3'-O-Methyl Quercetin 3-O-beta-D-Glucuronide

cas: 36687-76-0 — see every product listed under this CAS number, including other names

3'-O-Methyl Quercetin 3-O-beta-D-Glucuronide (CAS 36687-76-0) is a chemical reagent available from Chemat. Available pack sizes: on request, 100mg. Offered by: Chemat Brand, TRC.

brandChemat Brand
catalog numberULQ0517
cas36687-76-0
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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categoryChemicals
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Structural formula: {0} (CAS {1})

Isorhamnetin 3-glucuronide is a glucosiduronic acid and a member of flavonoids.

Source: ChEBI

Identity
Molecular formulaC22H20O13
Molecular weight492.4 g/mol
IUPAC name(2S,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyVVZWHOMBDMMRSC-NTKSAMNMSA-N
SMILESCOC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Isorhamnetin 3-glucuronide, Isorhamnetin-3-glucuronide, Isorhamnetin 3-glucuronoside, Isorhamnetin 3-O-beta-D-glucuronide, Isorhamnetin 3-O-glucuronide, 3'-O-Methyl Quercetin 3-O-beta-D-Glucuronide, 3'-O-Methyl Quercetin 3-O-?-D-Glucuronide, Isorhamnetin glucuronide, Isorhamnetin 3-O-beta-D-glucuronopyranoside, Isorhamnetin-3-O-glucuronide
Isomers (same molecular formula)
3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-7-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-2-carboxylic acid C22H20O13
(2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-3-methoxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid C22H20O13
3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-2-carboxylic acid C22H20O13
6-hydroxy-7,14-dimethoxy-13-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione C22H20O13
3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-2-carboxylic acid C22H20O13
methyl (2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate C22H20O13

Also listed as

Isorhamnetin 3-glucuronide MedChemExpress CAS 36687-76-0