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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:16alpha-hydroxyestrone
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Accession:CHEBI:776 term browser browse the term
Definition:The 16alpha-hydroxy derivative of estrone; a minor estrogen metabolite.
Synonyms:related_synonym: 16 alpha OHE;   16alpha-OHE;   16alpha-OHE1;   3,16alpha-Dihydroxyestra-1,3,5(10)-trien-17-one;   3,16alpha-dihydroxy-1,3,5(10)-estratrien-17-one;   Formula=C18H22O3;   InChI=1S/C18H22O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-16,19-20H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,18+/m1/s1;   InChIKey=WPOCIZJTELRQMF-QFXBJFAPSA-N;   SMILES=[H][C@@]12C[C@@H](O)C(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3;   estra-1,3,5(10)-triene-3,16alpha-diol-17-one
 alt_id: CHEBI:60497
 xref: Beilstein:3214335;   CAS:566-76-7;   Chemspider:103012;   FooDB:FDB021959;   HMDB:HMDB0000335;   KEGG:C05300;   LIPID_MAPS_instance:LMST02010041;   PDBeChem:J2Z;   PMID:10399881;   PMID:10408943;   PMID:10728690;   PMID:11431149;   PMID:11719282;   PMID:12450912;   PMID:12771045;   PMID:12919707;   PMID:12943746;   PMID:14569192;   PMID:15691880;   PMID:17885008;   PMID:18272409;   PMID:19250210;   PMID:29713726;   PMID:3621671;   Wikipedia:16-Hydroxyestrone


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Term Annotations click to browse term
  CHEBI ontology 19874
    role 19844
      application 19689
        pharmaceutical 19525
          drug 19525
            antineoplastic agent 17817
              estrone 128
                16alpha-hydroxyestrone 0
                  16alpha-hydroxyestrone 16-O-(beta-D-glucuronide) 0
                  16alpha-hydroxyestrone 16-O-(beta-D-glucuronide)(1-) 0
                  16alpha-hydroxyestrone 3-O-(beta-D-glucuronide) 0
                  16alpha-hydroxyestrone 3-O-(beta-D-glucuronide)(1-) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19874
    subatomic particle 19872
      composite particle 19872
        hadron 19872
          baryon 19872
            nucleon 19872
              atomic nucleus 19872
                atom 19872
                  main group element atom 19811
                    p-block element atom 19811
                      carbon group element atom 19751
                        carbon atom 19748
                          organic molecular entity 19748
                            organic molecule 19700
                              organic cyclic compound 19490
                                organic polycyclic compound 17286
                                  steroid 14717
                                    hydroxy steroid 14466
                                      3-hydroxy steroid 12808
                                        phenolic steroid 11313
                                          estrone 128
                                            16alpha-hydroxyestrone 0
                                              16alpha-hydroxyestrone 16-O-(beta-D-glucuronide) 0
                                              16alpha-hydroxyestrone 16-O-(beta-D-glucuronide)(1-) 0
                                              16alpha-hydroxyestrone 3-O-(beta-D-glucuronide) 0
                                              16alpha-hydroxyestrone 3-O-(beta-D-glucuronide)(1-) 0
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