Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=P(OCC(O)C(O)C(O)C(O)C(=O)CO)(O)O |
InChI | InChI | 1.03 | InChI=1S/C7H15O10P/c8-1-3(9)5(11)7(13)6(12)4(10)2-17-18(14,15)16/h4-8,10-13H,1-2H2,(H2,14,15,16)/t4-,5-,6-,7+/m1/s1 |
InChIKey | InChI | 1.03 | JDTUMPKOJBQPKX-GBNDHIKLSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | OCC(=O)[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO[P](O)(O)=O |
SMILES | CACTVS | 3.370 | OCC(=O)[CH](O)[CH](O)[CH](O)[CH](O)CO[P](O)(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | C([C@H]([C@H]([C@H]([C@@H](C(=O)CO)O)O)O)O)OP(=O)(O)O |
SMILES | OpenEye OEToolkits | 1.7.2 | C(C(C(C(C(C(=O)CO)O)O)O)O)OP(=O)(O)O |