90456-53-4
Product Name:
4H-1-Benzopyran-4-one, 6,8-bis(β-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-
Formula:
C27H30O17
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 626.5 g/mol |
|---|---|
| XLogP3 | -1.7 |
| Hydrogen Bond Donor Count | 11 |
| Hydrogen Bond Acceptor Count | 17 |
| Rotatable Bond Count | 7 |
| Exact Mass | 626.14829948 g/mol |
| Monoisotopic Mass | 626.14829948 g/mol |
| Topological Polar Surface Area | 286 Ų |
| Heavy Atom Count | 44 |
| 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
5,7-dihydroxy-2-(4-hydroxyphenyl)-6,8-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one is a natural product found in Centaurea hierapolitana, Artemisia capillaris, and Glycyrrhiza glabra with data available.