Account Calcium rel-(3R,5R)-7-(2-(4-fluorophenyl)-4-((4-hydroxyphenyl)carbamoyl)-5-isopropyl-3-phenyl-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate
- Catalog No. :
- ACBRGQ398
- CAS No. :
- 1263176-34-6
- Molecular Formula :
- C66H68CaF2N4O12
- Molecular Weight :
- 1187.36
IUPAC Name:calcium (3R,5R)-7-(2-(4-fluorophenyl)-4-((4-hydroxyphenyl)carbamoyl)-5-isopropyl-3-phenyl-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate
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Product Information
| Product Name | Calcium rel-(3R,5R)-7-(2-(4-fluorophenyl)-4-((4-hydroxyphenyl)carbamoyl)-5-isopropyl-3-phenyl-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate |
|---|---|
| IUPAC Name | calcium (3R,5R)-7-(2-(4-fluorophenyl)-4-((4-hydroxyphenyl)carbamoyl)-5-isopropyl-3-phenyl-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate |
| Molecular Formula | C66H68CaF2N4O12 |
| Molecular Weight | 1187.36 |
| SMILES | CC(C)C1=C(C(=O)NC2=CC=C(O)C=C2)C(C2=CC=CC=C2)=C(C2=CC=C(F)C=C2)N1CC[C@@H](O)C[C@@H](O)CC(=O)[O-].CC(C)C1=C(C(=O)NC2=CC=C(O)C=C2)C(C2=CC=CC=C2)=C(C2=CC=C(F)C=C2)N1CC[C@@H](O)C[C@@H](O)CC(=O)[O-].[Ca+2] |
| InChI Key | PYIWEMFVBXVPDU-MNSAWQCASA-L |
| Synonym | Atorvastatin 4-Hydroxy Calcium;Atorvastatin impurity 40/Atorvastatin 4-Hydroxy Calcium Salt/(3R,5R)-7-[3-(4-Hydroxyphenylcarbamoyl)-5-(4-fluorophenyl)-2-isopropyl-4-phenyl-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid calcium salt;para-Hydroxy Atorvastatin Ca salt;4-Hydroxy Atorvastatin Hemicalcium Salt (>90%);1H-Pyrrole-1-heptanoic acid, 2-(4-fluorophenyl)-β,δ-dihydroxy-4-[[(4-hydroxyphenyl)amino]carbonyl]-5-(1-methylethyl)-3-phenyl-, calcium salt (2:1), (βR,δR)-rel- |
| CAS No. | 1263176-34-6 |
Synthetic Route by SureRoute
2. ACBRGQ398 Molecular Building Block Synthetic Route
Sodium (3R,5R)-7-(2-(4-fluorophenyl)-4-((2-hydroxyphenyl)carbamoyl)-5-isopropyl-3-phenyl-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate dihydrate
Sodium (3R,5R)-7-(2-(4-fluorophenyl)-5-isopropyl-4-((2-oxidophenyl)carbamoyl)-3-phenyl-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate
(3R,5R)-7-(2-(4-Fluorophenyl)-4-((2-hydroxyphenyl)carbamoyl)-5-isopropyl-3-phenyl-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoic acid