| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:15:33 UTC |
|---|
| Update Date | 2025-03-21 18:34:08 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00099390 |
|---|
| Frequency | 27.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H6OS |
|---|
| Molecular Mass | 150.0139 |
|---|
| SMILES | Oc1csc2ccccc12 |
|---|
| InChI Key | XHQBIYCRFVVHFD-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzothiophenes |
|---|
| Subclass | 1-benzothiophenes |
|---|
| Direct Parent | 1-benzothiophenes |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | benzenoidsheteroaromatic compoundshydrocarbon derivativesorganooxygen compoundsthiophenes |
|---|
| Substituents | organic oxygen compoundaromatic heteropolycyclic compound1-benzothiopheneheteroaromatic compoundhydrocarbon derivativebenzenoidthiopheneorganooxygen compound |
|---|
