53B
Summary
Name: | 6-hydroxypyridine-2-carboxylic acid |
Formula: | C6 H5 N O3 |
Formal charge: | 0 |
Formula weight: | 139.109 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 6-hydroxypyridine-2-carboxylic acid |
OpenEye OEToolkits | 1.9.2 | 6-oxidanylpyridine-2-carboxylic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1cc(nc(c1)C(=O)O)O |
InChI | InChI | 1.03 | InChI=1S/C6H5NO3/c8-5-3-1-2-4(7-5)6(9)10/h1-3H,(H,7,8)(H,9,10) |
InChIKey | InChI | 1.03 | VRCWSYYXUCKEED-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1cccc(O)n1 |
SMILES | CACTVS | 3.385 | OC(=O)c1cccc(O)n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(nc(c1)O)C(=O)O |
SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(nc(c1)O)C(=O)O |