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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:cathinone
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Accession:CHEBI:4110 term browser browse the term
Definition:The S stereoisomer of 2-aminopropiophenone.
Synonyms:exact_synonym: (2S)-2-amino-1-phenylpropan-1-one
 related_synonym: D-Cathinone;   Formula=C9H11NO;   InChI=1S/C9H11NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7H,10H2,1H3/t7-/m0/s1;   InChIKey=PUAQLLVFLMYYJJ-ZETCQYMHSA-N;   Norephedrone;   SMILES=C[C@H](N)C(=O)c1ccccc1;   cathinonum;   catinona
 xref: CAS:71031-15-7;   DrugBank:DB01560;   KEGG:C08301;   KNApSAcK:C00001406


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19812
    role 19761
      application 19471
        fragrance 900
          propiophenone 10
            2-aminopropiophenone 1
              cathinone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19812
    subatomic particle 19811
      composite particle 19811
        hadron 19811
          baryon 19811
            nucleon 19811
              atomic nucleus 19811
                atom 19811
                  main group element atom 19708
                    p-block element atom 19708
                      carbon group element atom 19630
                        carbon atom 19620
                          organic molecular entity 19620
                            organic group 18728
                              organic divalent group 18719
                                organodiyl group 18719
                                  carbonyl group 18667
                                    carbonyl compound 18667
                                      ketone 16924
                                        aromatic ketone 12303
                                          propiophenone 10
                                            2-aminopropiophenone 1
                                              cathinone 0
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