HuagongsheHuagongshe Chemistry Print Report · For research reference only
L-myo-Inositol 1,4,5-trisphosphate
ZVCVTWVBDIPWPZ-FWMAINDVSA-K · L-myo-Inositol-1,4,5-trisphosphate sodium salt · L-myo-Inositol-1,4,5-triphosphate (sodium salt) · D-myo-Inositol, 3,5,6-tris(dihydrogen phosphate) · L-myo-Inositol-1,4,5-trisphosphate sodium salt, 98%,
Identifiers & Physical Properties
| CAS No. | 2068-89-5 |
|---|---|
| Molecular formula | C6H15O15P3 |
| Average molar mass | 420.1 g/mol |
| Monoisotopic mass | 419.96237967 g/mol |
| SMILES | O=P(O)(O)O[C@@H]1[C@@H](O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](O)[C@@H]1O |
| InChIKey | MMWCIQZXVOZEGG-HOZKJCLWSA-N |
| PubChem CID | 55310 |
| ChEBI | CHEBI:191121 |
| DTXSID | DTXSID001015822 |
Chemical & Physical Properties
| XLogP | -7 |
|---|---|
| Topological polar surface area | 261 |
| Hydrogen bond donors | 9 |
| Hydrogen bond acceptors | 15 |
| Rotatable bonds | 6 |
| Heavy atoms | 24 |
| Formal charge | 0 |
| Complexity | 574 |
| Boiling point | 877.6±75.0 °C(Predicted) |
| Density | 2.25±0.1 g/cm3(Predicted) |
| Storage conditions | Store at -20°C |
| pKa (acidity coefficient) | 1.91±0.10(Predicted) |
| Physical state | Lyophilized Powder |
| Color | White to off-white |
| Solubility | Water: 50 mg/ml |