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56222-78-7

56222-78-7 structural image
Product Name: valyl-ochratoxin A
Formula: C16H18ClNO6
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COMPUTED DESCRIPTORS

Molecular Weight 355.77 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 355.0822650 g/mol
Monoisotopic Mass 355.0822650 g/mol
Topological Polar Surface Area 113 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 525
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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