| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:41:42 UTC |
|---|
| Update Date | 2025-03-25 00:47:07 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02159557 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H9NO3 |
|---|
| Molecular Mass | 167.0582 |
|---|
| SMILES | O=NOc1ccc(CCO)cc1 |
|---|
| InChI Key | XALQLBJSEAXXLA-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | phenols |
|---|
| Subclass | tyrosols and derivatives |
|---|
| Direct Parent | tyrosols and derivatives |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | alcohols and polyolshydrocarbon derivativesnitrite estersorganic o-nitroso compoundsorganic nitritesorganic nitrogen compoundsorganic oxidesphenoxy compounds |
|---|
| Substituents | alcoholmonocyclic benzene moietyorganic nitroso compoundorganic nitritearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundhydrocarbon derivativenitrite estertyrosol derivativeorganic nitrogen compoundphenoxy compoundorganooxygen compoundorganic o-nitroso compound |
|---|
