Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(OC(COP(O)(=O)OCCC(C)C)COC(=O)CCCCCCCCC)CCCCCCC |
InChI | InChI | 1.06 | InChI=1S/C26H51O8P/c1-5-7-9-11-12-14-15-17-25(27)31-21-24(34-26(28)18-16-13-10-8-6-2)22-33-35(29,30)32-20-19-23(3)4/h23-24H,5-22H2,1-4H3,(H,29,30)/t24-/m1/s1 |
InChIKey | InChI | 1.06 | IMPGTAQAVHSDIP-XMMPIXPASA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCCC(=O)OC[C@H](CO[P](O)(=O)OCCC(C)C)OC(=O)CCCCCCC |
SMILES | CACTVS | 3.385 | CCCCCCCCCC(=O)OC[CH](CO[P](O)(=O)OCCC(C)C)OC(=O)CCCCCCC |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCC(C)C)OC(=O)CCCCCCC |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCC(=O)OCC(COP(=O)(O)OCCC(C)C)OC(=O)CCCCCCC |