CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | H2O < 0.1 (mg/mL) |
|---|---|
| Stability/Shelf Life | Bulk: As a bulk chemical, didemnin B is found to be stable at 25 ± 2 °C for 3 weeks. At the end of 4 weeks, approximately 2% decomposition has occurred. When stored at 45 °C, didemnin B appeared stable for 2 weeks; after this time, it slowly decomposed to an approximate 7% loss at the end of 4 weeks (HPLC). Solution: As a 6 mg/mL 50% aqueous ethanol solution at room temperature (25 ± 2 °C) didemnin B appeared stable for at least 26 hours (HPLC). |
COMPUTED DESCRIPTORS
| Molecular Weight | 1112.4 g/mol |
|---|---|
| XLogP3 | 5.5 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 15 |
| Rotatable Bond Count | 15 |
| Exact Mass | 1111.64166516 g/mol |
| Monoisotopic Mass | 1111.64166516 g/mol |
| Topological Polar Surface Area | 288 Ų |
| Heavy Atom Count | 79 |
| Formal Charge | 0 |
| Complexity | 2150 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 13 |
| 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
Didemnin B is a didemnin. It has a role as a metabolite.