Send us a Message



Submit Data |  Help |  Video Tutorials |  News |  Publications |  Download |  REST API |  Citing RGD |  Contact   

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:calcitriol 25-O-(beta-D-glucuronide)
go back to main search page
Accession:CHEBI:139600 term browser browse the term
Definition:A steroid glucosiduronic acid that is calcitriol in which the hydroxy hydrogen at position 25 has been replaced by a beta-D-glucuronyl residue.
Synonyms:exact_synonym: (6R)-6-[(1R,3aS,4E,7aR)-4-{(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene}-7a-methyloctahydro-1H-inden-1-yl]-2-methylheptan-2-yl beta-D-glucopyranosiduronic acid
 related_synonym: (1S,3R,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-1,3-diol-25-yl beta-D-glucopyranosiduronic acid;   1alpha,25-dihydroxyvitamin D3 25-O-(beta-D-glucuronic acid);   1alpha,25-dihydroxyvitamin D3 25-O-(beta-D-glucuronide);   Formula=C33H52O9;   InChI=1S/C33H52O9/c1-18(8-6-14-32(3,4)42-31-28(38)26(36)27(37)29(41-31)30(39)40)23-12-13-24-20(9-7-15-33(23,24)5)10-11-21-16-22(34)17-25(35)19(21)2/h10-11,18,22-29,31,34-38H,2,6-9,12-17H2,1,3-5H3,(H,39,40)/b20-10+,21-11-/t18-,22-,23-,24+,25+,26+,27+,28-,29+,31+,33-/m1/s1;   InChIKey=UBEXJJQDSPZXNL-BHNPUNFPSA-N;   SMILES=C1[C@]2([C@](/C(=C/C=C/3\\C([C@H](C[C@@H](C3)O)O)=C)/CC1)(CC[C@@]2([C@H](C)CCCC(O[C@@H]4O[C@@H]([C@H]([C@@H]([C@H]4O)O)O)C(=O)O)(C)C)[H])[H])C;   calcitriol 25-O--(beta-D-glucuronic acid);   calcitriol 25-O-glucoronide;   calcitriol 25-beta-glucuronide;   calcitriol 25-glucuronide
 xref: PMID:18177842
 cyclic_relationship: is_conjugate_acid_of CHEBI:139274



show annotations for term's descendants           Sort by:

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19834
    role 19810
      biological role 19808
        immunomodulator 15053
          calcitriol 2427
            calcitriol 25-O-(beta-D-glucuronide) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19834
    subatomic particle 19832
      composite particle 19832
        hadron 19832
          baryon 19832
            nucleon 19832
              atomic nucleus 19832
                atom 19832
                  main group element atom 19782
                    p-block element atom 19782
                      carbon group element atom 19730
                        carbon atom 19727
                          organic molecular entity 19727
                            heteroorganic entity 19484
                              organochalcogen compound 19243
                                organooxygen compound 19158
                                  carbohydrates and carbohydrate derivatives 15276
                                    carbohydrate 15276
                                      carbohydrate derivative 14282
                                        glycosyl compound 13042
                                          glycoside 11827
                                            glycosiduronic acid 190
                                              glucosiduronic acid 190
                                                beta-D-glucosiduronic acid 47
                                                  calcitriol 25-O-(beta-D-glucuronide) 0
paths to the root