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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-5alpha-estr-1(10)-en-3-one
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Accession:CHEBI:137110 term browser browse the term
Definition:A 3-oxo-5alpha-steroid that is 5alpha-estrane which is substituted by an oxo group at position 3, a hydroxy group at the 17beta position, and which has a double bond between positions 1 and 10. It is a 19-norsteroid arising from successive oxidation of dihydrotestosterone at C19.
Synonyms:related_synonym: (5alpha,17beta)-17-hydroxyestr-1(10)-en-3-one;   17beta-hydroxy-3-oxo-19-nor-5alpha-androst-1-ene;   Delta(1)(,)(10)-dehydro 19-nordihydrotestosterone;   Formula=C18H26O2;   InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h5,11,14-17,20H,2-4,6-10H2,1H3/t11-,14+,15+,16-,17-,18-/m0/s1;   InChIKey=NIELHBRGWMDPDV-PONDEJGUSA-N;   SMILES=C1=C2[C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(CC(C1)=O)[H])[H])(CC[C@@H]4O)[H])C)[H]
 xref: PMID:22773874;   Reaxys:2621103


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  CHEBI ontology 860
    chemical entity 860
      atom 845
        nonmetal atom 823
          carbon atom 804
            organic molecular entity 804
              lipid 234
                steroid 96
                  C18-steroid 0
                    17beta-hydroxy-5alpha-estr-1(10)-en-3-one 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 860
    subatomic particle 845
      composite particle 845
        hadron 845
          baryon 845
            nucleon 845
              atomic nucleus 845
                atom 845
                  main group element atom 834
                    p-block element atom 831
                      carbon group element atom 805
                        carbon atom 804
                          organic molecular entity 804
                            organic group 380
                              organic divalent group 378
                                organodiyl group 378
                                  carbonyl group 377
                                    carbonyl compound 377
                                      ketone 174
                                        oxo steroid 52
                                          3-oxo steroid 50
                                            3-oxo-5alpha-steroid 0
                                              17beta-hydroxy-5alpha-estr-1(10)-en-3-one 0
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