N-[(2S,5S)-2-[(3S,6S)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide


Chemical Name: N-[(2S,5S)-2-[(3S,6S)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CAS Number: 235752-73-5
Product Number: AG002NQ5(AGN-PC-07Y4SS)
Synonyms:
MDL No:
Molecular Formula: C22H31N3O13
Molecular Weight: 545.4938

Identification/Properties


Computed Properties
Molecular Weight:
545.5g/mol
XLogP3:
-2.6
Hydrogen Bond Donor Count:
7
Hydrogen Bond Acceptor Count:
13
Rotatable Bond Count:
8
Exact Mass:
545.185688g/mol
Monoisotopic Mass:
545.185688g/mol
Topological Polar Surface Area:
242Ų
Heavy Atom Count:
38
Formal Charge:
0
Complexity:
821
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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