N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4R,5R)-5-acetamido-1,2,4-trihydroxy-6-oxohexan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide


Chemical Name: N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4R,5R)-5-acetamido-1,2,4-trihydroxy-6-oxohexan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CAS Number: 38864-21-0
Product Number: AG00BXAJ(AGN-PC-0JLOLK)
Synonyms:
MDL No: MFCD00136047
Molecular Formula: C24H41N3O16
Molecular Weight: 627.5928

Identification/Properties


Computed Properties
Molecular Weight:
627.597g/mol
XLogP3:
-7.2
Hydrogen Bond Donor Count:
11
Hydrogen Bond Acceptor Count:
16
Rotatable Bond Count:
14
Exact Mass:
627.249g/mol
Monoisotopic Mass:
627.249g/mol
Topological Polar Surface Area:
303A^2
Heavy Atom Count:
43
Formal Charge:
0
Complexity:
944
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
14
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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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