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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:desogestrel
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Accession:CHEBI:4453 term browser browse the term
Definition:A terminal acetylenic compound that has formula C22H30O.
Synonyms:exact_synonym: 17alpha-ethynyl-11-methylidene-18a-homo-estr-4-en-17beta-ol
 related_synonym: 13-Ethyl-11-methylene-18,19-dinor-17alpha-pregn-4-en-20-yn-17-ol;   Cerazette;   Formula=C22H30O;   InChI=1S/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19-,20+,21-,22-/m0/s1;   InChIKey=RPLCPCMSCLEKRS-BPIQYHPVSA-N;   SMILES=[H][C@]12CCCC=C1CC[C@@]1([H])[C@]3([H])CC[C@@](O)(C#C)[C@@]3(CC)CC(=C)[C@]21[H];   desogestrelum
 xref: Beilstein:5094648;   CAS:54024-22-5;   DrugBank:DB00304;   Drug_Central:818;   KEGG:C07629;   KEGG:D02367;   LIPID_MAPS_instance:LMST02030104
 xref_mesh: MESH:D017135
 xref: Patent:DE2361120;   Patent:US3927046;   Wikipedia:Desogestrel

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Term Annotations click to browse term
  CHEBI ontology 2
    role 2
      application 2
        pharmaceutical 2
          drug 2
            reproductive control drug 0
              contraceptive drug 0
                desogestrel 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 2
    subatomic particle 2
      composite particle 2
        hadron 2
          baryon 2
            nucleon 2
              atomic nucleus 2
                atom 2
                  main group element atom 2
                    p-block element atom 2
                      carbon group element atom 2
                        carbon atom 2
                          organic molecular entity 2
                            organic molecule 2
                              organic cyclic compound 2
                                organic polycyclic compound 0
                                  steroid 0
                                    hydroxy steroid 0
                                      17-hydroxy steroid 0
                                        17beta-hydroxy steroid 0
                                          desogestrel 0
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