| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:35:24 UTC |
|---|
| Update Date | 2025-03-21 17:56:58 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00004797 |
|---|
| Frequency | 1151.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H14O |
|---|
| Molecular Mass | 138.1045 |
|---|
| SMILES | CC(=O)C1=C(C)CCCC1 |
|---|
| InChI Key | ZLSWYDUVHMPLTD-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | ketones |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivativesorganic oxides |
|---|
| Substituents | ketoneorganic oxidealiphatic homomonocyclic compoundhydrocarbon derivative |
|---|
