| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:46:52 UTC |
|---|
| Update Date | 2025-03-25 00:48:59 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02171293 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H10O4 |
|---|
| Molecular Mass | 158.0579 |
|---|
| SMILES | COC1CCC(=O)C(O)=C1O |
|---|
| InChI Key | PWCRQJXMQZSAJH-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | cyclohexenones |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | dialkyl ethershydrocarbon derivativesorganic oxidesvinylogous acids |
|---|
| Substituents | cyclohexenoneetherdialkyl ethervinylogous acidorganic oxidealiphatic homomonocyclic compoundhydrocarbon derivative |
|---|
