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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:atomoxetine hydrochloride
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Accession:CHEBI:331697 term browser browse the term
Definition:The hydrochloride salt of atomoxetine.
Synonyms:exact_synonym: (3R)-N-methyl-3-(2-methylphenoxy)-3-phenylpropan-1-amine hydrochloride
 related_synonym: (-)-N-Methyl-3-phenyl-3-(o-tolyloxy)propylamine hydrochloride;   (R)-Tomoxetine hydrochloride;   Atomoxetine HCl;   Formula=C17H22ClNO;   InChI=1S/C17H21NO.ClH/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15;/h3-11,17-18H,12-13H2,1-2H3;1H/t17-;/m1./s1;   InChIKey=LUCXVPAZUDVVBT-UNTBIKODSA-N;   SMILES=Cl.CNCC[C@@H](Oc1ccccc1C)c1ccccc1;   Tomoxetine hydrochloride;   atomoxetine;   tomoxetine
 xref: Beilstein:5318974;   CAS:82248-59-7;   DrugBank:DB00289;   KEGG:D02574
 xref_mesh: MESH:D000069445


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atomoxetine hydrochloride term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cyp2d4 cytochrome P450, family 2, subfamily d, polypeptide 4 increases hydroxylation ISO CYP2D6 protein results in increased hydroxylation of Atomoxetine Hydrochloride CTD PMID:17470523 NCBI chr 7:123,599,264...123,608,436
Ensembl chr 7:123,599,266...123,608,436
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Path 1
Term Annotations click to browse term
  CHEBI ontology 19875
    role 19825
      biological role 19825
        xenobiotic 18454
          atomoxetine 1
            atomoxetine hydrochloride 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19875
    subatomic particle 19873
      composite particle 19873
        hadron 19873
          baryon 19873
            nucleon 19873
              atomic nucleus 19873
                atom 19873
                  main group element atom 19763
                    main group molecular entity 19763
                      s-block molecular entity 19511
                        hydrogen molecular entity 19503
                          hydrides 18775
                            inorganic hydride 17505
                              pnictogen hydride 17478
                                nitrogen hydride 17323
                                  azane 17040
                                    ammonia 17039
                                      organic amino compound 17038
                                        secondary amino compound 6553
                                          atomoxetine 1
                                            atomoxetine hydrochloride 1
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