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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:1alpha,2beta,25-trihydroxy vitamin D3
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Accession:CHEBI:87395 term browser browse the term
Definition:A hydroxy seco-steroid that is calciol carrying three additional hydroxy substituents at positions 1alpha, 2beta and 25.
Synonyms:exact_synonym: (1R,2R,3R,5Z,7E)-9,10-secocholesta-5,7,10-triene-1,2,3,25-tetrol
 related_synonym: 1alpha,2beta,25(OH)3D3;   1alpha,2beta,25-(OH)3 cholecalciferol;   1alpha,2beta,25-(OH)3 vitamin D3;   1alpha,2beta,25-trihydroxycholecalciferol;   Formula=C27H44O4;   InChI=1S/C27H44O4/c1-17(8-6-14-26(3,4)31)21-12-13-22-19(9-7-15-27(21,22)5)10-11-20-16-23(28)25(30)24(29)18(20)2/h10-11,17,21-25,28-31H,2,6-9,12-16H2,1,3-5H3/b19-10+,20-11-/t17-,21-,22+,23-,24-,25-,27-/m1/s1;   InChIKey=JGIYYEHLYUOKSD-FQKVRLMOSA-N;   SMILES=C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\\C(CCC[C@]12C)=C\\C=C1\\C[C@@H](O)[C@@H](O)[C@H](O)C1=C
 xref: Reaxys:8957905



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Term Annotations click to browse term
  CHEBI ontology 19917
    role 19887
      biological role 19885
        molecular messenger 18690
          hormone 18509
            steroid hormone 7897
              1alpha,2beta,25-trihydroxy vitamin D3 0
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  CHEBI ontology 19917
    subatomic particle 19915
      composite particle 19915
        hadron 19915
          baryon 19915
            nucleon 19915
              atomic nucleus 19915
                atom 19915
                  main group element atom 19855
                    p-block element atom 19855
                      carbon group element atom 19794
                        carbon atom 19790
                          organic molecular entity 19790
                            organic molecule 19743
                              organic cyclic compound 19533
                                organic polycyclic compound 17307
                                  steroid 14723
                                    hydroxy steroid 14469
                                      hydroxy seco-steroid 2703
                                        vitamin D 2698
                                          D3 vitamins 2645
                                            calciol 2645
                                              1alpha,2beta,25-trihydroxy vitamin D3 0
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