| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:36:04 UTC |
|---|
| Update Date | 2025-03-21 17:57:12 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00006268 |
|---|
| Frequency | 827.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H6I2O3 |
|---|
| Molecular Mass | 403.8406 |
|---|
| SMILES | O=C(O)Cc1cc(I)c(O)c(I)c1 |
|---|
| InChI Key | IGWIPEUDVOXYDO-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | phenols |
|---|
| Subclass | halophenols |
|---|
| Direct Parent | halophenols |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | aryl iodidescarbonyl compoundscarboxylic acidshydrocarbon derivativesiodobenzenesmonocarboxylic acids and derivativeso-iodophenolsorganic oxidesorganoiodides |
|---|
| Substituents | monocyclic benzene moietycarbonyl groupcarboxylic acid2-iodophenolcarboxylic acid derivativeorganohalogen compoundiodobenzeneorganoiodidearyl halidearomatic homomonocyclic compound2-halophenolorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativearyl iodidehalobenzeneorganooxygen compound |
|---|
