| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:45:53 UTC |
|---|
| Update Date | 2025-03-21 18:00:40 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00028712 |
|---|
| Frequency | 130.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C12H6Br3ClO |
|---|
| Molecular Mass | 437.7657 |
|---|
| SMILES | Clc1cc(Br)ccc1Oc1ccc(Br)cc1Br |
|---|
| InChI Key | JDNFUSZODGSNTI-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | diphenylethers |
|---|
| Direct Parent | bromodiphenyl ethers |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | aryl bromidesaryl chloridesbromobenzeneschlorobenzenesdiarylethershydrocarbon derivativesorganobromidesorganochloridesphenol ethersphenoxy compounds |
|---|
| Substituents | aryl chloridechlorobenzenediaryl etherphenol etheretherorganochloridebromodiphenyl etherbromobenzeneorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganic oxygen compoundorganobromidehydrocarbon derivativehalobenzenephenoxy compoundaryl bromideorganooxygen compound |
|---|
