| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(OCC(O)CO)CCCCCCCCC\C=C/CCCCCC |
| InChI | InChI | 1.03 | InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h7-8,20,22-23H,2-6,9-19H2,1H3/b8-7-/t20-/m1/s1 |
| InChIKey | InChI | 1.03 | KJHYUSLWTPMFTN-WHXUGTBJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCC\C=C/CCCCCCCCCC(=O)OC[C@H](O)CO |
| SMILES | CACTVS | 3.370 | CCCCCCC=CCCCCCCCCCC(=O)OC[CH](O)CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CCCCCC/C=C\CCCCCCCCCC(=O)OC[C@@H](CO)O |
| SMILES | OpenEye OEToolkits | 1.7.2 | CCCCCCC=CCCCCCCCCCC(=O)OCC(CO)O |
