Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C16H33NO6/c1-3-4-5-6-7-8-9-14(21)17(2)10-12(19)15(22)16(23)13(20)11-18/h12-13,15-16,18-20,22-23H,3-11H2,1-2H3/t12-,13+,15+,16+/m0/s1 |
InChIKey | InChI | 1.06 | GCRLIVCNZWDCDE-SJXGUFTOSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCC(=O)N(C)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO |
SMILES | CACTVS | 3.385 | CCCCCCCCC(=O)N(C)C[CH](O)[CH](O)[CH](O)[CH](O)CO |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCCC(=O)N(C)C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCC(=O)N(C)CC(C(C(C(CO)O)O)O)O |