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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 57831776Generated: November 3, 2026

(δS)-2-(4-Fluorophenyl)-δ-hydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid

5-Dehydroxy (3S)-Atorvastatin · 1H-Pyrrole-1-heptanoic acid, 2-(4-fluorophenyl)-δ-hydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-, (δS)-

https://huagongshe.com/en/chemical/57831776

(δS)-2-(4-Fluorophenyl)-δ-hydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid molecular structure

Identifiers & Physical Properties

CAS No.887196-26-1
Molecular formulaC33H35FN2O4
Average molar mass542.651 g/mol
Monoisotopic mass542.25808582 g/mol
SMILESCC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)CCCC(=O)O
InChIKeyFXHZSTVKUASKCJ-MHZLTWQESA-N
PubChem CID57831776
DTXSIDDTXSID701106862

Chemical & Physical Properties

Boiling point675.2±55.0 °C(Predicted)
Density1.19±0.1 g/cm3(Predicted)
pKa (acidity coefficient)4.68±0.10(Predicted)

Applications & Uses

Uses

5-Dehydroxy (3S)-Atorvastatin is an impurity of Atorvastatin (A791750), which is a drug used for lowering both elevated LDL-cholesterol and triglyceinhibitorrides in patients with hypercholesterolemia. Atorvastatin is a selective, competitive HMG-CoA reductase inhibitor.