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944804-58-4

944804-58-4 structural image
Product Name: Rhuscholide A
Formula: C31H42O3
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COMPUTED DESCRIPTORS

Molecular Weight 462.7 g/mol
XLogP3 10
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 11
Exact Mass 462.31339520 g/mol
Monoisotopic Mass 462.31339520 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 844
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Rhuscholide A is a member of the class of 1-benzofurans that is 1-benzofuran-2(3H)-one substituted by a hydroxy group at position 5, a propan-2-ylidene group at position 3 and a (2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl group at position 7. Isolated from Rhus chinensis, it exhibits anti-HIV activity. It has a role as a metabolite and an anti-HIV-1 agent. It is a member of 1-benzofurans, a gamma-lactone and a member of phenols.