60M
Summary
| Name: | 6-(phosphonomethyl)pyridine-2-carboxylic acid |
| Formula: | C7 H8 N O5 P |
| Formal charge: | 0 |
| Formula weight: | 217.116 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | 6-(phosphonomethyl)pyridine-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H8NO5P/c9-7(10)6-3-1-2-5(8-6)4-14(11,12)13/h1-3H,4H2,(H,9,10)(H2,11,12,13) |
| InChIKey | InChI | 1.03 | HIDJRVUSOKZHOS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1cccc(C[P](O)(O)=O)n1 |
| SMILES | CACTVS | 3.385 | OC(=O)c1cccc(C[P](O)(O)=O)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1cc(nc(c1)C(=O)O)CP(=O)(O)O |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1cc(nc(c1)C(=O)O)CP(=O)(O)O |
