| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C1CCCCC1C(=O)Nc1sc2CCCCCCc2c1C(=O)OC |
| InChI | InChI | 1.06 | InChI=1S/C20H27NO5S/c1-26-20(25)16-14-10-4-2-3-5-11-15(14)27-18(16)21-17(22)12-8-6-7-9-13(12)19(23)24/h12-13H,2-11H2,1H3,(H,21,22)(H,23,24)/t12-,13-/m1/s1 |
| InChIKey | InChI | 1.06 | FLTXXOCJBMXERF-CHWSQXEVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)c1c2CCCCCCc2sc1NC(=O)[C@@H]3CCCC[C@H]3C(O)=O |
| SMILES | CACTVS | 3.385 | COC(=O)c1c2CCCCCCc2sc1NC(=O)[CH]3CCCC[CH]3C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC(=O)c1c2c(sc1NC(=O)[C@@H]3CCCC[C@H]3C(=O)O)CCCCCC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COC(=O)c1c2c(sc1NC(=O)C3CCCCC3C(=O)O)CCCCCC2 |
