5HN
Summary
Name: | 5-hydroxypyridine-3-carboxylic acid |
Synonyms: | 5-Hydroxynicotinic 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 | 5-hydroxypyridine-3-carboxylic acid |
OpenEye OEToolkits | 1.7.6 | 5-oxidanylpyridine-3-carboxylic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)c1cncc(O)c1 |
InChI | InChI | 1.03 | InChI=1S/C6H5NO3/c8-5-1-4(6(9)10)2-7-3-5/h1-3,8H,(H,9,10) |
InChIKey | InChI | 1.03 | ATTDCVLRGFEHEO-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | Oc1cncc(c1)C(O)=O |
SMILES | CACTVS | 3.370 | Oc1cncc(c1)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1c(cncc1O)C(=O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | c1c(cncc1O)C(=O)O |