| 種別 | プログラム | バージョン | 表記 |
| InChI | InChI | 1.03 | InChI=1S/C20H24N2O6/c23-15-9-5-7-13(17(15)25)19(27)21-11-3-1-2-4-12-22-20(28)14-8-6-10-16(24)18(14)26/h5-10,23-26H,1-4,11-12H2,(H,21,27)(H,22,28) |
| InChIKey | InChI | 1.03 | JWUBPLNIABBTRS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1cccc(C(=O)NCCCCCCNC(=O)c2cccc(O)c2O)c1O |
| SMILES | CACTVS | 3.385 | Oc1cccc(C(=O)NCCCCCCNC(=O)c2cccc(O)c2O)c1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(c(c(c1)O)O)C(=O)NCCCCCCNC(=O)c2cccc(c2O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(c(c(c1)O)O)C(=O)NCCCCCCNC(=O)c2cccc(c2O)O |
