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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 19832
    chemical entity 19830
      molecular entity 19830
        polyatomic entity 19788
          heteroatomic molecular entity 19744
            hydroxides 19321
              organic hydroxy compound 18949
                hydroxy steroid 14440
                  3-hydroxy steroid 12778
                    Tetrahydrogestrinone 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19832
    subatomic particle 19830
      composite particle 19830
        hadron 19830
          baryon 19830
            nucleon 19830
              atomic nucleus 19830
                atom 19830
                  main group element atom 19780
                    p-block element atom 19780
                      carbon group element atom 19729
                        carbon atom 19725
                          organic molecular entity 19725
                            organic molecule 19678
                              organic cyclic compound 19491
                                organic polycyclic compound 17250
                                  steroid 14694
                                    hydroxy steroid 14440
                                      3-hydroxy steroid 12778
                                        Tetrahydrogestrinone 2
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