| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 08:14:20 UTC |
|---|
| Update Date | 2025-03-24 22:45:40 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01238450 |
|---|
| Frequency | 1.1 |
|---|
| Structure | |
|---|
| Chemical Formula | C5H12O4 |
|---|
| Molecular Mass | 136.0736 |
|---|
| SMILES | CC(O)CCC(O)(O)O |
|---|
| InChI Key | YCIOOZQDANBBPR-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | orthocarboxylic acid derivatives |
|---|
| Subclass | orthocarboxylic acid derivatives |
|---|
| Direct Parent | orthocarboxylic acid derivatives |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivativesortho acidssecondary alcohols |
|---|
| Substituents | alcoholaliphatic acyclic compoundorganic oxygen compoundsecondary alcoholortho acidhydrocarbon derivativeorthocarboxylic acid derivativeorganooxygen compound |
|---|
