| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:10:27 UTC |
|---|
| Update Date | 2025-03-25 00:57:32 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02225415 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C18H30O7 |
|---|
| Molecular Mass | 358.1992 |
|---|
| SMILES | CC(=O)OC(C(=O)C(OC(=O)C(C)C)C(C)C)C(OC(C)=O)C(C)C |
|---|
| InChI Key | APINGBIYAHMMDA-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | carboxylic acids and derivatives |
|---|
| Subclass | tricarboxylic acids and derivatives |
|---|
| Direct Parent | tricarboxylic acids and derivatives |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alpha-acyloxy ketonescarboxylic acid estershydrocarbon derivativesketonesorganic oxides |
|---|
| Substituents | ketonealiphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundalpha-acyloxy ketonecarboxylic acid esterhydrocarbon derivativetricarboxylic acid or derivativesorganooxygen compound |
|---|
