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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:equilenin
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Accession:CHEBI:34739 term browser browse the term
Definition:A 3-hydroxy steroid that is estrone which carries two double bonds at positions 6 and 8. It is found in the urine of pregnant mare's and extensively used for estrogen replacement therapy in postmenopausal women.
Synonyms:exact_synonym: 3-hydroxyestra-1(10),2,4,6,8-pentaen-17-one
 related_synonym: (3aS,11aS)-7-hydroxy-11a-methyl-2,3,3a,10,11,11a-hexahydro-1H-cyclopenta[a]phenanthren-1-one;   3-Hydroxyestra-1,3,5(10),6,8-pentaen-17-one;   3-hydroxyestra-1,3,5,7,9-pentaen-17-one;   6,8-didehydroestrone;   Formula=C18H18O2;   InChI=1S/C18H18O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2-5,10,16,19H,6-9H2,1H3/t16-,18-/m0/s1;   InChIKey=PDRGHUMCVRDZLQ-WMZOPIPTSA-N;   SMILES=[H][C@@]12CCC(=O)[C@@]1(C)CCC1=C2C=CC2=CC(O)=CC=C12;   d-3-hydroxy-1,3,5(10),6,8-estrapentaen-17-one;   d-equilenin;   equilenine
 alt_id: CHEBI:42458
 xref: CAS:517-09-9;   DrugBank:DB03515;   KEGG:C14303;   LIPID_MAPS_instance:LMST02010007
 xref_mesh: MESH:D004855
 xref: PDBeChem:EQU;   PMID:10653633;   PMID:10694700;   PMID:11368557;   PMID:11850971;   PMID:12852789;   PMID:16191477;   PMID:18416538;   PMID:18919700;   PMID:20080683;   PMID:22126130;   PMID:22290292;   PMID:25611945;   PMID:26863931;   PMID:27375051;   PMID:28932441;   PMID:29660500;   PMID:3718973;   PMID:3821102;   PMID:3964666;   Patent:EP0944391;   Wikipedia:Equilenin


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equilenin term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Sts steroid sulfatase increases metabolic processing ISO STS protein results in increased metabolism of Equilenin CTD PMID:6874424 NCBI chr  X:168,856,332...169,015,037
Ensembl chr  X:168,909,030...169,014,924 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 22178
    role 22194
      chemical role 21407
        antioxidant 16394
          equilenin 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 22178
    subatomic particle 22170
      composite particle 22170
        hadron 22201
          baryon 22170
            nucleon 22170
              atomic nucleus 22170
                atom 22170
                  main group element atom 22104
                    p-block element atom 22104
                      carbon group element atom 21904
                        carbon atom 21859
                          organic molecular entity 21830
                            heteroorganic entity 21482
                              organochalcogen compound 20966
                                organooxygen compound 20806
                                  carbonyl compound 20172
                                    ketone 17949
                                      oxo steroid 10655
                                        17-oxo steroid 268
                                          equilenin 1
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