Basic Information |
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| Product Name: | ATORVASTATIN CALCIUM SALT TRIHYDRATE |
| CAS: | 344423-98-9 ;344920-08-7 ;134523-03-8 |
| English Synonyms: | TORVAST ; CI-981 ; LIPITOR ; CARDYL ; XAVATOR ; (3R,5R)-7-[2-(4-FLUOROPHENYL)-5-ISOPROPYL-3-PHENYL-4-(PHENYLCARBAMOYL)PYRROL-1-YL]-3,5-DIHYDROHEPTANOIC ACID CALCIUM SALT (2:1) TRIHYDRATE ; SOTIS ; ATORVASTATIN CALCIUM ; TOZALIP ; ATORVASTATIN CALCIUM SALT TRIHYDRATE ; ATORVASTATIN HEMICALCIUM SALT SESQUIHYDRATE ; ATORVASTATIN CALCIUM TRIHYDRATE |
| MDL Number.: | MFCD09752074 |
| 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.O.O.O |
| InChi: | InChI=1S/2C33H35FN2O5.Ca.3H2O/c2*1-21(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;;;;/h2*3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);;3*1H2/q;;+2;;;/p-2/t2*26-,27-;;;;/m11..../s1 |
| InChiKey: | InChIKey=SHZPNDRIDUBNMH-NIJVSVLQSA-L |
Property |
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Safety information |
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| WGK Germany: | 3 |
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