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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:atrazine
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Accession:CHEBI:15930 term browser browse the term
Definition:A diamino-1,3,5-triazine that is 1,3,5-triazine-2,4-diamine substituted by a chloro group at position 6 while one of hydrogens of each amino group is replaced respectively by an ethyl and a propan-2-yl group.
Synonyms:exact_synonym: 6-chloro-N-ethyl-N'-(propan-2-yl)-1,3,5-triazine-2,4-diamine
 related_synonym: 2-CHLORO-4-ISOPROPYLAMINO-6-ETHYLAMINO-1,3,5-TRIAZINE;   2-ethylamino-4-isopropylamino-6-chloro-s-triazine;   6-chloro-N-ethyl-N'-(1-methylethyl)-1,3,5-triazine-2,4-diamine;   6-chloro-N-ethyl-N'-isopropyl-1,3,5-triazine-2,4-diamine;   Formula=C8H14ClN5;   InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14);   InChIKey=MXWJVTOOROXGIU-UHFFFAOYSA-N;   SMILES=CCNc1nc(Cl)nc(NC(C)C)n1
 alt_id: CHEBI:13865;   CHEBI:22672;   CHEBI:2916;   CHEBI:49479
 xref: Beilstein:612020;   CAS:1912-24-9;   DrugBank:DB07392;   HMDB:HMDB0041830;   KEGG:C06551;   LINCS:LSM-18990
 xref_mesh: MESH:D001280
 xref: MetaCyc:ATRAZINE;   PDBeChem:ATZ;   PMID:24211529;   PMID:24239819;   PMID:24246238;   PPDB:43;   Reaxys:612020;   UM-BBD_compID:c0002;   Wikipedia:Atrazine


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    Path 1
    Term Annotations click to browse term
      CHEBI ontology 19932
        role 19904
          biological role 19902
            xenobiotic 18763
              atrazine 5096
                4-ethylamino-6-isopropylamino-1,3,5-triazin-2-ol 0
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 19932
        subatomic particle 19930
          composite particle 19930
            hadron 19930
              baryon 19930
                nucleon 19930
                  atomic nucleus 19930
                    atom 19930
                      main group element atom 19876
                        main group molecular entity 19876
                          s-block molecular entity 19705
                            hydrogen molecular entity 19686
                              hydrides 19179
                                inorganic hydride 18191
                                  pnictogen hydride 18181
                                    nitrogen hydride 18092
                                      azane 17895
                                        ammonia 17894
                                          organic amino compound 17894
                                            polyamine 9032
                                              diamine 8967
                                                diamino-1,3,5-triazine 5113
                                                  1,3,5-triazine-2,4-diamine 5096
                                                    6-chloro-1,3,5-triazine-2,4-diamine 5096
                                                      atrazine 5096
                                                        4-ethylamino-6-isopropylamino-1,3,5-triazin-2-ol 0
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