CHEBI:139182 - 4-(β-D-glucopyranuronosyloxy)retinoate(2−)

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ChEBI Name 4-(β-D-glucopyranuronosyloxy)retinoate(2−) ChEBI ID CHEBI:139182 ChEBI ASCII Name 4-(beta-D-glucopyranuronosyloxy)retinoate(2-) Definition A retinoid glucosiduronic acid anion obtained by deprotonation of the carboxy groups of 4-(β-D-glucopyranuronosyloxy)retinoic acid; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Nevila Nouspikel 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 C26H34O9 Net Charge -2 Average Mass 490.544 Monoisotopic Mass 490.22138 InChI InChI=1S/C26H36O9/c1-14(7-6-8-15(2)13-19(27)28)9-10-17-16(3)18(11-12-26(17,4)5)34-25-22(31)20(29)21(30)23(35-25)24(32)33/h6-10,13,18,20-23,25,29-31H,11-12H2,1-5H3,(H,27,28)(H,32,33)/p-2/b8-6+,10-9+,14-7+,15-13+/t18?,20-,21-,22+,23-,25+/m0/s1 InChIKey LVCMXFSJTNPFHH-YUJSZCEWSA-L SMILES C=1(C(CCC(C1C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C([O-])=O)O)O)O)(C)C)/C=C/C(=C/C=C/C(=C/C([O-])=O)/C)/C ChEBI Ontology Outgoing 4-(β-D-glucopyranuronosyloxy)retinoate(2−) (CHEBI:139182) is a retinoid glucosiduronic acid anion (CHEBI:139186) 4-(β-D-glucopyranuronosyloxy)retinoate(2−) (CHEBI:139182) is conjugate base of 4-(β-D-glucopyranuronosyloxy)retinoic acid (CHEBI:84092) Incoming 4-(β-D-glucopyranuronosyloxy)retinoic acid (CHEBI:84092) is conjugate acid of 4-(β-D-glucopyranuronosyloxy)retinoate(2−) (CHEBI:139182) IUPAC Name 4-(β-D-glucopyranuronosyloxy)-15-oxidoretinal Synonyms Sources 4-(β-D-glucopyranuronosyloxy)retinoate ChEBI 4-(O-β-D-glucuronosyl)oxy-all-trans-retinoate(2−) ChEBI all-trans-4-hydroxy-4-O-(β-D-glucuronide)-retinoate UniProt all-trans-4-hydroxyretinoate 4-O-(β-D-glucuronide)(2−) ChEBI Citation Type Source 10702251 PubMed citation SUBMITTER Last Modified 16 March 2023