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The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at The data is made available under the Creative Commons License (CC 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:2-methoxyestrone 3-O-(beta-D-glucuronide)
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Accession:CHEBI:37450 term browser browse the term
Definition:A steroid glucosiduronic acid that is 2-methoxyestrone having a single beta-D-glucuronic acid residue attached at position 3.
Synonyms:exact_synonym: 2-methoxy-17-oxoestra-1(10),2,4-trien-3-yl beta-D-glucopyranosiduronic acid
 related_synonym: 2-MeOE1 3G;   2-Methoxyestrone-3-glucuronide;   2-methoxyestrone 3-O-(beta-D-glucuronic acid);   2-methoxyestrone 3-O-glucuronide;   2-methoxyestrone 3-beta-D-glucuronide;   2-methoxyestrone 3-beta-glucuronide;   2-methoxyestrone 3-glucosiduronic acid;   2-methoxyestrone 3-glucuronoside;   Formula=C25H32O9;   InChI=1S/C25H32O9/c1-25-8-7-12-13(15(25)5-6-18(25)26)4-3-11-9-17(16(32-2)10-14(11)12)33-24-21(29)19(27)20(28)22(34-24)23(30)31/h9-10,12-13,15,19-22,24,27-29H,3-8H2,1-2H3,(H,30,31)/t12-,13+,15-,19-,20-,21+,22-,24+,25-/m0/s1;   InChIKey=NZTHZDNDYACBSX-FJNWEKAQSA-N;   SMILES=C1[C@]2([C@]3([C@@](C4=C(C=C(O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)C(=C4)OC)CC3)(CC[C@@]2(C(=O)C1)C)[H])[H])[H]
 alt_id: CHEBI:1190;   CHEBI:19676
 xref: CAS:25577-70-2;   KEGG:C11132;   LIPID_MAPS_instance:LMST05010010;   Reaxys:11305842
 cyclic_relationship: is_conjugate_acid_of CHEBI:136971

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  CHEBI ontology 19838
    role 19810
      application 19679
        pharmaceutical 19495
          drug 19520
            antineoplastic agent 17820
              estrone 128
                2-methoxyestrone 1
                  2-methoxyestrone 3-O-(beta-D-glucuronide) 0
Path 2
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  CHEBI ontology 19838
    subatomic particle 19836
      composite particle 19836
        hadron 19836
          baryon 19836
            nucleon 19836
              atomic nucleus 19836
                atom 19836
                  main group element atom 19782
                    p-block element atom 19782
                      carbon group element atom 19722
                        carbon atom 19719
                          organic molecular entity 19719
                            heteroorganic entity 19474
                              organochalcogen compound 19262
                                organooxygen compound 19153
                                  carbohydrates and carbohydrate derivatives 15270
                                    carbohydrate 15270
                                      carbohydrate derivative 14281
                                        glycosyl compound 13035
                                          glycoside 11815
                                            glycosiduronic acid 195
                                              glucosiduronic acid 195
                                                beta-D-glucosiduronic acid 47
                                                  2-methoxyestrone 3-O-(beta-D-glucuronide) 0
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