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352000-03-4

352000-03-4 structural image
Product Name: 2,5-ANHYDRO-D-MANNITOL-1,6-DIPHOSPHATE, DIBARIUM SALT DIHYDRATE
Formula: C6H10O11P2.2Ba.2H2O
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COMPUTED DESCRIPTORS

Molecular Weight 630.77 g/mol
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 4
Exact Mass 631.801459 g/mol
Monoisotopic Mass 631.801459 g/mol
Topological Polar Surface Area 197 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 328
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 5
Compound Is Canonicalized Yes