2-(5-amino-1,2,4-trihydroxy-6-oxohexan-3-yl)oxy-3,4-dihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid


Chemical Name: 2-(5-amino-1,2,4-trihydroxy-6-oxohexan-3-yl)oxy-3,4-dihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid
CAS Number: 123228-39-7
Product Number: AG009GI2(AGN-PC-0LLV27)
Synonyms:
MDL No: MFCD00166787
Molecular Formula: C12H19NO10
Molecular Weight: 337.27996

Identification/Properties


Computed Properties
Molecular Weight:
337.281g/mol
XLogP3:
-6.7
Hydrogen Bond Donor Count:
7
Hydrogen Bond Acceptor Count:
11
Rotatable Bond Count:
8
Exact Mass:
337.101g/mol
Monoisotopic Mass:
337.101g/mol
Topological Polar Surface Area:
200A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
455
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
7
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



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