Updated S108 mappings

deposition/NORMAN_SLE_classification.txt

@@ -107,7 +107,7 @@ https://zenodo.org/records/7802120/files/S104_UKVETMED_InChIKey.txt	S104 | UKVET
 https://zenodo.org/records/7808219/files/S105_P65CHEM_InChiKEY.txt	S105 | P65CHEM | Californian Proposition 65 warning list of chemicals	"A list of chemicals known to cause cancer, birth defects or reproductive toxicity published by the California Environmental Protection Agency (CalEPA)'s Office of Environmental Health Hazard Assessment (OEHHA) on their Proposition 65 warnings website (http://www.p65warnings.ca.gov/) to provide the public with information on associated chemicals, products and places. This annually revised and republished list aims to enable Californians to make informed decisions about their exposures to these chemicals and prohibit Californian businesses from knowingly discharging significant amounts of them into sources of drinking water. Dataset DOI: https://doi.org/10.5281/zenodo.7808218"	https://doi.org/10.5281/zenodo.7808218	Reg|Prio|Use	yes	med	
 https://zenodo.org/records/8101975/files/S106_AQUALITY19_InChIKey.txt	S106 | AQUAlity19 | EU AQUAlity's water analysis list 2019	"List of compounds found in surface and wastewater sampling and analysis by LC-HRMS (Orbitrap) within the European project AQUAlity in 2019. AQUAlity (http://https//www.aquality-etn.eu/) is a project funded by the European Union under the Marie Sklodowska-Curie Actions (MSCA) - Innovative Training Networks (Call: H2020-MSCA-ITN-2017) Project N. 765860. The list was kindly provided by Azziz Assoumani (INERIS, France). Dataset DOI: 10.5281/zenodo.8101974"	https://doi.org/10.5281/zenodo.8101974	Water	no	med	
 https://zenodo.org/records/8102040/files/S107_AQUALITY20_InChIkey.txt	S107 | AQUAlity20 | EU AQUAlity's water analysis list 2020	"List of compounds found in surface and wastewater sampling and analysis by LC-QTOF within the European project AQUAlity in 2020. AQUAlity (http://https//www.aquality-etn.eu/) is a project funded by the European Union under the Marie Sklodowska-Curie Actions (MSCA) - Innovative Training Networks (Call: H2020-MSCA-ITN-2017) Project N. 765860. The list was kindly provided by Azziz Assoumani (INERIS, France). Dataset DOI: 10.5281/zenodo.8102039"	https://doi.org/10.5281/zenodo.8102039	Water	no	med	
-https://zenodo.org/records/8109044/files/S108_SINLIST_InChiKey.txt	S108 | SINLIST | SIN (Substitute It Now) list of hazardous chemicals by ChemSec	"SIN (Substitute It Now) list of hazardous chemicals used in a wide variety of articles, products and manufacturing processes around the globe. The SIN List consists of chemicals that have been identified by the non-profit ChemSec (https://sinlist.chemsec.org/) as being Substances of Very High Concern, based on the criteria defined within REACH, the EU chemicals legislation. The SIN abbreviation - Substitute It Now - implies that these chemicals should be removed as soon as possible as they pose a threat to human health and the environment. The list was kindly provided by Anna Lennquist (ChemSec, Sweden) and Hans Peter Arp  (NGI,NTNU, Norway). Dataset DOI: 10.5281/zenodo.8109043"	https://doi.org/10.5281/zenodo.8109043	Use	yes	med	
+https://zenodo.org/records/11147435/files/S108_SINLIST_InChIKey_2024-05-08.txt	S108 | SINLIST | SIN (Substitute It Now) list of hazardous chemicals by ChemSec	"SIN (Substitute It Now) list of hazardous chemicals used in a wide variety of articles, products and manufacturing processes around the globe. The SIN List consists of chemicals that have been identified by the non-profit ChemSec (https://sinlist.chemsec.org/) as being Substances of Very High Concern, based on the criteria defined within REACH, the EU chemicals legislation. The SIN abbreviation - Substitute It Now - implies that these chemicals should be removed as soon as possible as they pose a threat to human health and the environment. The list was kindly provided by Anna Lennquist (ChemSec, Sweden) and Hans Peter Arp  (NGI,NTNU, Norway). Dataset DOI: 10.5281/zenodo.8109043"	https://doi.org/10.5281/zenodo.8109043	Use	yes	med	
 https://zenodo.org/records/10944199/files/S109_PARCEDC_InChIKeys.txt	S109 | PARCEDC | List of 7074 potential endocrine disrupting compounds (EDCs) by PARC T4.2	"A comprehensive list of 7074 endocrine disruptors compiled by PARC T4.2., integrating assessments by EU and national regulators, contributions from entities like the European Chemicals Agency (ECHA)and complemented by other potential endocrine disruptors (hormones, bisphenols, etc.). The list also includes potentially active endocrine disruptors screened from all substances in the NORMAN SusDat database (https://www.norman-network.com/nds/susdat/) using VEGA (QSAR) EDC prediction models (https://www.vegahub.eu/about-qsar), ToxCast database's in vitro assay data and ToxCast based machine learning predictions. Dataset DOI: 10.5281/zenodo.10944198"	https://doi.org/10.5281/zenodo.10944199	EDC	yes	med	
 https://zenodo.org/records/8406129/files/S110_DUTCHUSE_InChIkey.txt	S110 | DUTCHUSE | Dutch Prioritized Chemical Use Categories	"List of 1700+ compounds with monitoring data and their assigned use categories performed within Dutch prioritization exercise by Ad eco advies and Deltares (NORMAN Working Group 1). The final use category was compiled from several lists, including the Watson database (https://watson-cost.eu/outputs/databases/), RIWA (https://www.riwa-rijn.org/en/), Dutch Substances of Very High Concern (SVHC - https://rvszoeksysteem.rivm.nl/ZZSlijst/TotaleLijst), Kennisimpuls Waterkwalititeit (KIWK), WFD priority and specific pollutants (NL), NORMAN lists and some expert judgement. The 1700 compounds were chosen based on availability of Dutch targeted monitoring data (3 different datasets) in 2022. This list is a translation of the file kindly provided by Anja Derksen, AD eco advies. Dataset DOI: 10.5281/zenodo.8406128"	https://doi.org/10.5281/zenodo.8406128	Use	yes	med	
 https://zenodo.org/records/8417075/files/PMTPFAS_InChIKey.txt	S111 | PMTPFAS | Fluorine-containing Compounds in PMT Suspect Lists	"PMTPFAS is a list of fluorine-containing compounds extracted from existing suspect lists for PMT (persistent, mobile, toxic) compounds, currently S36 UBAPMT, S82 EAWAGPMT and S84 UFZHSFPMT. All entries contain fluorine but are not necessarily PFAS. Two salt entries were replaced with the F-containing parts only. Dataset DOI: 10.5281/zenodo.8417074"	https://doi.org/10.5281/zenodo.8417074	PFAS|PMT	no	low	

deposition/NORMAN_SLE_mappings.txt

@@ -109,7 +109,7 @@ https://zenodo.org/records/7802120/files/S104_UKVETMED.csv	S104_UKVETMED	S104.0.
 https://zenodo.org/records/7808219/files/S105_P65CHEM.csv	S105_P65CHEM	S105.0.1.0	7-Apr-23	10.5281/zenodo.7808218	https://www.norman-network.com/nds/SLE/		SMILES	InChiKey	InChi	Chemical|Preferred_Name			FALSE	
 https://zenodo.org/records/8101975/files/S106_AQUALITY19.csv	S106_AQUALITY19	S106.0.1.1	30-Jun-23	10.5281/zenodo.8101974	https://www.norman-network.com/nds/SLE/		SMILES	INCHIKEY	InChi	Name|Preferred_Name			FALSE	
 https://zenodo.org/records/8102040/files/S107_AQUALITY20.csv	S107_AQUALITY20	S107.0.1.1	30-Jun-23	10.5281/zenodo.8102039	https://www.norman-network.com/nds/SLE/		SMILES	InChIKey	InChI	Name|Preferred_Name			FALSE	
-https://zenodo.org/records/8109044/files/S108_SINLIST.csv	S108_SINLIST	S108.0.1.1	3-Jul-23	10.5281/zenodo.8109043	https://www.norman-network.com/nds/SLE/		SMILES	InChiKey	INCHI	Name|CAS_Number|ES_Number			FALSE	
+https://zenodo.org/records/11147435/files/S108_SINLIST_2024-05-08.csv	S108_SINLIST	S108.0.2.0	8-May-24	10.5281/zenodo.8109043	https://www.norman-network.com/nds/SLE/		SMILES	InChIKey	INCHI	Name|CAS_Number|EC_Number			FALSE	
 https://zenodo.org/records/10944199/files/S109_PARCEDC.csv	S109_PARCEDC	S109.0.1.0	8-Apr-24	10.5281/zenodo.10944198	https://www.norman-network.com/nds/SLE/		SMILES	InChIKey	InChI	Name|Preferred_Name			FALSE	
 https://zenodo.org/records/8406129/files/S110_DUTCHUSE.csv	S110_DUTCHUSE	S110.0.1.0	4-Oct-23	10.5281/zenodo.8406128	https://www.norman-network.com/nds/SLE/		SMILES	InChIKey	InChI	Preferred_Name|Subtance_Name(Dutch)			FALSE	
 https://zenodo.org/records/8417075/files/PMTPFAS.csv	S111_PMTPFAS	S111.0.1.0	7-Oct-23	10.5281/zenodo.8417074	https://www.norman-network.com/nds/SLE/		SMILES	InChIKey	InChI	Name			FALSE