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308359-33-3

308359-33-3 structural image
Product Name: Trabectedin intermediate
Formula: C31H31N3O9S
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COMPUTED DESCRIPTORS

Molecular Weight 621.7 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 3
Exact Mass 621.17810075 g/mol
Monoisotopic Mass 621.17810075 g/mol
Topological Polar Surface Area 173 Ų
Heavy Atom Count 44
Formal Charge 0
Complexity 1240
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 1
Compound Is Canonicalized Yes