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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:epiandrosterone sulfate
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Accession:CHEBI:83040 term browser browse the term
Definition:A steroid sulfate that is the 3-sulfate of epiandrosterone.
Synonyms:exact_synonym: 17-oxo-5alpha-androstan-3beta-yl hydrogen sulfate
 related_synonym: (3beta,5alpha)-17-oxoandrostan-3-yl hydrogen sulfate;   Formula=C19H30O5S;   InChI=1S/C19H30O5S/c1-18-9-7-13(24-25(21,22)23)11-12(18)3-4-14-15-5-6-17(20)19(15,2)10-8-16(14)18/h12-16H,3-11H2,1-2H3,(H,21,22,23)/t12-,13-,14-,15-,16-,18-,19-/m0/s1;   InChIKey=ZMITXKRGXGRMKS-LUJOEAJASA-N;   SMILES=C1[C@@]2([C@@]([C@@]3([C@](C[C@@H](OS(O)(=O)=O)CC3)(C1)[H])C)(CC[C@@]4(C(CC[C@@]24[H])=O)C)[H])[H]
 xref: PMID:11711114;   PMID:1926228;   PMID:2171821;   PMID:8987136;   Reaxys:2225705
 cyclic_relationship: is_conjugate_acid_of CHEBI:133729


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19808
    role 19784
      chemical role 19420
        catalyst 8291
          sulfuric acid 8240
            sulfuric acid derivative 8240
              organic sulfate 2275
                steroid sulfate 63
                  epiandrosterone sulfate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19808
    subatomic particle 19806
      composite particle 19806
        hadron 19806
          baryon 19806
            nucleon 19806
              atomic nucleus 19806
                atom 19806
                  main group element atom 19756
                    p-block element atom 19756
                      chalcogen 19513
                        oxygen atom 19488
                          oxygen molecular entity 19488
                            hydroxides 19299
                              oxoacid 18736
                                chalcogen oxoacid 13754
                                  sulfur oxoacid 13542
                                    sulfuric acid 8240
                                      sulfuric acid derivative 8240
                                        sulfates 8235
                                          organic sulfate 2275
                                            steroid sulfate 63
                                              epiandrosterone sulfate 0
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