ATORVASTATIN CALCIUM ,110862-48-1 _Chemical Cloud Database

ATORVASTATIN CALCIUM

Basic Information
Product Name：	ATORVASTATIN CALCIUM
CAS：	110862-48-1 ;134523-03-8
English Synonyms：	ATORVASTATIN CALCIUM SALT ; LIPITOR HEMICALCIUM SALT ; ATORVASTATINE CADIUM ; CALCIUM (3R,5R)-7-(2-(4-FLUOROPHENYL)-5-ISOPROPYL-3-PHENYL-4-(PHENYLCARBAMOYL)-1H-PYRROL-1-YL)-3,5-DIHYDROXYHEPTANOATE ; ATORVASTATIN CALCIUM ; (3R,5R)-7-(2-(4-FLUOROPHENYL)-5-ISOPROPYL-3-PHENYL-4-(PHENYLCARBAMOYL)-1H-PYRROL-1-YL)-3,5-DIHYDROXYHEPTANOIC ACID CALCIUM ; ATORVASTATIN CA ; LIPITOR ; ATORVASTATIN HEMICALCIUM SALT ; ATORVASTATIN (HEMICALCIUM SALT)
MDL Number.：	MFCD03613598
H bond acceptor：	14
H bond donor：	6
Smile：	CC(C)c1c(c(c(n1CC[C@H](C[C@H](CC(=O)O[Ca]OC(=O)C[C@@H](C[C@@H](CCn2c(c(c(c2C(C)C)C(=O)Nc3ccccc3)c4ccccc4)c5ccc(cc5)F)O)O)O)O)c6ccc(cc6)F)c7ccccc7)C(=O)Nc8ccccc8
InChi：	InChI=1S/2C33H35FN2O5.Ca/c21-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40;/h23-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);/q;;+2/p-2/t2*26-,27-;/m11./s1
InChiKey：	InChIKey=FQCKMBLVYCEXJB-MNSAWQCASA-L
Property
Safety information
WGK Germany：	3

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