| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:56:08 UTC |
|---|
| Update Date | 2025-03-21 18:04:50 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00053074 |
|---|
| Frequency | 126.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H6N4O3 |
|---|
| Molecular Mass | 194.044 |
|---|
| SMILES | Nc1nc2c(C(=O)O)c[nH]c2c(=O)[nH]1 |
|---|
| InChI Key | HVQCKHNKLQSGKL-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrrolopyrimidines |
|---|
| Subclass | pyrrolopyrimidines |
|---|
| Direct Parent | pyrrolopyrimidines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1-carboxy-2-haloaromatic compoundsamino acidsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminespyrimidonespyrrole carboxylic acidsvinylogous amides |
|---|
| Substituents | lactamcarboxylic acidpyrrole-3-carboxylic acid or derivativesamino acid or derivativesamino acidpyrimidonecarboxylic acid derivativepyrimidinepyrrolopyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1-carboxy-2-haloaromatic compoundvinylogous amideazacycleheteroaromatic compoundmonocarboxylic acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativeprimary amineorganic nitrogen compoundpyrrole-3-carboxylic acidamineorganooxygen compound |
|---|
