Quercetin 3-O-Beta-D-Glucuronide
Product Code
TRC-Q509510
CAS Number
Product Format
Neat
Molecular Formula
C21 H18 O13
Molecular Weight
478.36
Product Categories
Product Type
MetaboliteHPLC Purity
>95%
Documentation
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Product Information
Chemical Data
Analyte Name
Quercetin-3-O-glucuronide
CAS Number
22688-79-5
Molecular Formula
C21 H18 O13
Molecular Weight
478.36
Accurate Mass
478.0747
SMILES
O[C@@H]1[C@@H](O)C(OC2=C(Oc3cc(O)cc(O)c3C2=O)c4ccc(O)c(O)c4)O[C@@H]([C@H]1O)C(=O)O
InChI
InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21?/m0/s1
IUPAC
(2S,3S,4S,5R)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat
HPLC Purity
>95%
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