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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:androsta-1,4,6-triene-3,17-dione
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Accession:CHEBI:131190 term browser browse the term
Definition:An androstanoid that is androsta-1,4,6-triene substituted by oxo groups at positions 3 and 17.
Synonyms:related_synonym: 1,4,6-Androstatriene-3,17-dione;   1,4,6-Etioallochan-dione;   Formula=C19H22O2;   InChI=1S/C19H22O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3-4,7,9,11,14-16H,5-6,8,10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1;   InChIKey=DKVSUQWCZQBWCP-QAGGRKNESA-N;   SMILES=C=1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(C=CC2=CC(C1)=O)[H])(CCC4=O)[H])C)[H])C
 xref: CAS:633-35-2;   PMID:17303200;   PMID:22120997;   PMID:22315450;   PMID:26632865;   PMID:2950196;   PMID:3193049;   PMID:3199056;   PMID:3397055;   PMID:3557327;   PMID:3562648;   PMID:3803480;   PMID:6810900;   PMID:6896890;   PMID:7050537;   PMID:7210060;   PMID:7300351;   PMID:7413827;   PMID:7472286;   PMID:7600674;   Reaxys:3121300;   Wikipedia:1\,4\,6-Androstatriene-3\,17-dione



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Term Annotations click to browse term
  CHEBI ontology 22210
    role 22195
      biological role 22194
        biochemical role 21464
          metabolite 21412
            xenobiotic metabolite 16004
              human xenobiotic metabolite 15214
                androsta-1,4,6-triene-3,17-dione 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22210
    subatomic particle 22202
      composite particle 22202
        hadron 22202
          baryon 22202
            nucleon 22202
              atomic nucleus 22202
                atom 22202
                  main group element atom 22136
                    p-block element atom 22136
                      carbon group element atom 21936
                        carbon atom 21861
                          organic molecular entity 21861
                            heteroorganic entity 21517
                              organochalcogen compound 21006
                                organooxygen compound 20847
                                  carbonyl compound 20213
                                    ketone 17975
                                      oxo steroid 10671
                                        3-oxo steroid 10000
                                          3-oxo-Delta(1) steroid 5279
                                            3-oxo-Delta(1),Delta(4)-steroid 5279
                                              androsta-1,4,6-triene-3,17-dione 0
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