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7608-44-8

7608-44-8 structural image
Product Name: artocarpin
Formula: C26H28O6
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 174 - 175 °C

COMPUTED DESCRIPTORS

Molecular Weight 436.5 g/mol
XLogP3 5.7
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 436.18858861 g/mol
Monoisotopic Mass 436.18858861 g/mol
Topological Polar Surface Area 96.2 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 762
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
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

Artocarpin is a trihydroxyflavone that is flavone substituted by hydroxy groups at positions 5, 2', and 4', a methoxy group at position 7, a prenyl group at position 3 and a (1E)-3-methylbut-1-enyl group at position 6. Isolated from Artocarpus heterophyllus and Artocarpus integrifolia, it exhibits antineoplastic activity. It has a role as a metabolite and an antineoplastic agent. It is a monomethoxyflavone and a trihydroxyflavone.