CHEBI:139558 - 1-O-(5,6-epoxyretinoyl)-β-D-glucuronic acid

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ChEBI Name 1-O-(5,6-epoxyretinoyl)-β-D-glucuronic acid ChEBI ID CHEBI:139558 ChEBI ASCII Name 1-O-(5,6-epoxyretinoyl)-beta-D-glucuronic acid Definition A retinoid that is 5,6-epoxyretinoic acid in which the carboxy proton has been replaced by a β-D-glucuronyl residue. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C26H36O9 Net Charge 0 Average Mass 492.560 Monoisotopic Mass 492.23593 InChI InChI=1S/C26H36O9/c1-15(10-13-26-24(3,4)11-7-12-25(26,5)35-26)8-6-9-16(2)14-17(27)33-23-20(30)18(28)19(29)21(34-23)22(31)32/h6,8-10,13-14,18-21,23,28-30H,7,11-12H2,1-5H3,(H,31,32)/b9-6+,13-10+,15-8+,16-14+/t18-,19-,20+,21-,23+,25?,26?/m0/s1 InChIKey BZPOQLONXBJGAZ-WSPRJJCZSA-N SMILES C12(C(CCCC1(C)O2)(C)C)/C=C/C(=C/C=C/C(=C/C(O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)=O)/C)/C Metabolite of Species Details Rattus norvegicus (NCBI:txid10116) See: PubMed Roles Classification Biological Role(s): rat metabolite Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus). View more via ChEBI Ontology ChEBI Ontology Outgoing 1-O-(5,6-epoxyretinoyl)-β-D-glucuronic acid (CHEBI:139558) has functional parent 5,6-epoxyretinoic acid (CHEBI:80658) 1-O-(5,6-epoxyretinoyl)-β-D-glucuronic acid (CHEBI:139558) has role rat metabolite (CHEBI:86264) 1-O-(5,6-epoxyretinoyl)-β-D-glucuronic acid (CHEBI:139558) is a β-D-glucosiduronic acid (CHEBI:15341) 1-O-(5,6-epoxyretinoyl)-β-D-glucuronic acid (CHEBI:139558) is a epoxide (CHEBI:32955) 1-O-(5,6-epoxyretinoyl)-β-D-glucuronic acid (CHEBI:139558) is a retinoid (CHEBI:26537) 1-O-(5,6-epoxyretinoyl)-β-D-glucuronic acid (CHEBI:139558) is conjugate acid of 1-O-(5,6-epoxyretinoyl)-β-D-glucuronate (CHEBI:139184) Incoming 1-O-(5,6-epoxyretinoyl)-β-D-glucuronate (CHEBI:139184) is conjugate base of 1-O-(5,6-epoxyretinoyl)-β-D-glucuronic acid (CHEBI:139558) Synonyms Sources 1-O-(5,6-epoxyretinoyl)-β-D-glucuronide ChEBI 1-O-(all-trans-5,6-epoxyretinoyl)-β-D-glucuronic acid ChEBI 1-O-(all-trans-5,6-epoxyretinoyl)-β-D-glucuronide ChEBI 1-O-[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)nona-2,4,6,8-tetraenoyl]-β-D-glucopyranuronic acid ChEBI 5,6-epoxyretinoic acid glucuronide ChEBI 5,6-epoxyretinoyl beta-glucuronide ChEBI 5,6-Epoxyretinoyl glucuronide ChemIDplus all-trans-5,6-epoxyretinoic acid glucuronide ChEBI Registry Numbers Types Sources 24291587 Reaxys Registry Number Reaxys 81164-05-8 CAS Registry Number ChemIDplus Citations Types Sources 10702251 PubMed citation Europe PMC 7082654 PubMed citation Europe PMC Last Modified 01 February 2018