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131944-48-4

131944-48-4 structural image
Product Name: (E/Z)-FK-506 26,28-Allylic Ester RearrangeMent IMpurity
Formula: C44H69NO12
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COMPUTED DESCRIPTORS

Molecular Weight 804.0 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 6
Exact Mass 803.48197664 g/mol
Monoisotopic Mass 803.48197664 g/mol
Topological Polar Surface Area 178 Ų
Heavy Atom Count 57
Formal Charge 0
Complexity 1480
Isotope Atom Count 0
Defined Atom Stereocenter Count 14
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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