的初衷是依托内置的背景知识，实现筛查数据的高效处理。 本次编制所用数据源如下： 1. 卢森堡境内农药分类与授权相关信息： - 欧盟农药数据库：https://ec.europa.eu/food/plant/pesticides/eu-pesticides-database/public/?event=activesubstance.selection&language=EN - 英国赫特福德大学航空与环境研究中心（AERU）农药数据库（BPDB）：https://sitem.herts.ac.uk/aeru/bpdb/search.htm - 英国赫特福德大学航空与环境研究中心植保产品数据库（PPDB）：https://sitem.herts.ac.uk/aeru/ppdb/en/search.htm 额外数据来源： - ASTA：https://saturn.etat.lu/tapes/tapes_de_lst_pdt.jsp?sel=_ - SWISSPEST16：https://comptox.epa.gov/dashboard/chemical_lists/swisspest 结构映射方式说明：通过PubChem的CID编号完成映射，基于CompTox进行批量检索；借助OpenBabel将简化分子线性输入规范（SMILES）字符串转换为国际化学标识符（InChI）。质谱筛查采用适用于质谱分析的SMILES（MS_READY SMILES），结构信息与分类内容的映射则基于农药母核结构完成。