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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 22205
        role 22190
          biological role 22189
            xenobiotic 19696
              atrazine 5020
                4-ethylamino-6-isopropylamino-1,3,5-triazin-2-ol 0
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 22205
        subatomic particle 22197
          composite particle 22197
            hadron 22197
              baryon 22197
                nucleon 22169
                  atomic nucleus 22197
                    atom 22197
                      main group element atom 22131
                        main group molecular entity 22131
                          s-block molecular entity 21729
                            hydrogen molecular entity 21646
                              hydrides 20783
                                inorganic hydride 18707
                                  pnictogen hydride 18687
                                    nitrogen hydride 18556
                                      azane 18461
                                        ammonia 18426
                                          organic amino compound 18460
                                            polyamine 8961
                                              diamine 8901
                                                diamino-1,3,5-triazine 5037
                                                  1,3,5-triazine-2,4-diamine 5020
                                                    6-chloro-1,3,5-triazine-2,4-diamine 5020
                                                      atrazine 5020
                                                        4-ethylamino-6-isopropylamino-1,3,5-triazin-2-ol 0
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