21884-44-6
Product Name:
Rugulosin, 8,8'-dihydroxy-, (1S,1'S,2R,2'R,3S,3'S,9aR,9'aR)-
Formula:
C30H22O12
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Yellow solid; [HSDB] |
|---|---|
| Color/Form | YELLOW, RECTANGULAR CRYSTALS |
| Melting Point | 287 °C (DECOMP) |
| Solubility | PRACTICALLY INSOL IN WATER; SOL IN AQ SODIUM BICARBONATE; SOL IN MOST ORGANIC SOLVENTS |
| Stability/Shelf Life | CONVERTS TO A BROWNISH-RED QUINOID SUBSTANCE, LUMILUTEOSKYRIN, WHEN EXPOSED TO SUNLIGHT |
| Optical Rotation | SPECIFIC OPTICAL ROTATION: -880 DEG @ 25 °C/D (0.1% IN ACETONE); MAX ABSORPTION (CHLOROFORM): 280.5 NM (E= 446); 436 NM (E= 562); 457 NM (E= 559); (ETHANOL): 433 NM (E= 597); 448 NM (E=599); (0.1 MOLAR POTASSIUM PHOSPHATE BUFFER, PH 7.4): 350 NM (E= 458); 353 NM (E= 390) |
| Chemical Classes | Biological Agents -> Mycotoxins |
COMPUTED DESCRIPTORS
| Molecular Weight | 574.5 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 8 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 0 |
| Exact Mass | 574.11112613 g/mol |
| Monoisotopic Mass | 574.11112613 g/mol |
| Topological Polar Surface Area | 230 Ų |
| Heavy Atom Count | 42 |
| Formal Charge | 0 |
| Complexity | 1360 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 8 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Luteoskyrin is a cyclic ketone and an organic polycyclic compound.