Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=P(O)(O)OCC1OCC(O)C(O)C1O |
InChI | InChI | 1.03 | InChI=1S/C6H13O8P/c7-3-1-13-4(6(9)5(3)8)2-14-15(10,11)12/h3-9H,1-2H2,(H2,10,11,12)/t3-,4+,5+,6+/m0/s1 |
InChIKey | InChI | 1.03 | KAJAXXUCVJFKFM-SLPGGIOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | O[C@H]1CO[C@H](CO[P](O)(O)=O)[C@@H](O)[C@@H]1O |
SMILES | CACTVS | 3.370 | O[CH]1CO[CH](CO[P](O)(O)=O)[CH](O)[CH]1O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C1[C@@H]([C@H]([C@@H]([C@H](O1)COP(=O)(O)O)O)O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | C1C(C(C(C(O1)COP(=O)(O)O)O)O)O |