etox_targets
(Package: webchem) :
Get Quality Targets from a ETOX ID
Query ETOX: Information System Ecotoxicology and Environmental Quality Targets https://webetox.uba.de/webETOX/index.do for quality targets
● Data Source:
CranContrib
● Keywords:
● Alias: etox_targets
●
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Convert a InChI to InChiKey
● Data Source:
CranContrib
● Keywords:
● Alias: cs_inchi_inchikey
●
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cs_extcompinfo
(Package: webchem) :
Get extended record details by ChemSpider ID
Get extended info from Chemspider, see http://www.chemspider.com/
● Data Source:
CranContrib
● Keywords:
● Alias: cs_extcompinfo
●
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Convert a InChI to SMILES
● Data Source:
CranContrib
● Keywords:
● Alias: cs_inchi_smiles
●
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aw_query
(Package: webchem) :
Query http://www.alanwood.net/pesticides
Query Alan Woods Compendium of Pesticide Common Names http://www.alanwood.net/pesticides
● Data Source:
CranContrib
● Keywords:
● Alias: aw_query
●
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get_cid
(Package: webchem) :
Retrieve Pubchem Id (CID)
Return CompoundID (CID) for a search query using PUG-REST, see https://pubchem.ncbi.nlm.nih.gov/.
● Data Source:
CranContrib
● Keywords:
● Alias: get_cid
●
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Query ETOX: Information System Ecotoxicology and Environmental Quality Targets https://webetox.uba.de/webETOX/index.do for their substance ID
● Data Source:
CranContrib
● Keywords:
● Alias: get_etoxid
●
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cts_compinfo
(Package: webchem) :
Get record details from Chemical Translation Service (CTS)
Get record details from CTS, see http://cts.fiehnlab.ucdavis.edu
● Data Source:
CranContrib
● Keywords:
● Alias: cts_compinfo
●
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Query the OPSIN (Open Parser for Systematic IUPAC nomenclature) web service http://opsin.ch.cam.ac.uk/instructions.html.
● Data Source:
CranContrib
● Keywords:
● Alias: opsin_query
●
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webchem-defunct
(Package: webchem) :
Defunct function(s) in the webchem package
These functions are defunct and no longer available.
● Data Source:
CranContrib
● Keywords:
● Alias: cir, ppdb, ppdb_query, webchem-defunct
●
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providing 
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