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108340-81-4

108340-81-4 structural image
Product Name: D-MYO-INOSITOL 1,4,5-TRISPHOSPHATE HEXASODIUM SALT
Formula: C6H16NaO15P3
Synonyms: D-myo-Inositol 1,4,5-Trisphosphate, Trisodium Salt - CAS 108340-81-4 - Calbiochem;D-Ins(1,4,5)P₃, 3Na
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COMPUTED DESCRIPTORS

Molecular Weight 551.99 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 3
Exact Mass 551.8540463 g/mol
Monoisotopic Mass 551.8540463 g/mol
Topological Polar Surface Area 278 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 539
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 7
Compound Is Canonicalized Yes