| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:06:30 UTC |
|---|
| Update Date | 2025-03-21 18:29:30 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00077777 |
|---|
| Frequency | 37.7 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H12 |
|---|
| Molecular Mass | 108.0939 |
|---|
| SMILES | C=CC(C=C)=CCC |
|---|
| InChI Key | DBQVPSZNMNUZLR-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | hydrocarbons |
|---|
| Class | unsaturated hydrocarbons |
|---|
| Subclass | branched unsaturated hydrocarbons |
|---|
| Direct Parent | branched unsaturated hydrocarbons |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alkatrienesunsaturated aliphatic hydrocarbons |
|---|
| Substituents | aliphatic acyclic compoundbranched unsaturated hydrocarbonalkatrieneunsaturated aliphatic hydrocarbonolefinacyclic olefin |
|---|
