(R,S)-Equol 7-beta-D-Glucuronide Sodium Salt
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- structure.search.product.name (R,S)-Equol 7-beta-D-Glucuronide Sodium Salt
- Product Code: TRC-E593005
- Brand: TRC
Product Overview
Product Code
TRC-E593005
Product Format
Neat
Molecular Formula
C21 H21 O9 . Na
Molecular Weight
440.38
API Family
DaidzeinProduct Categories
Product Type
MetaboliteAlternate CAS Number
(S)-isomer free acid: 38482-82-5; (R)-isomer free acid: 428438-41-9
Purity
>95% (HPLC)
Documentation
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Product Information
Chemical Data
Analyte Name
(R,S)-Equol 7-beta-D-Glucuronide sodium salt
Molecular Formula
C21 H21 O9 . Na
Molecular Weight
440.38
Accurate Mass
440.1083
SMILES
[Na+].O[C@H]1[C@H](Oc2ccc3CC(COc3c2)c4ccc(O)cc4)O[C@@H]([C@@H](O)[C@@H]1O)C(=O)[O-]
InChI
InChI=1S/C21H22O9.Na/c22-13-4-1-10(2-5-13)12-7-11-3-6-14(8-15(11)28-9-12)29-21-18(25)16(23)17(24)19(30-21)20(26)27;/h1-6,8,12,16-19,21-25H,7,9H2,(H,26,27);/q;+1/p-1/t12?,16-,17-,18+,19-,21+;/m0./s1
IUPAC
sodium;(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenyl)chroman-7-yl]oxy-tetrahydropyran-2-carboxylate
Alternate CAS Number
(S)-isomer free acid: 38482-82-5; (R)-isomer free acid: 428438-41-9
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat
API Family
Purity
>95% (HPLC)