Term: | 9-cis-retinoyl-beta-D-glucuronide |
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Accession: | CHEBI:172945
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Definition: | A retinoid that is 9-cis-retinoic acid in which the carboxy proton has been replaced by a beta-D-glucuronyl group. It is a major metabolite of 9-cis-retinoic acid. |
Synonyms: | exact_synonym: | (9cis)-O(15)-[(2S,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl]retinoic acid |
| related_synonym: | (9Z)-retinoic acid beta-D-glucopyranuronosyl ester; (9Z)-retinoyl-beta-D-glucuronide; (9Z)-retinoyl-beta-D-glucuronopyranoside; (9cis)-O(15)-[(2S,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]retinoic acid; 1-O-(9-cis-retinoyl)-beta-D-glucuronic acid; Formula=C26H36O8; InChI=1S/C26H36O8/c1-15(11-12-18-17(3)10-7-13-26(18,4)5)8-6-9-16(2)14-19(27)33-25-22(30)20(28)21(29)23(34-25)24(31)32/h6,8-9,11-12,14,20-23,25,28-30H,7,10,13H2,1-5H3,(H,31,32)/b9-6+,12-11+,15-8-,16-14+/t20-,21-,22+,23-,25+/m0/s1; InChIKey=MTGFYEHKPMOVNE-RDMMYANXSA-N; SMILES=C\\C(\\C=C\\C1=C(C)CCCC1(C)C)=C\\C=C\\C(\\C)=C\\C(=O)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O |
| xref: | CAS:153321-67-6; Chemspider:8132266; PMID:10064560; PMID:8295481; PMID:8891912 |
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