(2Z)-2,3-Dehydroxy Atorvastatin (>90% Z)

CAS: 1191901-60-6

Ref. TR-D230043

Product Information

• Name: (2Z)-2,3-Dehydroxy Atorvastatin (>90% Z)
• Synonyms: 2-Heptenoic acid, 7-[2-(4-fluorophenyl)-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrol-1-yl]-5-hydroxy-, (2Z,5S)-
• Brand: TRC
• Description: Applications (2Z)-2,3-Dehydroxy Atorvastatin is an intermediate in synthesizing (2E)-2,3-Dehydroxy Atorvastatin (D230045), which is an impurity in the synthesis of Atorvastatin (A791750).References Kearney, A.S., et al.: Pharm. Res., 10, 1461 (1993); Heinonen, T.M., et al.: Clin. Ther., 18, 853 (1996)

Chemical properties

• Molecular weight: 540.62
• Formula: C₃₃H₃₃FN₂O₄
• Color/Form: Neat
• InChI: InChI=1S/C33H33FN2O4/c1-22(2)31-30(33(40)35-26-12-7-4-8-13-26)29(23-10-5-3-6-11-23)32(24-16-18-25(34)19-17-24)36(31)21-20-27(37)14-9-15-28(38)39/h3-13,15-19,22,27,37H,14,20-21H2,1-2H3,(H,35,40)(H,38,39)/b15-9-/t27-/m0/s1
• InChI key: InChIKey=MBPXXTUUUBBIRF-SPEKIDPZSA-N
• SMILES: CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C/C=C\C(=O)O