| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:11:33 UTC |
|---|
| Update Date | 2025-03-25 00:57:58 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02227830 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H8O2 |
|---|
| Molecular Mass | 124.0524 |
|---|
| SMILES | C=C1COC(C)=CC1=O |
|---|
| InChI Key | WISLXNBXYMTBRN-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrans |
|---|
| Subclass | pyranones and derivatives |
|---|
| Direct Parent | dihydropyranones |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | cyclic ketoneshydrocarbon derivativesorganic oxidesoxacyclic compoundsvinylogous esters |
|---|
| Substituents | carbonyl groupdihydropyranonevinylogous estercyclic ketoneketoneoxacycleorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivativeorganooxygen compound |
|---|
