08O
Summary
| Name: | (Z)-docos-13-enoic acid |
| Formula: | C22 H42 O2 |
| Formal charge: | 0 |
| Formula weight: | 338.568 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (~{Z})-docos-13-enoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9- |
| InChIKey | InChI | 1.03 | DPUOLQHDNGRHBS-KTKRTIGZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCC\C=C/CCCCCCCCCCCC(O)=O |
| SMILES | CACTVS | 3.385 | CCCCCCCCC=CCCCCCCCCCCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCC=CCCCCCCCCCCCC(=O)O |
