| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:15:29 UTC |
|---|
| Update Date | 2025-03-25 00:59:22 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02236678 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C15H12N2O4S |
|---|
| Molecular Mass | 316.0518 |
|---|
| SMILES | CS(=O)(=O)c1ccc(-c2nc3ccc(C(=O)O)cc3[nH]2)cc1 |
|---|
| InChI Key | BJEVRKJTEUEKDB-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzimidazoles |
|---|
| Subclass | phenylbenzimidazoles |
|---|
| Direct Parent | phenylbenzimidazoles |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | azacyclic compoundsbenzenesulfonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesimidazolesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsphenylimidazolessulfones |
|---|
| Substituents | monocyclic benzene moietycarboxylic acidorganosulfur compoundcarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundazolebenzenesulfonyl groupazacycleheteroaromatic compoundmonocarboxylic acid or derivativessulfonylorganic oxygen compound2-phenylimidazolehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundsulfonephenylbenzimidazole |
|---|
