For research use only. Not for therapeutic Use.
Atorvastatin Methyl Ester(cas 345891-62-5) is a impurity of API Atorvastatin.
| Catalog Number | R012666 |
| CAS Number | 345891-62-5 |
| Synonyms | (βR,δR)-2-(4-Fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic Acid Methyl Ester; |
| Molecular Formula | C34H37FN2O5 |
| Purity | ≥95% |
| Storage | -20°C |
| IUPAC Name | methyl (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate |
| 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 |
| InChIKey | IRKGCTGBOBRSMG-VSGBNLITSA-N |
| SMILES | CC(C)C1=C(C(=C(N1CCC(CC(CC(=O)OC)O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4 |
| Reference | (1) Stach, Jan; Collection of Czechoslovak Chemical Communications 2008, V73(2), P229-246 |
