Chemical Compound

(3S,5S)-Atorvastatin Calcium Salt

CAS Registry Number 1105067-88-6
(3S,5S)-Atorvastatin Calcium Salt chemical structure
Primary Record

(3S,5S)-Atorvastatin Calcium Salt

In stock
3,044 g
Purity
99.1 %
CAS
1105067-88-6

Compound Identifiers & Properties

CAS
1105067-88-6
PubChem CID
131865833
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.[Ca]
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.[Ca]

Names & Synonyms

  • (3S,5S)-Atorvastatin Calcium Salt
  • 1105067-88-6