DCR
Summary
| Name: | icosanoic acid |
| Formula: | C20 H40 O2 |
| Formal charge: | 0 |
| Formula weight: | 312.53 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | icosanoic acid |
| OpenEye OEToolkits | 1.5.0 | icosanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCCCCCCCCCCCCCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCCCCCCCCCCCC(O)=O |
| SMILES | CACTVS | 3.341 | CCCCCCCCCCCCCCCCCCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCCCCCCCCCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCCCCCCCCCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22) |
| InChIKey | InChI | 1.03 | VKOBVWXKNCXXDE-UHFFFAOYSA-N |
