2-Hydroxy Atorvastatin-D5 Acetonide tert-Butyl Ester

Product Name 2-Hydroxy Atorvastatin-D5 Acetonide tert-Butyl Ester
Alternate Names Atorvastatin Stable Isotopes, Stable Isotopes of Atorvastatin
CAT No. CS-T-54902
CAS No. 265989-42-2
Category Stable Isotopes
Stock Enquire
Mol. Wt. Not Available
Mol. For. Not Available
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Atorvastatin
Therapeutic Anti-Diabetic
Canonical Smiles CC(C)C1=C(C(=C(N1CCC2CC(OC(O2)(C)C)CC(=O)OC(C)(C)C)C3=CC=C(C=C3)F)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5O
InchIKey OZJAGODXZFIYDA-REWGUOJHSA-N
Inchl InChI=1S/C40H47FN2O6/c1-25(2)36-35(38(46)42-31-15-11-12-16-32(31)44)34(26-13-9-8-10-14-26)37(27-17-19-28(41)20-18-27)43(36)22-21-29-23-30(48-40(6,7)47-29)24-33(45)49-39(3,4)5/h8-20,25,29-30,44H,21-24H2,1-7H3,(H,42,46)/t29-,30-/m1/s1/i8D,9D,10D,13D,14D
IUPAC tert-butyl 2-[(4R,6R)-6-[2-[2-(4-fluorophenyl)-4-[(2-hydroxyphenyl)carbamoyl]-3-(2,3,4,5,6-pentadeuteriophenyl)-5-propan-2-ylpyrrol-1-yl]ethyl]-2,2-dimethyl-1,3-dioxan-4-yl]acetate
Controlled No
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2-Hydroxy Atorvastatin-D5 Acetonide tert-Butyl Ester is a chemical compound that is used in the pharmaceutical industry as a starting material for the synthesis of Atorvastatin, a well-known cholesterol-lowering medication. This compound is a deuterated derivative of Atorvastatin that is specifically designed for use in pharmacokinetic studies, as it allows researchers to track the movement and metabolism of Atorvastatin in the body more accurately. The chemical formula of 2-Hydroxy Atorvastatin-D5 Acetonide tert-Butyl Ester is C39H47D5NO5, and it has a molecular weight of 639.88 g/mol. It is a white to off-white powder that is soluble in organic solvents such as methanol, ethanol, and dimethyl sulfoxide (DMSO). The compound is typically synthesized using a series of chemical reactions, beginning with the reaction of Atorvastatin with tert-butyl acetate and acetic anhydride to form the acetonide derivative. This is followed by the introduction of deuterium atoms at specific positions using deuterated reagents, resulting in the final product of 2-Hydroxy Atorvastatin-D5 Acetonide tert-Butyl Ester. Overall, the compound is an important tool for pharmacological research, as it enables scientists to better understand the mechanisms of action and metabolism of Atorvastatin, and potentially develop more effective treatments for cholesterol-related conditions.

Related Compounds

Atorvastatin D5 | Atorvastatin sodium salt 13C6 | Atorvastatin D5 calcium | Atorvastatin-d5 (N-(phenyl-d5) Lactone | p-Hydroxyatorvastatin 13C6 | Atorvastatin D5 sodium | Atorvastatin D5 4-(phenyl-d5) Lactone |

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