| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:00:44 UTC |
|---|
| Update Date | 2025-03-21 18:06:35 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00063874 |
|---|
| Frequency | 48.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C11H14 |
|---|
| Molecular Mass | 146.1096 |
|---|
| SMILES | C=C(CC)c1ccc(C)cc1 |
|---|
| InChI Key | FOLXOMPYJCUHMX-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | phenylpropanes |
|---|
| Direct Parent | phenylpropanes |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | branched unsaturated hydrocarbonscyclic olefinstoluenesunsaturated aliphatic hydrocarbons |
|---|
| Substituents | phenylpropanearomatic homomonocyclic compoundcyclic olefinbranched unsaturated hydrocarbonunsaturated aliphatic hydrocarbonolefintoluenehydrocarbonunsaturated hydrocarbon |
|---|
