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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:(S)-fluoxetine(1+)
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Accession:CHEBI:86995 term browser browse the term
Definition:An organic cation resulting from the protonation of the amino group of (S)-fluoxetine.
Synonyms:exact_synonym: (3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-aminium
 related_synonym: (-)-fluoxetine(1+);   Formula=C17H19F3NO;   InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3/p+1/t16-/m0/s1;   InChIKey=RTHCYVBBDHJXIQ-INIZCTEOSA-O;   SMILES=C[NH2+]CC[C@H](Oc1ccc(cc1)C(F)(F)F)c1ccccc1
 xref: Reaxys:25263174
 cyclic_relationship: is_conjugate_acid_of CHEBI:86992;   is_enantiomer_of CHEBI:86993


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fluoxetine hydrochloride term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Slc6a4 solute carrier family 6 member 4 decreases expression EXP fluoxetine decreases expression of Slc6a4 mRNA in the dorsal raphe nucleus RGD PMID:15936043 RGD:38549581 NCBI chr10:61,824,208...61,858,924
Ensembl chr10:61,826,123...61,858,384
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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19821
    chemical entity 19821
      molecular entity 19819
        ion 16059
          organic ion 9147
            organic cation 8091
              (S)-fluoxetine(1+) 1
                (S)-fluoxetine hydrochloride + 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19821
    subatomic particle 19819
      composite particle 19819
        hadron 19819
          baryon 19819
            nucleon 19819
              atomic nucleus 19819
                atom 19819
                  main group element atom 19716
                    main group molecular entity 19716
                      s-block molecular entity 19502
                        hydrogen molecular entity 19498
                          hydrides 18852
                            inorganic hydride 17691
                              pnictogen hydride 17672
                                nitrogen hydride 17545
                                  ammonium 8228
                                    ammonium ion derivative 8224
                                      (S)-fluoxetine(1+) 1
                                        (S)-fluoxetine hydrochloride + 1
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