ChemicalBook--->CAS DataBase List--->1105067-88-6

1105067-88-6

1105067-88-6 Structure

1105067-88-6 Structure
IdentificationBack Directory
[Name]

3S, 5S enantioMer of Atorvastatin CalciuM
[CAS]

1105067-88-6
[Synonyms]

USP Impurity E
Calcium (3S,5S)
-1H-pyrrol-1-yl)
ent-Atorvastatin
Atorvastatin imp E
Atorvastatin EP IMP E
Atorvastatin USP RC E
Atorvastatin calcium-3
-7-(2-(4-fluorophenyl)
Atorvastatin impurity E
Atorvastatin Enantiomer
ent-Atorvastatin Calcium
-3,5-dihydroxyheptanoate
monocalcium mono((3S,5S)-
Atorvastatin calcium VIII
Atorvastatin Impurity E(USP)
Atorvastatin Related CoMpound E
(3S,5S)-Atorvastatin Calcium Salt
Atorvastatin related impurities E
Atorvastatin Impurity E calcium salt
Atorvastatin EP Impurity E (Ca Salt)
USP Atorvastatin Related Compound E
3S,5S enantiomer-Atorvastatin calcium
Atorvastatin Impurity 79 Calcium Salt
(3S,5S)-Atorvastatin hemicalcium salt
-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)
3S, 5S enantioMer of Atorvastatin CalciuM
Atorvastatin Related Compound E (10 mg) (3S, 5S enantiomer of Atorvastatin Calcium)
"Atorvastatin corresponds to isomer Atorvastatin calcium 2020 Pharmacopoeia Impurity VIII)"
calcium:(3S,5S)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate
((3S,5S)-7-(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4- (phenylcarbamoyl)-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate) calcium(II)
(βS,δS)-2-(4-Fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic Acid Calcium Salt
(βS,δS)-2-(4-Fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid hemicalcium salt
(betaS,deltaS)-2-(4-Fluorophenyl)-beta,delta-dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid calcium salt (2:1)
Atorvastatin impurity 6/Atorvastatin EP Impurity E Calcium Salt/(3S,5S)-Atorvastatin Calcium Salt/((3S,5S)-7-(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4- (phenylcarbamoyl)-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate) Calcium Salt
[Molecular Formula]

C33H34CaFN2O5+
[MDL Number]

MFCD26142859
[MOL File]

1105067-88-6.mol
[Molecular Weight]

597.71
Chemical PropertiesBack Directory
[Melting point ]

170℃ (decomposition)
[storage temp. ]

Hygroscopic, Refrigerator, under inert atmosphere
[solubility ]

DMSO (Slightly, Sonicated), Methanol (Slightly)
[form ]

neat
[color ]

White to Off-White
[Major Application]

pharmaceutical (small molecule)
[InChIKey]

DYJKAHNDTTZSNX-QXFSHCJSNA-M
[SMILES]

c1(-c2ccccc2)c(C(=O)Nc2ccccc2)c(C(C)C)[n](CC[C@H](O)C[C@H](O)CC([O-])=O)c1-c1ccc(F)cc1.[Ca+2] |&1:24,27,r|
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319
[Precautionary statements ]

P264-P280-P305+P351+P338-P337+P313P
[WGK Germany ]

WGK 3
[HS Code ]

2933997500
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Impuritiy of Atorvaststin (A791750), a selective, competitive HMG-CoA reductase inhibitor. Atorvastatin is the only drug in its class specfically indicated for lowering both elevated LDL-cholesterol a nd triglycerides in patients with hypercholesterolemia.
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