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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:thiocyclam oxalate
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Accession:CHEBI:133553 term browser browse the term
Definition:An oxalate salt resulting from the formal reaction of equimolar amounts of thiocyclam and oxalic acid. A nicotinic acetylcholine receptor agonist, it was used as a broad-spectrum insecticide. It is not approved for use within the European Union.
Synonyms:exact_synonym: N,N-dimethyl-1,2,3-trithian-5-aminium hydrogen oxalate
 related_synonym: 5-dimethylamino-1,2,3-trithiane hydrogen oxalate;   Evisect;   Evisekt;   Formula=C7H13NO4S3;   InChI=1S/C5H11NS3.C2H2O4/c1-6(2)5-3-7-9-8-4-5;3-1(4)2(5)6/h5H,3-4H2,1-2H3;(H,3,4)(H,5,6);   InChIKey=ICTQUFQQEYSGGJ-UHFFFAOYSA-N;   N,N-dimethyl-1,2,3-trithian-5-amine ethanedioate (1:1);   N,N-dimethyl-1,2,3-trithian-5-amine hydrogenoxalate;   N,N-dimethyl-1,2,3-trithian-5-ylamine oxalate (1:1);   N,N-dimethyl-1,2,3-trithian-5-ylammonium hydrogen oxalate;   SMILES=S1SSCC(C1)N(C)C.C(C(=O)O)(=O)O;   oxalic acid--N,N-dimethyl-1,2,3-trithian-5-amine (1/1);   thiocyclam hydrogen oxalate
 xref: CAS:31895-22-4;   PPDB:753;   Pesticides:derivatives/thiocyclam%20oxalate

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  CHEBI ontology 0
    role 0
      application 0
        agrochemical 0
          thiocyclam oxalate 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    main group molecular entity 0
                      s-block molecular entity 0
                        hydrogen molecular entity 0
                          hydrides 0
                            inorganic hydride 0
                              pnictogen hydride 0
                                nitrogen hydride 0
                                  ammonium 0
                                    ammonium ion derivative 0
                                      thiocyclam(1+) 0
                                        thiocyclam oxalate 0
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