| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:08:00 UTC |
|---|
| Update Date | 2025-03-25 00:56:39 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02219877 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C10H14NOS+ |
|---|
| Molecular Mass | 196.0791 |
|---|
| SMILES | C[N+]1(C)CC(O)Sc2ccccc21 |
|---|
| InChI Key | NCEIUABWQVYQKT-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzothiazines |
|---|
| Subclass | benzothiazines |
|---|
| Direct Parent | benzothiazines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1,4-thiazinesaminesaryl thioethersazacyclic compoundsbenzenoidshydrocarbon derivativesorganic cationsorganic saltsorganooxygen compoundsorganopnictogen compoundsquaternary ammonium salts |
|---|
| Substituents | para-thiazineazacyclequaternary ammonium saltbenzothiazinearyl thioetherorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganic cationorganic saltamineorganooxygen compound |
|---|
