| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:10:07 UTC |
|---|
| Update Date | 2025-03-21 18:31:33 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00086400 |
|---|
| Frequency | 60.7 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H6N2O4 |
|---|
| Molecular Mass | 206.0328 |
|---|
| SMILES | O=C(O)c1nc(O)c2cccc(O)c2n1 |
|---|
| InChI Key | DUNJRLKRNYFSNQ-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | diazanaphthalenes |
|---|
| Subclass | benzodiazines |
|---|
| Direct Parent | quinazolines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsazacyclic compoundsbenzenoidscarboxylic acidsdiazanaphthalenesheteroaromatic compoundshydrocarbon derivativeshydroxypyrimidinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrimidinecarboxylic acids |
|---|
| Substituents | pyrimidine-2-carboxylic acidcarboxylic acidazacycleheteroaromatic compound1-hydroxy-2-unsubstituted benzenoidhydroxypyrimidine1-hydroxy-4-unsubstituted benzenoidcarboxylic acid derivativepyrimidineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundquinazolinepyrimidine-2-carboxylic acid or derivativesorganooxygen compound |
|---|
