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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:oryzalin
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Accession:CHEBI:73163 term browser browse the term
Definition:A sulfonamide that is benzenesulfonamide substituted at positions 3 and 5 by nitro groups and at position 4 by a dipropylamino group.
Synonyms:exact_synonym: 4-(dipropylamino)-3,5-dinitrobenzenesulfonamide
 related_synonym: 3,5-Dinitro-N4,N4-dipropylsulphanilamide;   3,5-dinitro-N(4),N(4)-dipropylsulfanilamide;   4-(dipropylamino)-3,5-dinitrobenzene-1-sulfonamide;   Formula=C12H18N4O6S;   InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22);   InChIKey=UNAHYJYOSSSJHH-UHFFFAOYSA-N;   SMILES=CCCN(CCC)c1c(cc(cc1[N+]([O-])=O)S(N)(=O)=O)[N+]([O-])=O
 xref: CAS:19044-88-3;   KEGG:C18877
 xref_mesh: MESH:C012465
 xref: PMID:20405146;   PMID:20870876;   PMID:21983568;   PMID:22771930;   PMID:23261650;   PPDB:494;   Patent:US2012108430;   Pesticides:19044-88-3;   Reaxys:2177305;   Wikipedia:Oryzalin


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  CHEBI ontology 0
    role 0
      application 0
        agrochemical 0
          oryzalin 0
Path 2
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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
                                  azane 0
                                    ammonia 0
                                      organic amino compound 0
                                        aromatic amine 0
                                          oryzalin 0
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