Home Aminos D-Gluconimidic acid, 2-(acetylamino)-2-deoxy-N-hydroxy-, δ-lactone, 3,4,6-triacetate (9CI)

D-Gluconimidic acid, 2-(acetylamino)-2-deoxy-N-hydroxy-, δ-lactone, 3,4,6-triacetate (9CI)

CAS No.:
132152-78-4
Catalog Number:
AG0010AU
Molecular Formula:
C14H20N2O9
Molecular Weight:
360.3166
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Product Description
Catalog Number:
AG0010AU
Chemical Name:
D-Gluconimidic acid, 2-(acetylamino)-2-deoxy-N-hydroxy-, δ-lactone, 3,4,6-triacetate (9CI)
CAS Number:
132152-78-4
Molecular Formula:
C14H20N2O9
Molecular Weight:
360.3166
MDL Number:
MFCD07367584
IUPAC Name:
[(2R,3S,4R,5R,6E)-5-acetamido-3,4-diacetyloxy-6-hydroxyiminooxan-2-yl]methyl acetate
InChI:
InChI=1S/C14H20N2O9/c1-6(17)15-11-13(24-9(4)20)12(23-8(3)19)10(5-22-7(2)18)25-14(11)16-21/h10-13,21H,5H2,1-4H3,(H,15,17)/b16-14+/t10-,11-,12-,13-/m1/s1
InChI Key:
QHLGKFLFCWDLOA-RWMKSRPCSA-N
SMILES:
O/N=C\1/O[C@H](COC(=O)C)[C@H]([C@@H]([C@H]1NC(=O)C)OC(=O)C)OC(=O)C
Properties
Complexity:
575  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
1  
Exact Mass:
360.117g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
360.319g/mol
Monoisotopic Mass:
360.117g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
150A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties