| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:14:50 UTC |
|---|
| Update Date | 2025-03-25 00:59:08 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02235261 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C14H16O2 |
|---|
| Molecular Mass | 216.115 |
|---|
| SMILES | Cc1ccc2c(c(=O)c1)C(=O)CCC2(C)C |
|---|
| InChI Key | UBGIYEFWLAWZEC-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | hydrocarbon derivatives |
|---|
| Class | tropones |
|---|
| Subclass | tropones |
|---|
| Direct Parent | tropones |
|---|
| Geometric Descriptor | aromatic homopolycyclic compounds |
|---|
| Alternative Parents | aryl alkyl ketonesorganic oxidesorganooxygen compounds |
|---|
| Substituents | ketoneorganic oxidetroponearyl alkyl ketoneorganic oxygen compoundaromatic homopolycyclic compoundorganooxygen compoundaryl ketone |
|---|
