| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 03:41:56 UTC |
|---|
| Update Date | 2025-03-21 22:54:30 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00584978 |
|---|
| Frequency | 2.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H5NO3 |
|---|
| Molecular Mass | 139.0269 |
|---|
| SMILES | O=C(OO)c1cccnc1 |
|---|
| InChI Key | YCOXMESWGGHVBG-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyridines and derivatives |
|---|
| Subclass | pyridinecarboxylic acids and derivatives |
|---|
| Direct Parent | pyridine-3-carboxylic acids |
|---|
| Geometric Descriptor | aromatic heteromonocyclic compounds |
|---|
| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesorganic hydroperoxidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsperoxolsperoxycarboxylic acids and derivatives |
|---|
| Substituents | aromatic heteromonocyclic compoundazacyclepyridine-3-carboxylic acidheteroaromatic compoundhydroxypyridinehydroperoxidecarboxylic acid derivativeperoxolorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundperoxycarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
|---|
