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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:aminocyclopyrachlor-triethylammonium
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Accession:CHEBI:193129 term browser browse the term
Definition:The triethylammonium salt of aminocyclopyrachlor.
Synonyms:exact_synonym: N,N-diethylethanaminium 6-amino-5-chloro-2-cyclopropylpyrimidine-4-carboxylate
 related_synonym: 6-amino-5-chloro-2-cyclopropyl-4-pyrimidinecarboxylic acid compound with N,N-diethylethanamine (1:1);   6-amino-5-chloro-2-cyclopropylpyrimidine-4-carboxylic acid - triethylamine (1:1);   6-amino-5-chloro-2-cyclopropylpyrimidine-4-carboxylic acid--N,N-diethylethan-1-amine (1/1);   6-amino-5-chloro-2-cyclopropylpyrimidine-4-carboxylic acid-N,N-diethylethanamine (1/1);   Formula=C8H7ClN3O2.C6H16N;   InChI=1S/C8H8ClN3O2.C6H15N/c9-4-5(8(13)14)11-7(3-1-2-3)12-6(4)10;1-4-7(5-2)6-3/h3H,1-2H2,(H,13,14)(H2,10,11,12);4-6H2,1-3H3;   InChIKey=OPXYSCVSOMBXJI-UHFFFAOYSA-N;   SMILES=CC[NH+](CC)CC.NC1=C(Cl)C(=NC(=N1)C1CC1)C([O-])=O;   triethylammonium 6-amino-5-chloro-2-cyclopropylpyrimidine-4-carboxylate
 xref: CAS:858956-32-8;   PPDB:3392;   Pesticides:/derivatives/aminocyclopyrachlor-triethylammonium;   Reaxys:11429238

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  CHEBI ontology 0
    role 0
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        pesticide 0
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            aminocyclopyrachlor-triethylammonium 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
                                      ammonium compound 0
                                        organoammonium salt 0
                                          aminocyclopyrachlor-triethylammonium 0
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