| Record Information |
|---|
| HMDB Status | quantified |
|---|
| Creation Date | 2024-02-20 23:35:12 UTC |
|---|
| Update Date | 2025-03-21 17:56:54 UTC |
|---|
| HMDB ID | HMDB0039618 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00004334 |
|---|
| Name | Propyl butyrate |
|---|
| Frequency | 1298.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H14O2 |
|---|
| Molecular Mass | 130.0994 |
|---|
| SMILES | CCCOC(=O)CCC |
|---|
| InChI Key | HUAZGNHGCJGYNP-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | lipids and lipid-like molecules |
|---|
| Class | fatty acyls |
|---|
| Subclass | fatty acid esters |
|---|
| Direct Parent | fatty acid esters |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | carbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
|---|
| Substituents | aliphatic acyclic compoundfatty acid estercarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativecarboxylic acid derivativeorganooxygen compound |
|---|
