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ONTOLOGY REPORT - ANNOTATIONS


Term:16alpha-hydroxydehydroepiandrosterone 3-sulfate
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Accession:CHEBI:87774 term browser browse the term
Definition:An androstanoid that is dehydroepiandrosterone 3-sulfate substituted by a hydroxy group at the 16alpha-position.
Synonyms:exact_synonym: 16alpha-hydroxy-17-oxoandrost-5-en-3beta-yl hydrogen sulfate
 related_synonym: (3beta)-16alpha-hydroxy-17-oxoandrost-5-en-3-yl sulfate;   (3beta,16alpha)-16-hydroxy-17-oxoandrost-5-en-3-yl sulfate;   16alpha-hydroxy-DHEA 3-sulfate;   3beta-sulfooxy-16alpha-hydroxyandrost-5-en-17-one;   Formula=C19H28O6S;   InChI=1S/C19H28O6S/c1-18-7-5-12(25-26(22,23)24)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)21/h3,12-16,20H,4-10H2,1-2H3,(H,22,23,24)/t12-,13+,14-,15-,16+,18-,19-/m0/s1;   InChIKey=ALBNSVAJDFJRKQ-DNKQKWOHSA-N;   SMILES=C1[C@@]2([C@@]([C@@]3(C(C[C@@H](OS(O)(=O)=O)CC3)=C1)C)(CC[C@]4([C@]2(C[C@H](C4=O)O)[H])C)[H])[H]
 xref: PMID:153014;   PMID:17178770;   Reaxys:6004315
 cyclic_relationship: is_conjugate_acid_of CHEBI:87538


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Term Annotations click to browse term
  CHEBI ontology 19790
    role 19738
      biological role 19737
        biochemical role 19232
          metabolite 19208
            xenobiotic metabolite 14049
              human xenobiotic metabolite 13304
                16alpha-hydroxydehydroepiandrosterone 3-sulfate 0
Path 2
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  CHEBI ontology 19790
    subatomic particle 19788
      composite particle 19788
        hadron 19788
          baryon 19788
            nucleon 19788
              atomic nucleus 19788
                atom 19788
                  main group element atom 19674
                    p-block element atom 19674
                      carbon group element atom 19572
                        carbon atom 19561
                          organic molecular entity 19561
                            organic group 18475
                              organic divalent group 18468
                                organodiyl group 18468
                                  carbonyl group 18366
                                    carbonyl compound 18366
                                      ketone 16011
                                        oxyketone 8605
                                          alpha-oxyketone 8605
                                            alpha-hydroxy ketone 8605
                                              secondary alpha-hydroxy ketone 867
                                                16alpha-hydroxydehydroepiandrosterone 3-sulfate 0
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