| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:50:41 UTC |
|---|
| Update Date | 2025-03-25 00:50:18 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02180074 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H9IO2 |
|---|
| Molecular Mass | 263.9647 |
|---|
| SMILES | Cc1cc(I)cc(CO)c1O |
|---|
| InChI Key | IMFIHCGQTOCUJL-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | phenols |
|---|
| Subclass | halophenols |
|---|
| Direct Parent | halophenols |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | aromatic alcoholsaryl iodidesbenzyl alcoholshydrocarbon derivativesiodobenzenesorganoiodidesortho cresolsp-iodophenolstoluenes |
|---|
| Substituents | aromatic alcoholalcoholmonocyclic benzene moietybenzyl alcoholorganohalogen compoundiodobenzene4-iodophenolorganoiodidearyl halidearomatic homomonocyclic compoundorganic oxygen compound4-halophenolo-cresolhydrocarbon derivativearyl iodidehalobenzenetolueneorganooxygen compound |
|---|
