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ONTOLOGY REPORT - ANNOTATIONS


Term:MT-2153
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Accession:CHEBI:145514 term browser browse the term
Definition:A benzoylpyrazole that is 1H-pyrazole substituted by an ethyl, 3-(2-methoxyethoxy)-2-methyl-4-(methylsulfonyl)benzoyl, and a hydroxy group at positions 1, 4 and 5, respectively. It is the active metabolite of the proherbicide, tolpyralate.
Synonyms:exact_synonym: (1-ethyl-5-hydroxy-1H-pyrazol-4-yl)[3-(2-methoxyethoxy)-2-methyl-4-(methylsulfonyl)phenyl]methanone
 related_synonym: (1-ethyl-5-hydroxypyrazol-4-yl)[4-mesyl-3-(2-methoxyethoxy)-2-methylphenyl]mthanone;   Formula=C17H22N2O6S;   InChI=1S/C17H22N2O6S/c1-5-19-17(21)13(10-18-19)15(20)12-6-7-14(26(4,22)23)16(11(12)2)25-9-8-24-3/h6-7,10,21H,5,8-9H2,1-4H3;   InChIKey=AOWROGWEYJVWCJ-UHFFFAOYSA-N;   SMILES=C=1C(=C(C(=C(C1)C(=O)C=2C=NN(C2O)CC)C)OCCOC)S(C)(=O)=O
 xref: PMID:26725441 "Europe PMC"


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  CHEBI ontology 834
    role 811
      application 441
        pesticide 101
          herbicide 51
            MT-2153 0
              tolpyralate 0
Path 2
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  CHEBI ontology 834
    subatomic particle 818
      composite particle 818
        hadron 818
          baryon 818
            nucleon 818
              atomic nucleus 818
                atom 818
                  main group element atom 806
                    p-block element atom 803
                      carbon group element atom 774
                        carbon atom 770
                          organic molecular entity 770
                            organic molecule 687
                              organic cyclic compound 612
                                organic heterocyclic compound 325
                                  heteroarene 88
                                    monocyclic heteroarene 20
                                      azole 20
                                        diazole 13
                                          pyrazoles 3
                                            benzoylpyrazole 0
                                              MT-2153 0
                                                tolpyralate 0
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