| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | FC(F)(F)COCC(OP(=O)(OC)O)COCCCCCCCCCCCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCCCCCCCCOC[C@H](COCC(F)(F)F)O[P@@](O)(=O)OC |
| SMILES | CACTVS | 3.341 | CCCCCCCCCCCCCCCCOC[CH](COCC(F)(F)F)O[P](O)(=O)OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCCCCCCOC[C@H](COCC(F)(F)F)O[P@](=O)(O)OC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCCCCCCOCC(COCC(F)(F)F)OP(=O)(O)OC |
| InChI | InChI | 1.03 | InChI=1S/C22H44F3O6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-29-18-21(31-32(26,27)28-2)19-30-20-22(23,24)25/h21H,3-20H2,1-2H3,(H,26,27)/t21-/m1/s1 |
| InChIKey | InChI | 1.03 | XPTFBVFCGHXMRK-OAQYLSRUSA-N |
