MLI
Summary
| Name: | MALONATE ION |
| Formula: | C3 H2 O4 |
| Formal charge: | -2 |
| Formula weight: | 102.046 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | propanedioate |
| OpenEye OEToolkits | 1.5.0 | propanedioate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | [O-]C(=O)CC([O-])=O |
| SMILES_CANONICAL | CACTVS | 3.341 | [O-]C(=O)CC([O-])=O |
| SMILES | CACTVS | 3.341 | [O-]C(=O)CC([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(C(=O)[O-])C(=O)[O-] |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(C(=O)[O-])C(=O)[O-] |
| InChI | InChI | 1.03 | InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)/p-2 |
| InChIKey | InChI | 1.03 | OFOBLEOULBTSOW-UHFFFAOYSA-L |
