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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:21-dehydrocortisol
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Accession:CHEBI:78595 term browser browse the term
Definition:A C21-steroid that is cortisol in which the 21-hydroxy group has been oxidised to the corresponding aldehyde.
Synonyms:exact_synonym: (11beta)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-al
 related_synonym: 11beta,17-dihydroxy-21-oxoprogesterone;   11beta,17alpha-dihydroxypregn-4-en-3,20-dione-21-al;   11beta,17alpha-dihydroxypregn-4-ene-3,20,21-trione;   4-pregnen-11beta,17alpha-diol-3,20-dione-21-al;   Formula=C21H28O5;   InChI=1S/C21H28O5/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/h9,11,14-16,18,24,26H,3-8,10H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1;   InChIKey=JIELFMXLFHFDRT-VWUMJDOOSA-N;   SMILES=C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)C=O
 xref: CAS:14760-49-7
 xref_mesh: MESH:C026547
 xref: PMID:1112882;   PMID:170263;   PMID:171488;   PMID:5413721;   PMID:5685579;   PMID:7098476;   PMID:7439163;   Reaxys:4564511



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Path 1
Term Annotations click to browse term
  CHEBI ontology 499
    chemical entity 499
      group 493
        organic group 405
          3-oxo-Delta(4)-steroid group 20
            3-oxo-Delta(4) steroid 20
              21-dehydrocortisol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 499
    subatomic particle 499
      composite particle 499
        hadron 499
          baryon 499
            nucleon 499
              atomic nucleus 499
                atom 499
                  main group element atom 492
                    p-block element atom 492
                      carbon group element atom 481
                        carbon atom 480
                          organic molecular entity 480
                            organic group 405
                              organic divalent group 404
                                organodiyl group 404
                                  carbonyl group 404
                                    carbonyl compound 404
                                      carboxylic acid 368
                                        carboacyl group 307
                                          univalent carboacyl group 307
                                            formyl group 4
                                              aldehyde 4
                                                steroid aldehyde 2
                                                  21-dehydrocortisol 0
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