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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:diuron
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Accession:CHEBI:116509 term browser browse the term
Definition:A member of the class of 3-(3,4-substituted-phenyl)-1,1-dimethylureas that is urea in which both of the hydrogens attached to one nitrogen are substituted by methyl groups, and one of the hydrogens attached to the other nitrogen is substituted by a 3,4-dichlorophenyl group.
Synonyms:exact_synonym: 3-(3,4-dichlorophenyl)-1,1-dimethylurea
 related_synonym: 1,1-dimethyl-3-(3,4-dichlorophenyl)urea;   1-(3,4-dichlorophenyl)-3,3-dimethylurea;   1-(3,4-dichlorophenyl)-3,3-dimethyluree;   3-(3,4-Dichlor-phenyl)-1,1-dimethyl-harnstoff;   3-(3,4-Dichloro-phenyl)-1,1-dimethyl-urea;   DCMU;   Formula=C9H10Cl2N2O;   InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14);   InChIKey=XMTQQYYKAHVGBJ-UHFFFAOYSA-N;   N'-(3,4-dichlorophenyl)-N,N-dimethylurea;   N,N,-dimethyl-N'-(3,4-dichlorophenyl)urea;   SMILES=CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1
 xref: CAS:330-54-1;   KEGG:C18428;   LINCS:LSM-25609
 xref_mesh: MESH:D004237
 xref: MetaCyc:CPD-16775;   PMID:10866370;   PMID:17142046;   PMID:17449247;   PMID:23081760;   PMID:33400299;   PPDB:260;   Patent:CN103120180;   Patent:CN103125511;   Patent:US2768971;   Pesticides:diuron;   Reaxys:2215168;   Wikipedia:Diuron


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      CHEBI ontology 19890
        role 19839
          biological role 19858
            xenobiotic 18739
              diuron 2263
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      CHEBI ontology 19890
        subatomic particle 19867
          composite particle 19888
            hadron 19888
              baryon 19888
                nucleon 19867
                  atomic nucleus 19888
                    atom 19888
                      main group element atom 19806
                        p-block element atom 19806
                          carbon group element atom 19746
                            carbon atom 19743
                              organic molecular entity 19743
                                heteroorganic entity 19502
                                  organochalcogen compound 19264
                                    organooxygen compound 19180
                                      carbon oxoacid 18666
                                        carboxylic acid 18663
                                          carboacyl group 17715
                                            univalent carboacyl group 17690
                                              carbamoyl group 17566
                                                carboxamide 17566
                                                  monocarboxylic acid amide 15721
                                                    urea 6221
                                                      ureas 6219
                                                        phenylureas 2618
                                                          3-(3,4-substituted-phenyl)-1,1-dimethylurea 2273
                                                            diuron 2263
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