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128219-81-8

128219-81-8 structural image
Product Name: 5'-O-DMT-2'-O-methyl-N6-phenoxyacetyl-D-adenosine
Formula: C40H39N5O8
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COMPUTED DESCRIPTORS

Molecular Weight 717.8 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 14
Exact Mass 717.27986322 g/mol
Monoisotopic Mass 717.27986322 g/mol
Topological Polar Surface Area 148 Ų
Heavy Atom Count 53
Formal Charge 0
Complexity 1140
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes