2-Hydroxy Atorvastatin-d5 Sodium Salt
Product Code
TRC-H828952
CAS Number
Product Format
Neat
Molecular Formula
C33 2H5 H28 F N2 O6 . 2 Na
Molecular Weight
623.63
API Family
AtorvastatinProduct Categories
Chiral Molecules , TRC, Statins and related drugs, API Reference Standards & Research Materials, Impurity Reference Materials , Statins and related drugs, Stable isotopes, Stable Isotope Labelled Analytical Standards
Alternate CAS Number
Unlabelled CAS Number
Purity
>95% (HPLC)
Documentation
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Product Information
Chemical Data
Analyte Name
o-Hydroxy Atorvastatin, phenyl-d5, Disodium Salt
CAS Number
1276537-19-9
Molecular Formula
C33 2H5 H28 F N2 O6 . 2 Na
Molecular Weight
623.63
Accurate Mass
623.2432
SMILES
[Na+].[Na+].[2H]c1c([2H])c([2H])c(c([2H])c1[2H])c2c(C(=O)Nc3ccccc3[O-])c(C(C)C)n(CC[C@@H](O)C[C@@H](O)CC(=O)[O-])c2c4ccc(F)cc4
InChI
InChI=1S/C33H35FN2O6.2Na/c1-20(2)31-30(33(42)35-26-10-6-7-11-27(26)39)29(21-8-4-3-5-9-21)32(22-12-14-23(34)15-13-22)36(31)17-16-24(37)18-25(38)19-28(40)41;;/h3-15,20,24-25,37-39H,16-19H2,1-2H3,(H,35,42)(H,40,41);;/q;2*+1/p-2/t24-,25-;;/m1../s1/i3D,4D,5D,8D,9D;;
IUPAC
disodium;(3R,5R)-7-[2-(4-fluorophenyl)-4-[(2-oxidophenyl)carbamoyl]-3-(2,3,4,5,6-pentadeuteriophenyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate
Alternate CAS Number
Disodium salt: 1276537-19-9
Unlabelled CAS Number
Free acid: 214217-86-4
SIL Type
Deuterium
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Stable Isotope Labelled; Metabolite; API
Product Format
Neat
API Family
Purity
>95% (HPLC)
Product Description
A deuterated metabolite of Atorvastatin, a selective, competitive HMG-CoA reductase inhibitor. Atorvastatin is the only drug in its class specfically indicated for lowering both elevated LDL-cholesterol and triglycerides in patients with hypercholesterolemia.
References: Smith, S., et al.: Am. J. Cardiol., 80, 10H
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