b-D-Glucopyranosiduronic acid,1,2,3,4,10,14b-hexahydro-2-methylpyrazino[2,1-a]pyrido[2,3-c][2]benzazepin-8-yl


Chemical Name: b-D-Glucopyranosiduronic acid,1,2,3,4,10,14b-hexahydro-2-methylpyrazino[2,1-a]pyrido[2,3-c][2]benzazepin-8-yl
CAS Number: 155239-47-7
Product Number: AG001NR1(AGN-PC-0Q6V98)
Synonyms:
MDL No:
Molecular Formula: C23H27N3O7
Molecular Weight: 457.4764

Identification/Properties


Computed Properties
Molecular Weight:
457.483g/mol
XLogP3:
-0.9
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
3
Exact Mass:
457.185g/mol
Monoisotopic Mass:
457.185g/mol
Topological Polar Surface Area:
136A^2
Heavy Atom Count:
33
Formal Charge:
0
Complexity:
714
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
2
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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