COMPUTED DESCRIPTORS
| Molecular Weight | 597.7 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 11 |
| Exact Mass | 597.33016746 g/mol |
| Monoisotopic Mass | 597.33016746 g/mol |
| Topological Polar Surface Area | 92.8 Ų |
| Heavy Atom Count | 43 |
| Formal Charge | 0 |
| Complexity | 1100 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 13 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
8-Acetyl-14-benzoylchasmanine is a natural product found in Aconitum with data available.