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201049-37-8

201049-37-8 structural image
Product Name: epothilone E
Formula: C26H39NO7S
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COMPUTED DESCRIPTORS

Molecular Weight 509.7 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 3
Exact Mass 509.24472376 g/mol
Monoisotopic Mass 509.24472376 g/mol
Topological Polar Surface Area 158 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 788
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

epothilone E is a natural product found in Sorangium cellulosum with data available.