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ONTOLOGY REPORT - ANNOTATIONS


Term:5beta-scymnol sulfate
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Accession:CHEBI:50107 term browser browse the term
Definition:A steroid sulfate that has formula C27H48O9S.
Synonyms:exact_synonym: (24R)-3alpha,7alpha,12alpha,24,26-pentahydroxy-5beta-cholestan-27-yl hydrogen sulfate
 related_synonym: Formula=C27H48O9S;   InChI=1S/C27H48O9S/c1-15(4-7-22(30)16(13-28)14-36-37(33,34)35)19-5-6-20-25-21(12-24(32)27(19,20)3)26(2)9-8-18(29)10-17(26)11-23(25)31/h15-25,28-32H,4-14H2,1-3H3,(H,33,34,35)/t15-,16?,17+,18-,19-,20+,21?,22-,23-,24+,25+,26+,27-/m1/s1;   InChIKey=JKUSPYUETNXNRO-JWBDLDPOSA-N;   SMILES=[H][C@@]12C[C@H](O)CC[C@]1(C)C1C[C@H](O)[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])[C@H](O)C2)[C@H](C)CC[C@@H](O)C(CO)COS(O)(=O)=O
 xref: KEGG:C16261
 cyclic_relationship: is_conjugate_acid_of CHEBI:58808


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  CHEBI ontology 19790
    role 19738
      chemical role 19269
        catalyst 8051
          sulfuric acid 8012
            sulfuric acid derivative 8012
              organic sulfate 1931
                steroid sulfate 61
                  5beta-scymnol sulfate 0
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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
                      chalcogen 19378
                        oxygen atom 19339
                          oxygen molecular entity 19339
                            hydroxides 19079
                              oxoacid 18174
                                chalcogen oxoacid 11481
                                  sulfur oxoacid 11081
                                    sulfuric acid 8012
                                      sulfuric acid derivative 8012
                                        sulfates 8009
                                          organic sulfate 1931
                                            steroid sulfate 61
                                              5beta-scymnol sulfate 0
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