| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:42:50 UTC |
|---|
| Update Date | 2025-03-21 17:59:32 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00021667 |
|---|
| Frequency | 184.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H5FO2 |
|---|
| Molecular Mass | 140.0274 |
|---|
| SMILES | O=C(O)c1ccccc1F |
|---|
| InChI Key | NSTREUWFTAOOKS-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | benzoic acids and derivatives |
|---|
| Direct Parent | 2-halobenzoic acids |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1-carboxy-2-haloaromatic compoundsaryl fluoridesbenzoic acidsbenzoyl derivativesfluorobenzeneshalobenzoic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganofluoridesorganooxygen compoundsvinylogous halides |
|---|
| Substituents | aryl fluoride2-halobenzoic acidcarboxylic acidbenzoylcarboxylic acid derivativeorganohalogen compoundfluorobenzeneorganic oxide1-carboxy-2-haloaromatic compoundbenzoic acidhalobenzoic acidorganofluoridevinylogous halidearyl halidearomatic homomonocyclic compoundmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativehalobenzeneorganooxygen compound |
|---|
