| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:01:03 UTC |
|---|
| Update Date | 2025-03-25 00:54:02 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02203657 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H6O6 |
|---|
| Molecular Mass | 186.0164 |
|---|
| SMILES | O=C(O)CCC1=C(O)OC(=O)C1=O |
|---|
| InChI Key | VCESJZPVNFIEMT-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | dihydrofurans |
|---|
| Subclass | furanones |
|---|
| Direct Parent | furanones |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | carboxylic acid esterscarboxylic acidscyclic ketonesdicarboxylic acids and derivativeshydrocarbon derivativeslactonesorganic oxidesoxacyclic compoundsvinylogous acids |
|---|
| Substituents | carbonyl groupcarboxylic acidcyclic ketonecarboxylic acid derivativeketonelactoneoxacyclevinylogous acidorganic oxideorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivative3-furanoneorganooxygen compound |
|---|
