CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | H2O < 1 (mg/mL) |
|---|---|
| Stability/Shelf Life | Bulk: The bulk drug was determined to be stable at 60 ° C under both light and dark conditions for 30 days (HPLC). Solution: Pancratistatin was stable in 50% DMSO/H for 24 hours (HPLC). |
| Optical Rotation | (c = 1, H2O) [a]25D = + 44 ± 2° |
COMPUTED DESCRIPTORS
| Molecular Weight | 325.27 g/mol |
|---|---|
| XLogP3 | -1.6 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 0 |
| Exact Mass | 325.07976644 g/mol |
| Monoisotopic Mass | 325.07976644 g/mol |
| Topological Polar Surface Area | 149 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 503 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 6 |
| 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
Pancratistatin is a citraconoyl group.