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ONTOLOGY REPORT - ANNOTATIONS


Term:3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid
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Accession:CHEBI:18402 term browser browse the term
Definition:A steroid acid that is 5beta-cholestan-26-oic acid which is substituted by hydroxy groups as the 3alpha, 7alpha, and 12alpha positions.
Synonyms:related_synonym: (3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxycholestan-26-oic acid;   3,7,12-trihydroxycholestan-26-oic acid;   Formula=C27H46O5;   InChI=1S/C27H46O5/c1-15(6-5-7-16(2)25(31)32)19-8-9-20-24-21(14-23(30)27(19,20)4)26(3)11-10-18(28)12-17(26)13-22(24)29/h15-24,28-30H,5-14H2,1-4H3,(H,31,32)/t15-,16?,17+,18-,19-,20+,21+,22-,23+,24+,26+,27-/m1/s1;   InChIKey=CNWPIIOQKZNXBB-VCVMUKOKSA-N;   SMILES=C[C@H](CCCC(C)C(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C;   coprocholic acid
 alt_id: CHEBI:11897;   CHEBI:11898;   CHEBI:1698;   CHEBI:20219;   CHEBI:20220
 xref: Beilstein:5384623 "Beilstein";   CAS:547-98-8 "ChemIDplus";   CAS:547-98-8 "KEGG COMPOUND";   HMDB:HMDB0000601;   HMDB:HMDB0003873;   KEGG:C04722;   LIPID_MAPS_instance:LMST04030001 "LIPID MAPS";   Reaxys:5384623 "Reaxys"
 cyclic_relationship: is_conjugate_acid_of CHEBI:85674


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Term Annotations click to browse term
  CHEBI ontology 19716
    chemical entity 19714
      atom 19712
        nonmetal atom 19585
          carbon atom 19480
            organic molecular entity 19480
              organic acid 17947
                steroid acid 870
                  3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid 0
                    (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid 0
                    (25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid 0
                    3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA + 0
                    S-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl)-4'-phosphopantetheine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19716
    subatomic particle 19712
      composite particle 19712
        hadron 19712
          baryon 19712
            nucleon 19712
              atomic nucleus 19712
                atom 19712
                  main group element atom 19598
                    p-block element atom 19598
                      carbon group element atom 19486
                        carbon atom 19480
                          organic molecular entity 19480
                            organic group 18407
                              organic divalent group 18397
                                organodiyl group 18397
                                  carbonyl group 18285
                                    carbonyl compound 18285
                                      carboxylic acid 17940
                                        hydroxy carboxylic acid 3595
                                          hydroxy monocarboxylic acid 3595
                                            3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid 0
                                              (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid 0
                                              (25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid 0
                                              3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA + 0
                                              S-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl)-4'-phosphopantetheine 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.