| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:08:42 UTC |
|---|
| Update Date | 2025-03-25 00:56:54 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02221491 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H11FO4 |
|---|
| Molecular Mass | 190.0641 |
|---|
| SMILES | O=C(O)CCCCC=C(F)C(=O)O |
|---|
| InChI Key | OSGNNXRJYJPXBO-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | lipids and lipid-like molecules |
|---|
| Class | fatty acyls |
|---|
| Subclass | fatty acids and conjugates |
|---|
| Direct Parent | medium-chain fatty acids |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alpha-halocarboxylic acidscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesfluoroalkeneshalogenated fatty acidshydrocarbon derivativesorganic oxidesorganofluoridesunsaturated fatty acidsvinyl fluorides |
|---|
| Substituents | alpha-halocarboxylic acid or derivativeshalogenated fatty acidaliphatic acyclic compoundcarbonyl groupcarboxylic acidorganofluoridealpha-halocarboxylic acidvinyl fluoridecarboxylic acid derivativeorganohalogen compoundunsaturated fatty acidorganic oxideorganic oxygen compoundvinyl halidehaloalkenedicarboxylic acid or derivativeshydrocarbon derivativemedium-chain fatty acidfluoroalkeneorganooxygen compound |
|---|
