reteplayground
Select

Molecules with their structure

NameFormulaSmiles
(rac)-2-([2.2]paracyclophan-4…C24H21Nc1ccc2c(c1)[nH]c(c2)c…
11,11'-(2,5-dimethyl-1,4-phen…C108H82N8Cc1cc(c(cc1c1ccc2c(c1…
3-(3-hydroxypropyl)-4-(3-meth…C17H15F3O4COCC#Cc1c(CCCO)oc(=O)…
4-(2-azidophenyl)-1-methylpyr…C12H11ClN4[N-]=[N+]=Nc1ccccc1c1…
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The query

PREFIX rdfs: <http://www.w3.org/2000/01/rdf-schema#> PREFIX obo: <http://purl.obolibrary.org/obo/> PREFIX chebi: <http://purl.obolibrary.org/obo/chebi/> SELECT ?name ?formula ?smiles WHERE { ?m a obo:CHEBI_23367 ; rdfs:label ?name ; chebi:formula ?formula ; chebi:smiles ?smiles } LIMIT 200

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