| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:23:46 UTC |
|---|
| Update Date | 2025-03-21 18:38:11 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00119464 |
|---|
| Frequency | 21.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C15H16 |
|---|
| Molecular Mass | 196.1252 |
|---|
| SMILES | Cc1ccc(-c2ccc(C)c(C)c2)cc1 |
|---|
| InChI Key | BMLWGFRPPLURHG-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | xylenes |
|---|
| Direct Parent | o-xylenes |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | saturated hydrocarbonstoluenes |
|---|
| Substituents | aromatic homomonocyclic compoundsaturated hydrocarbono-xylenetoluenehydrocarbon |
|---|
