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39011-91-1

39011-91-1 structural image
Product Name: oxypaeoniflora
Formula: C23H28O12
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COMPUTED DESCRIPTORS

Molecular Weight 496.5 g/mol
XLogP3 -1.4
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 7
Exact Mass 496.15807632 g/mol
Monoisotopic Mass 496.15807632 g/mol
Topological Polar Surface Area 185 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 879
Isotope Atom Count 0
Defined Atom Stereocenter Count 11
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

Oxypaeoniflorin is a monoterpene glycoside with formula C23H28O12, isolated from several species of Paeoniae. It has a role as a plant metabolite. It is a cyclic acetal, a lactol, a bridged compound, a beta-D-glucoside, a 4-hydroxybenzoate ester and a monoterpene glycoside.