Home Other Building Blocks Methyl Mycophenolate (EP Impurity E)

Methyl Mycophenolate (EP Impurity E)

CAS No.:
31858-66-9
Catalog Number:
AG00C9E5
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C9E5
Chemical Name:
Methyl Mycophenolate (EP Impurity E)
CAS Number:
31858-66-9
MDL Number:
MFCD08063801
IUPAC Name:
methyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
InChI:
InChI=1S/C18H22O6/c1-10(6-8-14(19)22-3)5-7-12-16(20)15-13(9-24-18(15)21)11(2)17(12)23-4/h5,20H,6-9H2,1-4H3/b10-5+
InChI Key:
ZPXRQFLATDNYSS-BJMVGYQFSA-N
UNII:
0B5C0EG8E8
Properties
Complexity:
500  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
334.142g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
334.368g/mol
Monoisotopic Mass:
334.142g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Literature
Title Journal
Structure-activity relationships for inhibition of inosine monophosphate dehydrogenase and differentiation induction of K562 cells among the mycophenolic acid derivatives. Bioorganic & medicinal chemistry 20101115
Mycophenolic acid as a latent agonist of PPARgamma. Bioorganic & medicinal chemistry letters 20070901
Inhibitors of the IMPDH enzyme as potential anti-bovine viral diarrhoea virus agents. Antiviral chemistry & chemotherapy 20021101
Properties