N-[(2R,3R,4R,5R,6R)-4-hydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide


Chemical Name: N-[(2R,3R,4R,5R,6R)-4-hydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide
CAS Number: 184377-56-8
Product Number: AG00AQ6W(AGN-PC-05J3XR)
Synonyms:
MDL No:
Molecular Formula: C20H28N2O13
Molecular Weight: 504.44192

Identification/Properties


Computed Properties
Molecular Weight:
504.445g/mol
XLogP3:
-2.6
Hydrogen Bond Donor Count:
7
Hydrogen Bond Acceptor Count:
13
Rotatable Bond Count:
7
Exact Mass:
504.159g/mol
Monoisotopic Mass:
504.159g/mol
Topological Polar Surface Area:
233A^2
Heavy Atom Count:
35
Formal Charge:
0
Complexity:
716
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
10
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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