COMPUTED DESCRIPTORS
| Molecular Weight | 426.5 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 426.16785316 g/mol |
| Monoisotopic Mass | 426.16785316 g/mol |
| Topological Polar Surface Area | 88.1 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 835 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Praeruptorin B is a natural product found in Saposhnikovia divaricata with data available.