Products 1105067-88-6

CAS 1105067-88-6 appears in our catalog under these names: Atorvastatin Impurity 25(Atorvastatin EP Impurity E Calcium Salt), (3S,5S)-Atorvastatin Calcium Salt, >95% (HPLC), (3S,5S)-7-(2-(4-Fluorophenyl)-5-(1-methylethyl)-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoic Acid Calcium Salt (ent-Atorvastatin Calcium 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). Offered by: Hubei YoungXin, TRC, Mikromol, Biosynth. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 200mg, 1mg, 0,01g, 0,005g.

Structural formula: {0} (CAS {1})

Calcium bis((3S,5S)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate) (CAS 1105067-88-6) is a chemical compound with the molecular formula C66H68CaF2N4O10 and a molecular weight of 1155.3 g/mol. IUPAC name: calcium bis((3S,5S)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate). InChIKey: FQCKMBLVYCEXJB-XOOYZFGPSA-L.

Identity
Molecular formulaC66H68CaF2N4O10
Molecular weight1155.3 g/mol
IUPAC namecalcium bis((3S,5S)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate)
InChIKeyFQCKMBLVYCEXJB-XOOYZFGPSA-L
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.CC(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.[Ca+2]

Computed by PubChem (NCBI)