| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:37:11 UTC |
|---|
| Update Date | 2025-03-21 17:57:36 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00008913 |
|---|
| Frequency | 545.1 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H7Cl3O |
|---|
| Molecular Mass | 223.9562 |
|---|
| SMILES | OC(c1ccccc1)C(Cl)(Cl)Cl |
|---|
| InChI Key | ABFRBTDJEKZSRM-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | benzene and substituted derivatives |
|---|
| Direct Parent | benzene and substituted derivatives |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | alkyl chloridesaromatic alcoholschlorohydrinshydrocarbon derivativesorganochloridessecondary alcohols |
|---|
| Substituents | aromatic alcoholalcoholmonocyclic benzene moietychlorohydrinhalohydrinalkyl chlorideorganochlorideorganohalogen compoundaromatic homomonocyclic compoundorganic oxygen compoundsecondary alcoholalkyl halidehydrocarbon derivativeorganooxygen compound |
|---|
