| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(CC(=O)OC(CO)CO)CCCCCC=[C@H]C\C=C/CCCCC |
| InChI | InChI | 1.03 | InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9- |
| InChIKey | InChI | 1.03 | IEPGNWMPIFDNSD-HZJYTTRNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCC\C=C/C\C=C/CCCCCCCC(=O)OC(CO)CO |
| SMILES | CACTVS | 3.385 | CCCCCC=CCC=CCCCCCCCC(=O)OC(CO)CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC(CO)CO |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCC=CCC=CCCCCCCCC(=O)OC(CO)CO |
