Term: | calcidiol 3-O-(beta-D-glucuronide) |
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Accession: | CHEBI:139613
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Definition: | A steroid glucosiduronic acid that is calcidiol in which the hydroxy hydrogen at position 3 has been replaced by a beta-D-glucuronyl residue. |
Synonyms: | exact_synonym: | (1S,3Z)-3-[(2E)-2-{(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyloctahydro-4H-inden-4-ylidene}ethylidene]-4-methylidenecyclohexyl beta-D-glucopyranosiduronic acid |
| related_synonym: | (3S,5Z,7E)-25-hydroxy-9,10-secocholesta-5,7,10(19)-trien-3-yl beta-D-glucopyranosiduronic acid; 25(OH)D33G; 25-hydroxyvitamin D3 3-O-(beta-D-glucuronic acid); 25-hydroxyvitamin D3 3-O-(beta-D-glucuronide); 25-hydroxyvitamin D3 3-glucuronide; Formula=C33H52O8; InChI=1S/C33H52O8/c1-19-10-13-23(40-31-28(36)26(34)27(35)29(41-31)30(37)38)18-22(19)12-11-21-9-7-17-33(5)24(14-15-25(21)33)20(2)8-6-16-32(3,4)39/h11-12,20,23-29,31,34-36,39H,1,6-10,13-18H2,2-5H3,(H,37,38)/b21-11+,22-12-/t20-,23+,24-,25+,26+,27+,28-,29+,31-,33-/m1/s1; InChIKey=RYOQRDXVFJRWFJ-VIVSZJOJSA-N; SMILES=C1[C@]2([C@](/C(=C/C=C/3\\C(CC[C@@H](C3)O[C@@H]4O[C@@H]([C@H]([C@@H]([C@H]4O)O)O)C(=O)O)=C)/CC1)(CC[C@@]2([C@H](C)CCCC(C)(C)O)[H])[H])C; calcidiol 3-O-(beta-D-glucuronic acid); calcidiol 3-O-glucoronide; calcidiol 3-beta-glucuronide; calcidiol 3-glucuronide |
| xref: | PMID:24641623; PMID:28622619; Reaxys:7401269 |
| cyclic_relationship: | is_conjugate_acid_of CHEBI:139278 |
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