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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:4-methoxy-17beta-estradiol
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Accession:CHEBI:136975 term browser browse the term
Definition:A 17beta-hydroxy steroid that is 17beta-estradiol in which the hydrogen at position 4 has been replaced by a methoxy group.
Synonyms:exact_synonym: 4-methoxyestra-1,3,5(10)-triene-3,17beta-diol
 related_synonym: (17beta)-4-methoxyestra-1,3,5(10)-triene-3,17-diol;   4-MeOE2;   4-Methoxy-3,17beta-dihydroxy-1,3,5[10]-estratriene;   4-Methoxyestradiol;   4-Methoxyestradiol-17beta;   Formula=C19H26O3;   InChI=1S/C19H26O3/c1-19-10-9-12-11-5-7-16(20)18(22-2)14(11)4-3-13(12)15(19)6-8-17(19)21/h5,7,12-13,15,17,20-21H,3-4,6,8-10H2,1-2H3/t12-,13-,15+,17+,19+/m1/s1;   InChIKey=BCWZIZLVBYHFES-PYEWSWHRSA-N;   SMILES=C=1C=2[C@]3(CC[C@]4([C@]([C@@]3(CCC2C(=C(C1)O)OC)[H])(CC[C@@H]4O)[H])C)[H]
 xref: CAS:26788-23-8;   HMDB:HMDB0012782
 xref_mesh: MESH:C045018
 xref: PMID:10403516;   PMID:12810639;   PMID:14962508;   PMID:15472229;   PMID:17397890;   PMID:20823587;   PMID:21344307;   PMID:21561814;   PMID:22159223;   PMID:23319542;   PMID:23319543;   PMID:23757313;   PMID:25433128;   PMID:26180245;   PMID:26460631;   PMID:28219710;   Reaxys:5753018



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4-methoxy-17beta-estradiol term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cyp1b1 cytochrome P450, family 1, subfamily b, polypeptide 1 increases abundance
multiple interactions
ISO CYP1B1 protein results in increased abundance of 4-methoxyestradiol
Tetrachlorodibenzodioxin promotes the reaction [CYP1B1 protein results in increased abundance of 4-methoxyestradiol]; Tetradecanoylphorbol Acetate promotes the reaction [Tetrachlorodibenzodioxin promotes the reaction [CYP1B1 protein results in increased abundance of 4-methoxyestradiol]]
CTD PMID:9706865 NCBI chr 6:15,342,312...15,350,886
Ensembl chr 6:15,342,344...15,350,917
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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19831
    role 19807
      biological role 19805
        molecular messenger 18637
          hormone 18484
            sex hormone 18304
              estrogen 18258
                4-methoxy-17beta-estradiol 1
                  4-methoxy-17beta-estradiol 3-O-(beta-D-glucuronide) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19831
    subatomic particle 19829
      composite particle 19829
        hadron 19829
          baryon 19829
            nucleon 19829
              atomic nucleus 19829
                atom 19829
                  main group element atom 19779
                    p-block element atom 19779
                      carbon group element atom 19728
                        carbon atom 19724
                          organic molecular entity 19724
                            organic molecule 19677
                              organic cyclic compound 19490
                                organic polycyclic compound 17245
                                  steroid 14689
                                    hydroxy steroid 14434
                                      3-hydroxy steroid 12772
                                        phenolic steroid 11268
                                          estradiol 11264
                                            17beta-estradiol 11264
                                              4-methoxy-17beta-estradiol 1
                                                4-methoxy-17beta-estradiol 3-O-(beta-D-glucuronide) 0
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