Home Other Building Blocks N-Acetoxy Cyclosporin A Acetate

N-Acetoxy Cyclosporin A Acetate

CAS No.:
138957-23-0
Catalog Number:
AG009EWB
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG009EWB
Chemical Name:
N-Acetoxy Cyclosporin A Acetate
CAS Number:
138957-23-0
IUPAC Name:
[(E,5R,16S)-6-acetyloxy-7-(dimethylamino)-5,17-dimethyl-16-[[(2S)-4-methyl-2-(methylamino)pentanoyl]amino]-8,15-dioxooctadec-2-enyl] acetate
InChI:
InChI=1S/C33H59N3O7/c1-22(2)21-27(34-8)33(41)35-30(23(3)4)28(39)18-13-11-12-14-19-29(40)31(36(9)10)32(43-26(7)38)24(5)17-15-16-20-42-25(6)37/h15-16,22-24,27,30-32,34H,11-14,17-21H2,1-10H3,(H,35,41)/b16-15+/t24-,27+,30+,31?,32?/m1/s1
InChI Key:
FIRHBFWMHRQJRD-GZJMPQFMSA-N
Properties
Complexity:
901  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
1  
Exact Mass:
609.435g/mol
Formal Charge:
0
Heavy Atom Count:
43  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
609.849g/mol
Monoisotopic Mass:
609.435g/mol
Rotatable Bond Count:
25  
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  
Properties