| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:19:53 UTC |
|---|
| Update Date | 2025-03-21 18:36:19 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00110091 |
|---|
| Frequency | 24.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H10O8 |
|---|
| Molecular Mass | 234.0376 |
|---|
| SMILES | O=C(O)C1(O)CC(O)C(O)(C(=O)O)CC1=O |
|---|
| InChI Key | IEBGAXKOSXVWOY-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | hydroxy acids and derivatives |
|---|
| Subclass | beta hydroxy acids and derivatives |
|---|
| Direct Parent | beta hydroxy acids and derivatives |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | acyloinsalpha hydroxy acids and derivativescarboxylic acidscyclic ketonescyclitols and derivativesdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidessecondary alcoholstertiary alcohols |
|---|
| Substituents | alcoholcarbonyl groupcarboxylic acidalpha-hydroxy acidcyclitol or derivativescyclic ketonecyclic alcoholcarboxylic acid derivativeketonebeta-hydroxy acidtertiary alcoholorganic oxideorganic oxygen compoundacyloinsecondary alcoholaliphatic homomonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
|---|
