1D-myo-inositol 1,2,4,5,6-pentakisphosphate
[(1R,2R,4R,5S)-3-hydroxy-2,4,5,6-tetraphosphonooxycyclohexyl] dihydrogen phosphate
Also Known As: InsP5|myo-(3OH)IP5|myo-inositol 1,2,4,5,6-pentakisphosphate|1D-myo-inositol 1,2,4,5,6-pentakisphosphate|Inositol 1,2,4,5,6-pentaphosphate|Ins(1,2,4,5,6)P5|Myo-inositol 1,2,4,5,6-pentaphosphate|inositol 1,2,4,5,6-pentakisphosphate|myo-Inositol 2,3,4,5,6-pentakisphosphate|DL-Myo-inositol 1,2,4,5,6-pentaphosphate|D-myo-inositol 1,2,4,5,6-pentakisphosphate|D-myo-Inositol 1,2,4,5,6-pentakis-phosphate|L-myo-Inositol 2,3,4,5,6-pentakis-phosphate|myo-Inositol 1,2,4,5,6-pentaphosphoric acid|Myo-inositol, 1,2,4,5,6-pentakis(dihydrogen phosphate)|myo-Inositol 1,2,4,5,6-pentakisphosphoric acid|myo-Inositol-1,2,4,5,6-pentakisphosphoric acid|1D-myo-inositol 1,2,4,5,6-pentakis(dihydrogen phosphate)|[(1R,2R,4R,5S)-3-hydroxy-2,4,5,6-tetraphosphonooxycyclohexyl] dihydrogen phosphate|N0001-000949|D-myo-Inositol 1,2,4,5,6-pentakis-phosphate, >=96% (HPLC)|(1R,2R,3R,4S,5R,6R)-6-hydroxycyclohexane-1,2,3,4,5-pentayl pentakis[dihydrogen (phosphate)]|1alpha,2alpha,3alpha,4beta,5alpha,6beta-Cyclohexanehexol 1,2,4,5,6-pentaphosphoric acid|{[(1R,2R,3R,4R,6S)-2-hydroxy-3,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxy}phosphonic acid|ZNZ
| Molecular Formula | C6H17O21P5 |
|---|---|
| Molecular Weight | 579.895 g/mol |
| LogP | -9.2 |
| Topological Polar Surface Area | 354.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 10 |
| Exact Mass | 579.895 |
| Monoisotopic Mass | 579.895 |
| Heavy Atoms | 32 |
| Complexity | 824.0 |
Chemical Identifiers
| CAS Number | 26326-86-3 |
|---|---|
| SMILES | [C@@H]1([C@H](C([C@H]([C@@H](C1O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O |
| InChIKey | CTPQAXVNYGZUAJ-WWHKVMGRSA-N |
Product Overview
1D-myo-inositol 1,2,4,5,6-pentakisphosphate (CAS 26326-86-3), with molecular formula C6H17O21P5 and molecular weight 579.895 g/mol. IUPAC: [(1R,2R,4R,5S)-3-hydroxy-2,4,5,6-tetraphosphonooxycyclohexyl] dihydrogen phosphate.