| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:59:16 UTC |
|---|
| Update Date | 2025-03-25 00:53:26 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02199579 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C12H12O4 |
|---|
| Molecular Mass | 220.0736 |
|---|
| SMILES | Cc1ccc2c(c1)OC(=O)C2CCC(=O)O |
|---|
| InChI Key | SZVMLNVLEDVGTP-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzofurans |
|---|
| Subclass | benzofuranones |
|---|
| Direct Parent | benzofuranones |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | benzenoidscarbonyl compoundscarboxylic acid esterscarboxylic acidscoumaransdicarboxylic acids and derivativeshydrocarbon derivativeslactonesorganic oxidesoxacyclic compounds |
|---|
| Substituents | carbonyl groupcarboxylic acidbenzofuranonecarboxylic acid derivativelactoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundcarboxylic acid esterdicarboxylic acid or derivativeshydrocarbon derivativebenzenoidcoumaranorganooxygen compound |
|---|
