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17,21-dihydroxy-5beta-pregnane-3,11,20-trione - Ontology Report - Rat Genome Database

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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:17,21-dihydroxy-5beta-pregnane-3,11,20-trione
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Accession:CHEBI:18093 term browser browse the term
Definition:A 4,5-dihydrocortisone that has beta- configuration at position 5.
Synonyms:related_synonym: 17alpha,21-Dihydroxy-5beta-pregnane-3,11,20-trione;   4,5beta-Dihydrocortisone;   5-dihydrocortisone;   5beta-Pregnane-17alpha,21-diol-3,11,20-trione;   Formula=C21H30O5;   InChI=1S/C21H30O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12,14-15,18,22,26H,3-11H2,1-2H3/t12-,14+,15+,18-,19+,20+,21+/m1/s1;   InChIKey=YCLWEYIBFOLMEM-FNLRALKVSA-N;   SMILES=[H][C@]12CC[C@@]3([H])[C@]4([H])CC[C@](O)(C(=O)CO)[C@@]4(C)CC(=O)[C@]3([H])[C@@]1(C)CCC(=O)C2
 alt_id: CHEBI:11927;   CHEBI:1753;   CHEBI:20277;   CHEBI:785
 xref: Beilstein:3222844;   CAS:68-54-2;   KEGG:C05469;   LIPID_MAPS_instance:LMST02030095
 xref_mesh: MESH:C045993

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  CHEBI ontology 20856
    chemical entity 20854
      group 20798
        organic group 19534
          3-oxo-Delta(4)-steroid group 9254
            3-oxo-Delta(4) steroid 9254
              cortisone 25
                4,5-dihydrocortisone 0
                  17,21-dihydroxy-5beta-pregnane-3,11,20-trione 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 20856
    subatomic particle 20854
      composite particle 20854
        hadron 20854
          baryon 20854
            nucleon 20854
              atomic nucleus 20854
                atom 20854
                  main group element atom 20777
                    p-block element atom 20777
                      carbon group element atom 20710
                        carbon atom 20704
                          organic molecular entity 20704
                            heteroorganic entity 20215
                              organochalcogen compound 19902
                                organooxygen compound 19804
                                  carbonyl compound 19435
                                    ketone 17451
                                      oxo steroid 10638
                                        3-oxo steroid 10017
                                          3-oxo-Delta(4) steroid 9254
                                            cortisone 25
                                              4,5-dihydrocortisone 0
                                                17,21-dihydroxy-5beta-pregnane-3,11,20-trione 0
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