| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 07:48:00 UTC |
|---|
| Update Date | 2025-03-24 22:22:11 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01173443 |
|---|
| Frequency | 1.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H12 |
|---|
| Molecular Mass | 108.0939 |
|---|
| SMILES | CC1=CC2CCC2C1 |
|---|
| InChI Key | KOSOMZGYXGBFSF-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | hydrocarbons |
|---|
| Class | polycyclic hydrocarbons |
|---|
| Subclass | polycyclic hydrocarbons |
|---|
| Direct Parent | polycyclic hydrocarbons |
|---|
| Geometric Descriptor | aliphatic homopolycyclic compounds |
|---|
| Alternative Parents | branched unsaturated hydrocarbonscyclic olefinsunsaturated aliphatic hydrocarbons |
|---|
| Substituents | cyclic olefinbranched unsaturated hydrocarbonunsaturated aliphatic hydrocarbonolefinpolycyclic hydrocarbonunsaturated hydrocarbonaliphatic homopolycyclic compound |
|---|
