| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:06:25 UTC |
|---|
| Update Date | 2025-03-21 18:29:28 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00077564 |
|---|
| Frequency | 37.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C13H10S |
|---|
| Molecular Mass | 198.0503 |
|---|
| SMILES | c1ccc2c(c1)CSc1ccccc1-2 |
|---|
| InChI Key | CDWKIEQLLOVYHY-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzothiopyrans |
|---|
| Subclass | 2-benzothiopyrans |
|---|
| Direct Parent | 2-benzothiopyrans |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1-benzothiopyransalkylarylthioethersbenzenoidshydrocarbon derivatives |
|---|
| Substituents | aromatic heteropolycyclic compoundthioetherhydrocarbon derivativebenzenoidalkylarylthioetheraryl thioether2-benzothiopyran1-benzothiopyran |
|---|
