Chemical Compound

Atorvastatin magnesium trihydrate

CAS Registry Number 1035609-19-8
Atorvastatin magnesium trihydrate chemical structure
Primary Record

Atorvastatin magnesium trihydrate

In stock
5,996 g
Purity
98.2 %
CAS
1035609-19-8

Compound Identifiers & Properties

CAS
1035609-19-8
PubChem CID
24849182
SMILES
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.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.O.O.O.[Mg+2]
Canonical SMILES
CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)[O-].CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)[O-].O.O.O.[Mg+2]

Names & Synonyms

  • Atorvastatin magnesium trihydrate
  • UNII-S40X654V9C
  • RefChem:115449
  • S40X654V9C
  • DTXSID20145902
  • Atorvastatin magnesium trihydrate [WHO-DD]
  • DTXCID2068393
  • 1035609-19-8
  • Q27288555
  • Magnesium, bis((betaR,deltaR)-2-(4-fluorophenyl)-beta-(hydroxy-kappao)-delta-hydroxy-5-(1-methylethyl)-3-phenyl-4-((phenylamino)carbonyl)-1H-pyrrole-1-heptanoato-kappao1)-, hydrate (1:3), (t-4)-
  • MAGNESIUM, BIS((.BETA.R,.DELTA.R)-2-(4-FLUOROPHENYL)-.BETA.-(HYDROXY-.KAPPA.O)-.DELTA.-HYDROXY-5-(1-METHYLETHYL)-3-PHENYL-4-((PHENYLAMINO)CARBONYL)-1H-PYRROLE-1-HEPTANOATO-.KAPPA.O1)-, HYDRATE (1:3), (T-4)-
  • Magnesium (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate--water (1/2/3)