| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:38:57 UTC |
|---|
| Update Date | 2025-03-25 00:46:07 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02153379 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C13H11IO3 |
|---|
| Molecular Mass | 341.9753 |
|---|
| SMILES | COc1ccc(Oc2ccc(O)cc2I)cc1 |
|---|
| InChI Key | AUFUJSCLSWUZCX-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | diphenylethers |
|---|
| Direct Parent | diphenylethers |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesaryl iodidesdiarylethershalophenolshydrocarbon derivativesiodobenzenesm-iodophenolsmethoxybenzenesorganoiodidesphenoxy compounds |
|---|
| Substituents | diaryl etherphenol etherether1-hydroxy-2-unsubstituted benzenoidalkyl aryl etherorganohalogen compoundiodobenzeneorganoiodide3-halophenolmethoxybenzenearyl halidearomatic homomonocyclic compoundorganic oxygen compoundanisolephenolhydrocarbon derivativearyl iodidehalobenzenephenoxy compound3-iodophenoldiphenyletherorganooxygen compound |
|---|
