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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:amodiaquine hydrochloride
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Accession:CHEBI:50652 term browser browse the term
Definition:A hydrochloride that has formula C20H22ClN3O.2HCl.2H2O.
Synonyms:exact_synonym: 4-[(7-chloroquinolin-4-yl)amino]-2-[(diethylamino)methyl]phenol dihydrochloride dihydrate
 related_synonym: Amodiaquin dihydrochloride dihydrate;   Flavoquine;   Formula=C20H22ClN3O.2HCl.2H2O;   Formula=C20H28Cl3N3O3;   InChI=1S/C20H22ClN3O.2ClH.2H2O/c1-3-24(4-2)13-14-11-16(6-8-20(14)25)23-18-9-10-22-19-12-15(21)5-7-17(18)19;;;;/h5-12,25H,3-4,13H2,1-2H3,(H,22,23);2*1H;2*1H2;   InChIKey=YVNAYSHNIILOJS-UHFFFAOYSA-N;   SMILES=[H+].[H+].O.O.[Cl-].[Cl-].CCN(CC)Cc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1O
 xref: CAS:6398-98-7;   DrugBank:DB00613;   KEGG:D02466


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19844
    role 19820
      biological role 19818
        antimicrobial agent 18191
          antiviral agent 11079
            anticoronaviral agent 9668
              amodiaquine hydrochloride 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19844
    subatomic particle 19842
      composite particle 19842
        hadron 19842
          baryon 19842
            nucleon 19809
              atomic nucleus 19842
                atom 19842
                  main group element atom 19792
                    main group molecular entity 19792
                      s-block molecular entity 19626
                        hydrogen molecular entity 19613
                          hydrides 19115
                            inorganic hydride 18121
                              pnictogen hydride 18110
                                nitrogen hydride 18017
                                  azane 17823
                                    ammonia 17797
                                      organic amino compound 17822
                                        aromatic amine 15425
                                          aminoquinoline 1736
                                            amodiaquine 44
                                              amodiaquine hydrochloride 0
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