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ONTOLOGY REPORT - ANNOTATIONS


Term:cortisol 21-sulfate
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Accession:CHEBI:16473 term browser browse the term
Definition:A steroid sulfate obtained by the formal condensation of hydroxy group at position 21 of cortisol with sulfuric acid.
Synonyms:exact_synonym: 11beta,17-dihydroxy-3,20-dioxopregn-4-en-21-yl hydrogen sulfate
 related_synonym: (11beta)-11,17-Dihydroxy-21-(sulfooxy)pregn-4-ene-3,20-dione;   11,17-Dihydroxy-4-pregnene-3,20-dione-21-yl-sulfate;   Formula=C21H30O8S;   InChI=1S/C21H30O8S/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19/h9,14-16,18,23,25H,3-8,10-11H2,1-2H3,(H,26,27,28)/t14-,15-,16-,18+,19-,20-,21-/m0/s1;   InChIKey=JOVLCJDINAUYJW-VWUMJDOOSA-N;   SMILES=[H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])[C@@H](O)C[C@@]1(C)[C@@]2([H])CC[C@]1(O)C(=O)COS(O)(=O)=O
 alt_id: CHEBI:14025;   CHEBI:23395;   CHEBI:3895
 xref: CAS:1253-43-6;   KEGG:C02822;   PMID:2152866;   PMID:24392764;   PMID:5012753;   PMID:5857563;   PMID:8650705;   Reaxys:2404797
 cyclic_relationship: is_conjugate_acid_of CHEBI:57782


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Term Annotations click to browse term
  CHEBI ontology 19758
    chemical entity 19757
      group 19667
        organic group 18428
          3-oxo-Delta(4)-steroid group 7942
            3-oxo-Delta(4) steroid 7942
              cortisol 21-sulfate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19758
    subatomic particle 19756
      composite particle 19756
        hadron 19756
          baryon 19756
            nucleon 19756
              atomic nucleus 19756
                atom 19756
                  main group element atom 19641
                    p-block element atom 19641
                      carbon group element atom 19532
                        carbon atom 19521
                          organic molecular entity 19521
                            organic group 18428
                              organic divalent group 18419
                                organodiyl group 18419
                                  carbonyl group 18309
                                    carbonyl compound 18309
                                      ketone 15948
                                        oxyketone 8487
                                          alpha-oxyketone 8487
                                            alpha-hydroxy ketone 8487
                                              primary alpha-hydroxy ketone 7450
                                                cortisol 154
                                                  cortisol ester 0
                                                    cortisol 21-sulfate 0
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