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97169-44-3

97169-44-3 structural image
Product Name: 6-Epi-8-O-acetylharpagide
Formula: C17H26O11
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COMPUTED DESCRIPTORS

Molecular Weight 406.4 g/mol
XLogP3 -2.7
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 5
Exact Mass 406.14751164 g/mol
Monoisotopic Mass 406.14751164 g/mol
Topological Polar Surface Area 175 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 626
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 10
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

6-Epi-8-O-acetylharpagide is a natural product found in Stachys annua, Penstemon barbatus, and other organisms with data available.