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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:hyocholic acid
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Accession:CHEBI:81244 term browser browse the term
Definition:A trihydroxy-5beta-cholanic acid in which the three hydroxy substituents are located at the 3alpha-, 6alpha- and 7alpha-positions.
Synonyms:related_synonym: (3alpha,5beta,6alpha,7alpha)-3,6,7-trihydroxycholan-24-oic acid;   (4R)-4-[(1S,2R,5R,7R,8R,9S,10S,11S,15R)-5,8,9-trihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanoic acid;   3alpha,6alpha,7alpha-Trihydroxy-5beta-cholan-24-oic acid;   5b-Cholanic acid-3a,6a,7a-triol;   6alpha-Hydroxychenodeoxycholic acid;   Formula=C24H40O5;   InChI=1S/C24H40O5/c1-13(4-7-19(26)27)15-5-6-16-20-17(9-11-23(15,16)2)24(3)10-8-14(25)12-18(24)21(28)22(20)29/h13-18,20-22,25,28-29H,4-12H2,1-3H3,(H,26,27)/t13-,14-,15-,16+,17+,18+,20+,21-,22+,23-,24-/m1/s1;   InChIKey=DKPMWHFRUGMUKF-KWXDGCAGSA-N;   Iocholic acid;   SMILES=C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3([C@@H]([C@@H]([C@@]2(C[C@@H](C1)O)[H])O)O)[H])(CC[C@]4([H])[C@@H](CCC(O)=O)C)[H])C)[H])C;   gamma-Muricholic acid
 xref: CAS:547-75-1;   HMDB:HMDB0000760;   KEGG:C17649;   LIPID_MAPS_instance:LMST04010064;   PMID:10370651;   PMID:10388717;   PMID:22525741;   PMID:24212143;   PMID:27634100;   PMID:3179836;   PMID:4742563;   PMID:7619860;   Reaxys:3221235;   Wikipedia:Muricholic_acid
 cyclic_relationship: is_conjugate_acid_of CHEBI:133661


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Path 1
Term Annotations click to browse term
  CHEBI ontology 26034
    role 25961
      biological role 25929
        biochemical role 25162
          metabolite 25092
            eukaryotic metabolite 24514
              animal metabolite 24055
                mammalian metabolite 24059
                  mouse metabolite 22584
                    hyocholic acid 0
                      glycohyocholic acid 0
                      hyocholic acid 24-O-(beta-D-glucuronide) 0
                      hyocholic acid 6-O-(beta-D-glucuronide) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26034
    subatomic particle 26009
      composite particle 26009
        hadron 26020
          baryon 26009
            nucleon 26009
              atomic nucleus 26009
                atom 26009
                  main group element atom 25834
                    p-block element atom 25834
                      carbon group element atom 25434
                        carbon atom 25403
                          organic molecular entity 25392
                            organic molecule 25222
                              organic cyclic compound 24274
                                organic polycyclic compound 18800
                                  steroid 15855
                                    steroid fundamental parent 15629
                                      cholane 1043
                                        cholanoid 1044
                                          cholanic acids 1026
                                            cholanic acid 1027
                                              5beta-cholanic acid 1026
                                                hydroxy-5beta-cholanic acid 1027
                                                  trihydroxy-5beta-cholanic acid 343
                                                    muricholic acids 13
                                                      hyocholic acid 0
                                                        glycohyocholic acid 0
                                                        hyocholic acid 24-O-(beta-D-glucuronide) 0
                                                        hyocholic acid 6-O-(beta-D-glucuronide) 0
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