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ONTOLOGY REPORT - ANNOTATIONS


Term:3,7,12-trioxo-5beta-cholanic acid
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Accession:CHEBI:31459 term browser browse the term
Definition:An oxo-5beta-cholanic acid in which three oxo substituents are located at positions 3, 7 and 12 on the cholanic acid skeleton.
Synonyms:exact_synonym: 3,7,12-trioxo-5beta-cholan-24-oic acid
 related_synonym: 3,7,12-Triketo-5beta-cholanoic acid;   3,7,12-triketocholanic acid;   3,7,12-trioxocholanic acid;   Decholin;   Dehydrocholic acid;   Formula=C24H34O5;   InChI=1S/C24H34O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29)/t13-,14+,16-,17+,18+,22+,23+,24-/m1/s1;   InChIKey=OHXPGWPVLFPUSM-KLRNGDHRSA-N;   SMILES=[H][C@@]12CC(=O)CC[C@]1(C)[C@@]1([H])CC(=O)[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])C(=O)C2)[C@H](C)CCC(O)=O
 xref: AGR:IND44696467 "Europe PMC";   Beilstein:3226734 "ChemIDplus";   CAS:81-23-2 "ChemIDplus";   CAS:81-23-2 "KEGG COMPOUND";   Drug_Central:794 "DrugCentral";   Gmelin:1109714 "Gmelin";   KEGG:C13154;   KEGG:D01693;   LINCS:LSM-5960;   LIPID_MAPS_instance:LMST04010106 "LIPID MAPS"
 xref_mesh: MESH:D003685
 xref: PMCID:PMC3716435 "Europe PMC";   PMID:17604970 "Europe PMC";   PMID:18507070 "Europe PMC";   PMID:18613358 "Europe PMC";   PMID:19102397 "Europe PMC";   PMID:19734023 "Europe PMC";   PMID:21181147 "Europe PMC";   PMID:22153852 "Europe PMC";   PMID:22237952 "Europe PMC";   PMID:22581067 "Europe PMC";   PMID:22806613 "Europe PMC";   PMID:22899496 "Europe PMC";   PMID:23130230 "Europe PMC";   PMID:23315150 "Europe PMC";   PMID:25641915 "Europe PMC";   PMID:26849336 "Europe PMC";   Reaxys:3226734 "Reaxys"
 cyclic_relationship: is_conjugate_acid_of CHEBI:137881


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3,7,12-trioxo-5beta-cholanic acid term browser
Symbol Object Name JBrowse Chr Start Stop Reference
G Dhrs11 dehydrogenase/reductase 11 JBrowse link 10 72,144,042 72,153,496 RGD:6480464

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Term Annotations click to browse term
  CHEBI ontology 19754
    role 19701
      application 19353
        pharmaceutical 19222
          drug 19222
            gastrointestinal drug 263
              3,7,12-trioxo-5beta-cholanic acid 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19754
    subatomic particle 19752
      composite particle 19752
        hadron 19752
          baryon 19752
            nucleon 19752
              atomic nucleus 19752
                atom 19752
                  main group element atom 19637
                    p-block element atom 19637
                      carbon group element atom 19528
                        carbon atom 19517
                          organic molecular entity 19517
                            organic molecule 19436
                              organic cyclic compound 19199
                                organic polycyclic compound 16041
                                  steroid 12801
                                    steroid fundamental parent 12418
                                      cholane 873
                                        cholanoid 873
                                          cholanic acids 873
                                            cholanic acid 873
                                              5beta-cholanic acid 873
                                                oxo-5beta-cholanic acid 7
                                                  3,7,12-trioxo-5beta-cholanic acid 1
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