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909803-26-5

909803-26-5 structural image
Product Name: Sinocrassoside C1
Formula: C27H30O16
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COMPUTED DESCRIPTORS

Molecular Weight 610.5 g/mol
XLogP3 -0.9
Hydrogen Bond Donor Count 10
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 6
Exact Mass 610.15338487 g/mol
Monoisotopic Mass 610.15338487 g/mol
Topological Polar Surface Area 266 Ų
Heavy Atom Count 43
Formal Charge 0
Complexity 1020
Isotope Atom Count 0
Defined Atom Stereocenter Count 10
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

5,8-Dihydroxy-2-(4-hydroxyphenyl)-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-7-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one is a natural product found in Sedum sarmentosum and Sinocrassula indica with data available.