| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 17:18:30 UTC |
|---|
| Update Date | 2025-03-25 01:47:53 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02521983 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C5H7ClO2 |
|---|
| Molecular Mass | 134.0135 |
|---|
| SMILES | O=C(O)CCC=CCl |
|---|
| InChI Key | QFGFLTQPXRCNTD-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | lipids and lipid-like molecules |
|---|
| Class | fatty acyls |
|---|
| Subclass | fatty acids and conjugates |
|---|
| Direct Parent | halogenated fatty acids |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | carbonyl compoundscarboxylic acidschloroalkenesfatty acylshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesstraight chain fatty acidsvinyl chlorides |
|---|
| Substituents | halogenated fatty acidaliphatic acyclic compoundcarbonyl groupstraight chain fatty acidcarboxylic acidchloroalkeneorganochloridecarboxylic acid derivativeorganohalogen compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundvinyl halidehaloalkenehydrocarbon derivativevinyl chlorideorganooxygen compound |
|---|
