Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S(=O)(OC1C(O)C(O)C(OC1O)CO)O |
InChI | InChI | 1.03 | InChI=1S/C6H12O9S/c7-1-2-3(8)4(9)5(6(10)14-2)15-16(11,12)13/h2-10H,1H2,(H,11,12,13)/t2-,3-,4+,5-,6+/m1/s1 |
InChIKey | InChI | 1.03 | MOGKHCGKIJXABF-DVKNGEFBSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | OC[C@H]1O[C@H](O)[C@H](O[S](O)(=O)=O)[C@@H](O)[C@@H]1O |
SMILES | CACTVS | 3.370 | OC[CH]1O[CH](O)[CH](O[S](O)(=O)=O)[CH](O)[CH]1O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)OS(=O)(=O)O)O)O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | C(C1C(C(C(C(O1)O)OS(=O)(=O)O)O)O)O |