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3371-85-5

3371-85-5 structural image
Product Name: methyl 12-methoxy-13-(17-methoxy-17-oxovobasan-3alpha-yl)ibogamine-18-carboxylate
Formula: C43H52N4O5
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Solubility 3.23e-03 g/L

COMPUTED DESCRIPTORS

Molecular Weight 704.9 g/mol
XLogP3 6.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 7
Exact Mass 704.39377077 g/mol
Monoisotopic Mass 704.39377077 g/mol
Topological Polar Surface Area 99.9 Ų
Heavy Atom Count 52
Formal Charge 0
Complexity 1410
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Voacamine is a citraconoyl group.