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Homecas1313049-59-0

1313049-59-0

1313049-59-0 structural image
Product Name: Rebaudioside J
Formula: C50H80O27
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COMPUTED DESCRIPTORS

Molecular Weight 1113.2 g/mol
XLogP3 -3.9
Hydrogen Bond Donor Count 16
Hydrogen Bond Acceptor Count 27
Rotatable Bond Count 15
Exact Mass 1112.48869727 g/mol
Monoisotopic Mass 1112.48869727 g/mol
Topological Polar Surface Area 433 Ų
Heavy Atom Count 77
Formal Charge 0
Complexity 2060
Isotope Atom Count 0
Defined Atom Stereocenter Count 31
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes