| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | O=C(NC(C(=O)O)C(C)CC)C1OC1C(=O)OCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCOC(=O)[C@H]1O[C@@H]1C(=O)N[C@@H]([C@@H](C)CC)C(O)=O |
| SMILES | CACTVS | 3.341 | CCOC(=O)[CH]1O[CH]1C(=O)N[CH]([CH](C)CC)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC[C@H](C)[C@@H](C(=O)O)NC(=O)[C@@H]1[C@H](O1)C(=O)OCC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCC(C)C(C(=O)O)NC(=O)C1C(O1)C(=O)OCC |
| InChI | InChI | 1.03 | InChI=1S/C12H19NO6/c1-4-6(3)7(11(15)16)13-10(14)8-9(19-8)12(17)18-5-2/h6-9H,4-5H2,1-3H3,(H,13,14)(H,15,16)/t6-,7-,8-,9-/m0/s1 |
| InChIKey | InChI | 1.03 | MZJYLQZZISBOTF-JBDRJPRFSA-N |
