| Term: | calcitriol 25-O-(beta-D-glucuronide) |
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| Accession: | CHEBI:139600
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| Definition: | A steroid glucosiduronic acid that is calcitriol in which the hydroxy hydrogen at position 25 has been replaced by a β-D-glucuronyl residue. |
| Synonyms: | related_synonym: | (1S,3R,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-1,3-diol-25-yl beta-D-glucopyranosiduronic acid; (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; 1alpha,25-dihydroxyvitamin D3 25-O-(beta-D-glucuronic acid); 1alpha,25-dihydroxyvitamin D3 25-O-(beta-D-glucuronide); calcitriol 25-O--(beta-D-glucuronic acid); calcitriol 25-O-glucoronide; calcitriol 25-beta-glucuronide; calcitriol 25-glucuronide |
| | xref: | pubmed:18177842 |
| | chemrof_formula: | C33H52O9 |
| | chemrof_inchi: | 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 |
| | chemrof_inchikey: | UBEXJJQDSPZXNL-BHNPUNFPSA-N |
| | chemrof_smiles: | [H][C@@]12CC[C@]([H])([C@H](C)CCCC(C)(C)O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@@]1(C)CCC/C2=CC=C1C[C@@H](O)C[C@H](O)C1=C |
| | cyclic_relationship: | has_functional_parent CHEBI:17823; is_conjugate_acid_of CHEBI:139274 |
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