| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:42:56 UTC |
|---|
| Update Date | 2025-03-21 17:59:34 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00021877 |
|---|
| Frequency | 182.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C13H20 |
|---|
| Molecular Mass | 176.1565 |
|---|
| SMILES | CCCCCCc1ccc(C)cc1 |
|---|
| InChI Key | BCJOBVWKIGRZCW-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | toluenes |
|---|
| Direct Parent | toluenes |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | saturated hydrocarbons |
|---|
| Substituents | aromatic homomonocyclic compoundsaturated hydrocarbontoluenehydrocarbon |
|---|
