| MolName | [(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate |
| MolecularFormula | C6H13O9P |
| Smiles | OC[C@@H]([C@@H]([C@H]([C@H]1O)O)O)O[C@@H]1OP(O)(O)=O |
| InChI | InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3+,4-,5+,6+/m0/s1 |
| InChIK | HXXFSFRBOHSIMQ-DSOBHZJASA-N |
| TotalMolweight | 260.134 |
| Molweight | 260.134 |
| MonoisotopicMass | 260.029722 |
| CLogP | -5.8646 |
| CLogS | 1.831 |
| H Acceptors | 9 |
| H Donors | 6 |
| TotalSurfaceArea | 158.13 |
| Relative PSA | 0.73117 |
| PolarSurfaceArea | 166.72 |
| Druglikeness | -22.924 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 10 |
| Electronegative Atoms | 10 |
| StereoCenters | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3Atoms | 15 |
| Symmetricatoms | 1 |
| AcidicOxygens | 2 |
| StereoCon | this enantiomer |
Click to Load Molecule:
1 - [(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate | 2 - [(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dihydrogen phosphate