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133084-52-3

133084-52-3 structural image
Product Name: lyngbyatoxin B
Formula: C27H39N3O3
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CHEMICAL AND PHYSICAL PROPERTIES

Chemical Classes other linear non-peptide (Lyngbya toxin (alkaloid))

COMPUTED DESCRIPTORS

Molecular Weight 453.6 g/mol
XLogP3 5
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 8
Exact Mass 453.29914211 g/mol
Monoisotopic Mass 453.29914211 g/mol
Topological Polar Surface Area 88.6 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 725
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 4
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes