| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:01:39 UTC |
|---|
| Update Date | 2025-03-25 00:54:15 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02205040 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C11H8N2O5S |
|---|
| Molecular Mass | 280.0154 |
|---|
| SMILES | O=S(=O)(O)Oc1cc(O)nc2[nH]c3ccccc3c12 |
|---|
| InChI Key | DKBNOFBZVGLVDA-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | indoles and derivatives |
|---|
| Subclass | pyridoindoles |
|---|
| Direct Parent | alpha carbolines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 2-halopyridinesarylsulfatesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesindolesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyrrolespyrrolopyridinessulfuric acid monoesters |
|---|
| Substituents | sulfuric acid monoesterindolepolyhalopyridineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundarylsulfate2-halopyridineorganic sulfuric acid or derivativesazacyclepyrrolopyridineheteroaromatic compoundhydroxypyridinepyridineorganic oxygen compoundpyrrolesulfate-esterhydrocarbon derivativealpha-carbolinebenzenoidorganic nitrogen compoundsulfuric acid esterorganooxygen compound |
|---|
