Atorvastatin Methyl Ester

Analyte Name

Atorvastatin Methyl Ester

CAS Number

345891-62-5

Molecular Formula

C34 H37 F N2 O5

Molecular Weight

572.67

Accurate Mass

572.2687

Flash Point

-20

SMILES

COC(=O)C[C@H](O)C[C@H](O)CCn1c(C(C)C)c(C(=O)Nc2ccccc2)c(c3ccccc3)c1c4ccc(F)cc4

InChI

InChI=1S/C34H37FN2O5/c1-22(2)32-31(34(41)36-26-12-8-5-9-13-26)30(23-10-6-4-7-11-23)33(24-14-16-25(35)17-15-24)37(32)19-18-27(38)20-28(39)21-29(40)42-3/h4-17,22,27-28,38-39H,18-21H2,1-3H3,(H,36,41)/t27-,28-/m1/s1

IUPAC

methyl (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Atorvastatin Calcium

Purity

>95% (HPLC)