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32449-98-2

32449-98-2 structural image
Product Name: khasianine
Formula: C39H63NO11
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COMPUTED DESCRIPTORS

Molecular Weight 721.9 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 7
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 5
Exact Mass 721.44011183 g/mol
Monoisotopic Mass 721.44011183 g/mol
Topological Polar Surface Area 180 Ų
Heavy Atom Count 51
Formal Charge 0
Complexity 1320
Isotope Atom Count 0
Defined Atom Stereocenter Count 21
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

CID 21573759 is a natural product found in Solanum mammosum, Solanum aethiopicum, and other organisms with data available.