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494-04-2

494-04-2 structural image
Product Name: NICOTELLINE
Formula: C15H11N3
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COMPUTED DESCRIPTORS

Molecular Weight 233.27 g/mol
XLogP3 2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 233.095297364 g/mol
Monoisotopic Mass 233.095297364 g/mol
Topological Polar Surface Area 38.7 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 256
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Nicotelline is a natural product found in Nicotiana tabacum with data available.