Atorvastatin Impurity 153

cas: 110862-48-1 — see every product listed under this CAS number, including other names

Atorvastatin Impurity 153 (CAS 110862-48-1) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-A202353
cas110862-48-1
sizeon request
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Structural formula: {0} (CAS {1})

Atorvastatin is a dihydroxy monocarboxylic acid that is a member of the drug class known as statins, used primarily for lowering blood cholesterol and for preventing cardiovascular diseases. It has a role as a xenobiotic and an environmental contaminant. It is a member of pyrroles, a dihydroxy monocarboxylic acid, an aromatic amide, a member of monofluorobenzenes and a statin (synthetic). It is functionally related to a heptanoic acid. It is a conjugate acid of an atorvastatin(1-).

Source: ChEBI

Identity
Molecular formulaC33H35FN2O5
Molecular weight558.6 g/mol
IUPAC name(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid
InChIKeyXUKUURHRXDUEBC-KAYWLYCHSA-N
SMILESCC(C)C1=C(C(=C(N1CC[C@H](C[C@H](CC(=O)O)O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Computed by PubChem (NCBI)

Synonyms: atorvastatin, Cardyl, atorvastatina, atorvastatine, Sortis, atorvastatinum, Prevencor, Zarator, atrovastatin calcium, Hipolixan
Related forms of this compound
(3S,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid C33H35FN2O5
(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid C33H35FN2O5
7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid C33H35FN2O5
(3S,5S)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid C33H35FN2O5
(3R,5S)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid C33H35FN2O5
Isomers (same molecular formula)
(3R,5R)-7-[2-(2-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid C33H35FN2O5

Also listed as

Atorvastatin Biosynth CAS 110862-48-1
rel-(βR,δR)-2-(4-Fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid, >98.0%, >98.0% Chemat CAS 110862-48-1