| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 03:12:58 UTC |
|---|
| Update Date | 2025-03-21 22:12:26 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00515700 |
|---|
| Frequency | 3.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H12 |
|---|
| Molecular Mass | 96.0939 |
|---|
| SMILES | CC(C)C1=CCC1 |
|---|
| InChI Key | HXHIATTUBFNQHT-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | hydrocarbons |
|---|
| Class | unsaturated hydrocarbons |
|---|
| Subclass | branched unsaturated hydrocarbons |
|---|
| Direct Parent | branched unsaturated hydrocarbons |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | cyclic olefinsunsaturated aliphatic hydrocarbons |
|---|
| Substituents | cyclic olefinbranched unsaturated hydrocarbonaliphatic homomonocyclic compoundunsaturated aliphatic hydrocarbonolefin |
|---|
