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Atorvastatin Lactam Sodium Salt Impurity

CAS No.:
148217-40-7
Catalog Number:
AG00ADHJ
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00ADHJ
Chemical Name:
Atorvastatin Lactam Sodium Salt Impurity
CAS Number:
148217-40-7
MDL Number:
MFCD28143545
IUPAC Name:
sodium;(3R,5R)-7-[5-(4-fluorophenyl)-2-oxo-4-phenyl-3-(phenylcarbamoyl)-3-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate
InChI:
InChI=1S/C33H35FN2O6.Na/c1-21(2)33(31(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)30(23-13-15-24(34)16-14-23)36(32(33)42)18-17-26(37)19-27(38)20-28(39)40;/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);/q;+1/p-1/t26-,27-,33?;/m1./s1
InChI Key:
AWDUSRYVYMXRPW-LGZZEMPASA-M
Properties
Complexity:
988  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
596.23g/mol
Formal Charge:
0
Heavy Atom Count:
43  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
596.631g/mol
Monoisotopic Mass:
596.23g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties