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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:17beta-hydroxy-2alpha,17-dimethylestr-4-en-3-one
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Accession:CHEBI:79761 term browser browse the term
Definition:A 3-oxo Delta(4)-steroid that is estr-4-ene substituted by an oxo group at position 3, methyl groups at positions 2 and 17 and a beta-hydroxy group at position 17.
Synonyms:related_synonym: 2alpha,17-Dimethyl-19-nortestosterone;   Formula=C20H30O2;   InChI=1S/C20H30O2/c1-12-10-16-13(11-18(12)21)4-5-15-14(16)6-8-19(2)17(15)7-9-20(19,3)22/h11-12,14-17,22H,4-10H2,1-3H3/t12-,14+,15-,16+,17+,19+,20+/m1/s1;   InChIKey=JQIGNJUHWXILBM-OHLKBTDQSA-N;   SMILES=C[C@@H]1C[C@@H]2[C@H]3CC[C@@]4(C)[C@@H](CC[C@]4(C)O)[C@@H]3CCC2=CC1=O
 xref: CAS:1093-99-8;   KEGG:C15259;   Reaxys:6218773


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Term Annotations click to browse term
  CHEBI ontology 0
    chemical entity 0
      group 0
        organic group 0
          3-oxo-Delta(4)-steroid group 0
            3-oxo-Delta(4) steroid 0
              17beta-hydroxy-2alpha,17-dimethylestr-4-en-3-one 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbonyl compound 0
                                    ketone 0
                                      oxo steroid 0
                                        3-oxo steroid 0
                                          3-oxo-Delta(4) steroid 0
                                            17beta-hydroxy-2alpha,17-dimethylestr-4-en-3-one 0
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