Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(OCC2OC(c1ccccc1)C(O)C2O)(O)O |
SMILES_CANONICAL | CACTVS | 3.341 | O[C@H]1[C@@H](O)[C@@H](O[C@@H]1CO[P](O)(O)=O)c2ccccc2 |
SMILES | CACTVS | 3.341 | O[CH]1[CH](O)[CH](O[CH]1CO[P](O)(O)=O)c2ccccc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C2C(C(C(O2)COP(=O)(O)O)O)O |
InChI | InChI | 1.03 | InChI=1S/C11H15O7P/c12-9-8(6-17-19(14,15)16)18-11(10(9)13)7-4-2-1-3-5-7/h1-5,8-13H,6H2,(H2,14,15,16)/t8-,9-,10-,11+/m1/s1 |
InChIKey | InChI | 1.03 | UQFRVRKERMOLHL-DBIOUOCHSA-N |