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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:5alpha-androstane-3beta,17beta-diol 17-O-(beta-D-glucuronide)
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Accession:CHEBI:138022 term browser browse the term
Definition:A steroid glucosiduronic acid that is 5alpha-androstane-3beta,17beta-diol having a single beta-D-glucuronic acid residue attached at position 17.
Synonyms:exact_synonym: 3beta-hydroxy-5alpha-androstan-17beta-yl beta-D-glucopyranosiduronic acid
 related_synonym: (3beta,5alpha,17beta)-3-hydroxyandrostan-17-yl beta-D-glucopyranosiduronic acid;   5alpha-androstane 3beta,17beta-diol 17-O-glucuronide;   5alpha-androstane-3beta,17beta-diol 17-beta-D-glucuronide;   5alpha-androstane-3beta,17beta-diol 17-beta-glucuronide;   5alpha-androstane-3beta,17beta-diol 17-glucuronide;   Formula=C25H40O8;   InChI=1S/C25H40O8/c1-24-9-7-13(26)11-12(24)3-4-14-15-5-6-17(25(15,2)10-8-16(14)24)32-23-20(29)18(27)19(28)21(33-23)22(30)31/h12-21,23,26-29H,3-11H2,1-2H3,(H,30,31)/t12-,13-,14-,15-,16-,17-,18-,19-,20+,21-,23+,24-,25-/m0/s1;   InChIKey=ZJYZOWMDMWQJIV-JKNXCXBISA-N;   SMILES=C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(C[C@H](C1)O)[H])[H])(CC[C@@H]4O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)[H])C)[H])C
 xref: Reaxys:24460955
 cyclic_relationship: is_conjugate_acid_of CHEBI:136981


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  CHEBI ontology 19834
    chemical entity 19832
      atom 19832
        nonmetal atom 19770
          carbon atom 19727
            organic molecular entity 19727
              lipid 17976
                steroid 14695
                  steroid glucosiduronic acid 25
                    5alpha-androstane-3beta,17beta-diol 17-O-(beta-D-glucuronide) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19834
    subatomic particle 19832
      composite particle 19832
        hadron 19832
          baryon 19832
            nucleon 19832
              atomic nucleus 19832
                atom 19832
                  main group element atom 19782
                    p-block element atom 19782
                      carbon group element atom 19731
                        carbon atom 19727
                          organic molecular entity 19727
                            heteroorganic entity 19484
                              organochalcogen compound 19248
                                organooxygen compound 19165
                                  carbohydrates and carbohydrate derivatives 15288
                                    carbohydrate 15288
                                      carbohydrate derivative 14293
                                        glycosyl compound 13050
                                          glycoside 11832
                                            glycosiduronic acid 192
                                              glucosiduronic acid 192
                                                beta-D-glucosiduronic acid 47
                                                  5alpha-androstane-3beta,17beta-diol 17-O-(beta-D-glucuronide) 0
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