COMPUTED DESCRIPTORS
| Molecular Weight | 626.5 g/mol |
|---|---|
| XLogP3 | -1.8 |
| 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 | 1040 |
| 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
Quercetin 3-beta-gentiobioside is a quercetin O-glycoside in which the hydroxy hydrogen at position 3 of quercetin has been replaced by a gentiobiosyl group. It has a role as a Brassica napus metabolite. It is a quercetin O-glycoside, a disaccharide derivative and a tetrahydroxyflavone. It is functionally related to a gentiobiose.