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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:17beta-estradiol 17-glucosiduronic acid
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Accession:CHEBI:791 term browser browse the term
Definition:A steroid glucosiduronic acid that consists of 17beta-estradiol having a beta-glucuronyl residue attached at position 17 via a glycosidic linkage.
Synonyms:exact_synonym: 3-hydroxyestra-1,3,5(10)-trien-17beta-yl beta-D-glucopyranosiduronic acid
 related_synonym: 17beta-Estradiol 17-(beta-D-glucuronide);   17beta-Estradiol glucuronide;   Formula=C24H32O8;   Glucuronosylestradiol;   InChI=1S/C24H32O8/c1-24-9-8-14-13-5-3-12(25)10-11(13)2-4-15(14)16(24)6-7-17(24)31-23-20(28)18(26)19(27)21(32-23)22(29)30/h3,5,10,14-21,23,25-28H,2,4,6-9H2,1H3,(H,29,30)/t14-,15-,16+,17+,18+,19+,20-,21+,23-,24+/m1/s1;   InChIKey=MTKNDAQYHASLID-QXYWQCSFSA-N;   Oestradiol-17beta-glucuronide;   SMILES=[H][C@]12CC[C@]3(C)[C@H](CC[C@@]3([H])[C@]1([H])CCc1cc(O)ccc21)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O;   estra-1,3,5(10)-triene-3,17beta-diol 17-D-glucuronoside
 xref: CAS:1806-98-0;   HMDB:HMDB0010317;   KEGG:C11237;   LIPID_MAPS_instance:LMST05010015;   LIPID_MAPS_instance:LMST05010025
 xref_mesh: MESH:C025483
 xref: PMID:11812141;   PMID:11837698;   PMID:12527806;   PMID:12751626;   PMID:14567633;   PMID:15537867;   PMID:15608133;   PMID:20124397;   PMID:20360303;   PMID:20374298;   Reaxys:64569
 cyclic_relationship: is_conjugate_acid_of CHEBI:82961


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Term Annotations click to browse term
  CHEBI ontology 5067
    role 5032
      application 871
        pharmaceutical 722
          drug 722
            protective agent 454
              geroprotector 407
                17beta-estradiol 26
                  17beta-estradiol 17-glucosiduronic acid 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5067
    subatomic particle 5058
      composite particle 5058
        hadron 5058
          baryon 5058
            nucleon 5058
              atomic nucleus 5058
                atom 5058
                  main group element atom 5028
                    p-block element atom 5025
                      carbon group element atom 4942
                        carbon atom 4941
                          organic molecular entity 4941
                            heteroorganic entity 4781
                              organochalcogen compound 4743
                                organooxygen compound 4705
                                  carbohydrates and carbohydrate derivatives 123
                                    carbohydrate 123
                                      carbohydrate derivative 112
                                        glycosyl compound 50
                                          glycoside 25
                                            glycosiduronic acid 0
                                              glucosiduronic acid 0
                                                steroid glucosiduronic acid 0
                                                  17beta-estradiol 17-glucosiduronic acid 0
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