MAK
Summary
| Name: | ALPHA-KETOMALONIC ACID |
| Formula: | C3 H2 O5 |
| Formal charge: | 0 |
| Formula weight: | 118.045 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | oxopropanedioic acid |
| OpenEye OEToolkits | 1.5.0 | 2-oxopropanedioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(=O)C(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)C(=O)C(O)=O |
| SMILES | CACTVS | 3.341 | OC(=O)C(=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(=O)(C(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(=O)(C(=O)O)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C3H2O5/c4-1(2(5)6)3(7)8/h(H,5,6)(H,7,8) |
| InChIKey | InChI | 1.03 | XEEVLJKYYUVTRC-UHFFFAOYSA-N |
