b-D-Glucopyranosiduronic acid,4-(methylnitrosoamino)-1-(3-pyridinyl)butyl


Chemical Name: b-D-Glucopyranosiduronic acid,4-(methylnitrosoamino)-1-(3-pyridinyl)butyl
CAS Number: 131119-04-5
Product Number: AG000VJ9(AGN-PC-0PJF55)
Synonyms:
MDL No:
Molecular Formula: C16H23N3O8
Molecular Weight: 385.3691

Identification/Properties


Computed Properties
Molecular Weight:
385.373g/mol
XLogP3:
-0.7
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
11
Rotatable Bond Count:
8
Exact Mass:
385.149g/mol
Monoisotopic Mass:
385.149g/mol
Topological Polar Surface Area:
162A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
496
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
5
Undefined Atom Stereocenter Count:
1
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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