| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:46:53 UTC |
|---|
| Update Date | 2025-03-21 18:01:07 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00031071 |
|---|
| Frequency | 119.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H6O3 |
|---|
| Molecular Mass | 138.0317 |
|---|
| SMILES | CC(=O)c1ccc(C=O)o1 |
|---|
| InChI Key | COGVGDXHVCDEAN-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | furans |
|---|
| Subclass | furoic acid and derivatives |
|---|
| Direct Parent | furoic acid and derivatives |
|---|
| Geometric Descriptor | aromatic heteromonocyclic compounds |
|---|
| Alternative Parents | aryl alkyl ketonesaryl-aldehydesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsoxacyclic compounds |
|---|
| Substituents | furoic acid or derivativesaryl alkyl ketonearomatic heteromonocyclic compoundheteroaromatic compoundaldehydeketoneoxacycleorganic oxidearyl-aldehydeorganic oxygen compoundhydrocarbon derivativeorganooxygen compoundaryl ketone |
|---|
