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950600-96-1

950600-96-1 structural image
Product Name: (4R,4aS,8aS)-3,4a,8,8-tetramethyl-4-[(2-oxochromen-7-yl)oxymethyl]-4,5,6,8a-tetrahydronaphthalene-1,7-dione
Formula: C24H26O5
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COMPUTED DESCRIPTORS

Molecular Weight 394.5 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 394.17802393 g/mol
Monoisotopic Mass 394.17802393 g/mol
Topological Polar Surface Area 69.7 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 791
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
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

Epi-conferdione is a natural product found in Ferula foetida and Ferula assa-foetida with data available.