COMPUTED DESCRIPTORS
| Molecular Weight | 514.9 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 8 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 5 |
| Exact Mass | 514.0878039 g/mol |
| Monoisotopic Mass | 514.0878039 g/mol |
| Topological Polar Surface Area | 191 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 668 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 5 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Petunidin 3-O-glucoside is a metabolite found in or produced by Saccharomyces cerevisiae.