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59553-87-6

59553-87-6 structural image
Product Name: 16H-1,24:6,9-Dietheno-11,15-metheno-2H-pyrido[2',3':17,18][1,11]dioxacycloeicosino[2,3,4-ij]isoquinolin-14-ol, 3,5,16a,17,18,19-hexahydro-12,20,21,22,26-pentamethoxy-17-methyl-, (16aS)- (9CI)
Formula: C38H40N2O8
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COMPUTED DESCRIPTORS

Molecular Weight 652.7 g/mol
XLogP3 5.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 5
Exact Mass 652.27846624 g/mol
Monoisotopic Mass 652.27846624 g/mol
Topological Polar Surface Area 100 Ų
Heavy Atom Count 48
Formal Charge 0
Complexity 1090
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes