4-Hydroxy Propranolol Beta-D-Glucuronide (Mixture of Diastereomers)
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- structure.search.product.name 4-Hydroxy Propranolol Beta-D-Glucuronide (Mixture of Diastereomers)
- Product Code: TRC-H952535-1MG
- CAS Number: 94731-13-2
- Brand: TRC
Product Overview
Product Code
TRC-H952535-1MG
CAS Number
Product Format
Neat
Molecular Formula
C22 H29 N O9
Molecular Weight
451.47
API Family
PropranololProduct Categories
TRC, Additional endogenous metabolites, Impurity Reference Materials
Drug Type
Cardiac Drugs
Documentation
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Product Information
Chemical Data
Analyte Name
4-Hydroxy Propranolol beta-D-Glucuronide
CAS Number
94731-13-2
Molecular Formula
C22 H29 N O9
Molecular Weight
451.47
Accurate Mass
451.1842
SMILES
CC(C)NCC(O)COc1ccc(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)c3ccccc13
InChI
InChI=1S/C22H29NO9/c1-11(2)23-9-12(24)10-30-15-7-8-16(14-6-4-3-5-13(14)15)31-22-19(27)17(25)18(26)20(32-22)21(28)29/h3-8,11-12,17-20,22-27H,9-10H2,1-2H3,(H,28,29)/t12?,17-,18-,19+,20-,22+/m0/s1
IUPAC
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]naphthalen-1-yl]oxyoxane-2-carboxylic acid
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Impurity; Metabolite
Product Format
Neat
API Family
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