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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
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Accession:CHEBI:28859 term browser browse the term
Definition:The 5alpha-stereoisomer of androstane.
Synonyms:related_synonym: Androstane;   Formula=C19H32;   InChI=1S/C19H32/c1-18-11-5-7-16(18)15-9-8-14-6-3-4-12-19(14,2)17(15)10-13-18/h14-17H,3-13H2,1-2H3/t14-,15+,16+,17+,18+,19+/m1/s1;   InChIKey=QZLYKIGBANMMBK-UGCZWRCOSA-N;   SMILES=[H][C@]12CCCC[C@]1(C)[C@@]1([H])CC[C@]3(C)CCC[C@@]3([H])[C@]1([H])CC2
 alt_id: CHEBI:20638;   CHEBI:2712
 xref: Beilstein:2043119;   CAS:438-22-2;   KEGG:C01554;   LIPID_MAPS_instance:LMST02020056;   PMID:13749674


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    Path 1
    Term Annotations click to browse term
      CHEBI ontology 26050
        role 25966
          biological role 25945
            biochemical role 25178
              metabolite 25108
                eukaryotic metabolite 24528
                  animal metabolite 24070
                    mammalian metabolite 24064
                      human metabolite 23014
                        5alpha-androstane 2015
                          17beta-hydroxy-4alpha-methyl-5alpha-androstan-3-one 0
                          17beta-hydroxy-5alpha-androst-1-en-3-one propionate 0
                          17beta-hydroxy-5alpha-androstan-3-one + 1042
                          17beta-hydroxy-5alpha-androstane acetate 0
                          18-hydroxy-5alpha-dihydrotestosterone 0
                          19-hydroxy-5alpha-dihydrotestosterone 0
                          19-oxo-5alpha-dihydrotestosterone 0
                          5alpha-androstane-3beta,6alpha,17beta-triol 0
                          5alpha-androstane-3beta,7alpha,17beta-triol 0
                          androsterone + 13
                          androsterone sulfate 0
                          dutasteride 21
                          epiandrosterone + 0
                          epiandrosterone sulfate 0
                          finasteride 1028
                          rocuronium + 10
                          rocuronium bromide 0
                          vecuronium + 25
                          vecuronium bromide 25
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 26050
        subatomic particle 26025
          composite particle 26025
            hadron 26025
              baryon 26025
                nucleon 26025
                  atomic nucleus 26025
                    atom 26025
                      main group element atom 25850
                        p-block element atom 25850
                          carbon group element atom 25447
                            carbon atom 25405
                              organic molecular entity 25405
                                organic molecule 25233
                                  organic cyclic compound 24287
                                    organic polycyclic compound 18802
                                      steroid 15868
                                        steroid fundamental parent 15631
                                          androstane 6149
                                            5alpha-androstane 2015
                                              17beta-hydroxy-4alpha-methyl-5alpha-androstan-3-one 0
                                              17beta-hydroxy-5alpha-androst-1-en-3-one propionate 0
                                              17beta-hydroxy-5alpha-androstan-3-one + 1042
                                              17beta-hydroxy-5alpha-androstane acetate 0
                                              18-hydroxy-5alpha-dihydrotestosterone 0
                                              19-hydroxy-5alpha-dihydrotestosterone 0
                                              19-oxo-5alpha-dihydrotestosterone 0
                                              5alpha-androstane-3beta,6alpha,17beta-triol 0
                                              5alpha-androstane-3beta,7alpha,17beta-triol 0
                                              androsterone + 13
                                              androsterone sulfate 0
                                              dutasteride 21
                                              epiandrosterone + 0
                                              epiandrosterone sulfate 0
                                              finasteride 1028
                                              rocuronium + 10
                                              rocuronium bromide 0
                                              vecuronium + 25
                                              vecuronium bromide 25
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