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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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Term Annotations click to browse term
  CHEBI ontology 19853
    role 19804
      biological role 19804
        xenobiotic 18437
          atomoxetine 1
            atomoxetine hydrochloride 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19853
    subatomic particle 19851
      composite particle 19851
        hadron 19851
          baryon 19851
            nucleon 19851
              atomic nucleus 19851
                atom 19851
                  main group element atom 19744
                    main group molecular entity 19744
                      s-block molecular entity 19491
                        hydrogen molecular entity 19483
                          hydrides 18748
                            inorganic hydride 17481
                              pnictogen hydride 17454
                                nitrogen hydride 17296
                                  azane 17015
                                    ammonia 17014
                                      organic amino compound 17013
                                        secondary amino compound 6541
                                          atomoxetine 1
                                            atomoxetine hydrochloride 1
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