Sertraline Carbamoyl Glucuronide
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- structure.search.product.name Sertraline Carbamoyl Glucuronide
- Product Code: TRC-S279990
- CAS Number: 119733-44-7
- Brand: TRC
Product Overview
Product Code
TRC-S279990
CAS Number
Product Format
Neat
Molecular Formula
C24 H25 Cl2 N O8
Molecular Weight
526.36
API Family
Sertraline HydrochlorideProduct Categories
TRC - Toronto Research Chemicals, Additional endogenous metabolites, Impurity Reference Materials
Product Type
ImpurityDocumentation
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Product Information
Chemical Data
Analyte Name
Sertraline Carbamoyl Glucuronide
CAS Number
119733-44-7
Molecular Formula
C24 H25 Cl2 N O8
Molecular Weight
526.36
Accurate Mass
525.0957
SMILES
CN([C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c3ccccc13)C(=O)O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(=O)O
InChI
InChI=1S/C24H25Cl2NO8/c1-27(24(33)35-23-20(30)18(28)19(29)21(34-23)22(31)32)17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(25)16(26)10-11/h2-6,8,10,12,17-21,23,28-30H,7,9H2,1H3,(H,31,32)/t12-,17-,18-,19-,20+,21-,23-/m0/s1
IUPAC
(2S,3S,4S,5R,6S)-6-[[(1S,4S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]-methylcarbamoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Impurity
Product Format
Neat
API Family
Product Description
The major metabolite of the antidepressant Sertraline.
References: Myers, C.E., et al.: Pharmacol. Rev., 33, 1 (1981), Bosslet, K., et al.: Cancer Res., 58, 1195 (1998), Tremaine et. al.: Drug Metabolism and Disposition 17, 542 (1989)
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