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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:Tetrahydrogestrinone
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Accession:CHEBI:190313 term browser browse the term
Synonyms:exact_synonym: (8S,13S,14S,17S)-13,17-diethyl-17-hydroxy-1,2,6,7,8,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
 related_synonym: Formula=C21H28O2;   InChI=1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h9,11,13,18-19,23H,3-8,10,12H2,1-2H3/t18-,19+,20+,21+/m1/s1;   InChIKey=OXHNQTSIKGHVBH-ANULTFPQSA-N;   SMILES=O[C@@]1([C@@]2([C@]([C@]3(C(C=C2)=C4C(CC3)=CC(=O)CC4)[H])(CC1)[H])CC)CC
 xref: CAS:618903-56-3;   Chemspider:5257020;   DrugBank:DB06870;   HMDB:HMDB0004626
 xref_mesh: MESH:C479553
 xref: PDBeChem:17H


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Tetrahydrogestrinone term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cyp1a1 cytochrome P450, family 1, subfamily a, polypeptide 1 increases expression
multiple interactions		 ISO tetrahydrogestrinone results in increased expression of CYP1A1 mRNA
tetrahydrogestrinone results in increased expression of and results in increased activity of CYP1A1 protein		 CTD PMID:22664790 NCBI chr 8:58,096,021...58,102,130
Ensembl chr 8:58,096,077...58,102,125 		JBrowse link
G Nr1i3 nuclear receptor subfamily 1, group I, member 3 multiple interactions ISO 1,4-bis(2-(3,5-dichloropyridyloxy))benzene inhibits the reaction [tetrahydrogestrinone binds to and results in decreased activity of NR1I3 protein]; tetrahydrogestrinone binds to and results in decreased activity of NR1I3 protein CTD PMID:18832183 NCBI chr13:83,632,940...83,638,193
Ensembl chr13:83,632,899...83,637,906 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19844
    chemical entity 19842
      molecular entity 19842
        polyatomic entity 19799
          heteroatomic molecular entity 19755
            hydroxides 19331
              organic hydroxy compound 18961
                hydroxy steroid 14438
                  3-hydroxy steroid 12777
                    Tetrahydrogestrinone 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19844
    subatomic particle 19842
      composite particle 19842
        hadron 19842
          baryon 19842
            nucleon 19809
              atomic nucleus 19842
                atom 19842
                  main group element atom 19792
                    p-block element atom 19792
                      carbon group element atom 19738
                        carbon atom 19734
                          organic molecular entity 19734
                            organic molecule 19687
                              organic cyclic compound 19498
                                organic polycyclic compound 17251
                                  steroid 14692
                                    hydroxy steroid 14438
                                      3-hydroxy steroid 12777
                                        Tetrahydrogestrinone 2
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