sodium;5-acetamido-2-[2-[5-acetamido-6-hydroxy-2-(hydroxymethyl)-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylate


Chemical Name: sodium;5-acetamido-2-[2-[5-acetamido-6-hydroxy-2-(hydroxymethyl)-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylate
CAS Number: 98603-84-0
Product Number: AG01E70Y(AGN-PC-015JVL)
Synonyms:
MDL No: MFCD00270073
Molecular Formula: C31H51N2NaO23
Molecular Weight: 842.72601

Identification/Properties


Computed Properties
Molecular Weight:
820.748g/mol
XLogP3:
-8.6
Hydrogen Bond Donor Count:
15
Hydrogen Bond Acceptor Count:
23
Rotatable Bond Count:
18
Exact Mass:
820.296g/mol
Monoisotopic Mass:
820.296g/mol
Topological Polar Surface Area:
411A^2
Heavy Atom Count:
56
Formal Charge:
0
Complexity:
1320
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
20
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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