3HM
Summary
| Name: | 5-hydroxy-6-methylpyridine-3-carboxylic acid |
| Synonyms: | 2-methyl-3-hydroxypyridine-5-carboxylic acid |
| Formula: | C7 H7 N O3 |
| Formal charge: | 0 |
| Formula weight: | 153.135 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 5-hydroxy-6-methylpyridine-3-carboxylic acid |
| OpenEye OEToolkits | 1.5.0 | 5-hydroxy-6-methyl-pyridine-3-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)c1cnc(c(O)c1)C |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1ncc(cc1O)C(O)=O |
| SMILES | CACTVS | 3.341 | Cc1ncc(cc1O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1c(cc(cn1)C(=O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1c(cc(cn1)C(=O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C7H7NO3/c1-4-6(9)2-5(3-8-4)7(10)11/h2-3,9H,1H3,(H,10,11) |
| InChIKey | InChI | 1.03 | NYEFWJFPBFRRKU-UHFFFAOYSA-N |
