14V
Summary
| Name: | 3,5-dioxoicosanoic acid |
| Formula: | C20 H36 O4 |
| Formal charge: | 0 |
| Formula weight: | 340.497 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3,5-dioxoicosanoic acid |
| OpenEye OEToolkits | 1.7.2 | 3,5-bis(oxidanylidene)icosanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(CC(=O)CC(=O)O)CCCCCCCCCCCCCCC |
| InChI | InChI | 1.03 | InChI=1S/C20H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)16-19(22)17-20(23)24/h2-17H2,1H3,(H,23,24) |
| InChIKey | InChI | 1.03 | DAKTXSDZCYKITO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCCCCCCCCCCCCCCC(=O)CC(=O)CC(O)=O |
| SMILES | CACTVS | 3.370 | CCCCCCCCCCCCCCCC(=O)CC(=O)CC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CCCCCCCCCCCCCCCC(=O)CC(=O)CC(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.2 | CCCCCCCCCCCCCCCC(=O)CC(=O)CC(=O)O |
