COMPUTED DESCRIPTORS
| Molecular Weight | 416.5 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 1 |
| Exact Mass | 416.21988874 g/mol |
| Monoisotopic Mass | 416.21988874 g/mol |
| Topological Polar Surface Area | 99.5 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 866 |
| 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
De-O-acetylcinobufotalin is a natural product found in Bufo gargarizans and Bufo bufo with data available.