Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | NCCOP(OCC(COC(=O)CCCCC)OC(=O)CCCCCCCCCC)(O)=O |
InChI | InChI | 1.03 | InChI=1S/C22H44NO8P/c1-3-5-7-8-9-10-11-13-15-22(25)31-20(18-28-21(24)14-12-6-4-2)19-30-32(26,27)29-17-16-23/h20H,3-19,23H2,1-2H3,(H,26,27)/t20-/m1/s1 |
InChIKey | InChI | 1.03 | WTEUZJKVOKXZKR-HXUWFJFHSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCC)CO[P](O)(=O)OCCN |
SMILES | CACTVS | 3.385 | CCCCCCCCCCC(=O)O[CH](COC(=O)CCCCC)CO[P](O)(=O)OCCN |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCC)COP(=O)(O)OCCN |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCC(=O)OC(COC(=O)CCCCC)COP(=O)(O)OCCN |