| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:19:37 UTC |
|---|
| Update Date | 2025-03-25 01:01:00 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02246226 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C13H17ClO |
|---|
| Molecular Mass | 224.0968 |
|---|
| SMILES | CC1(C)COC(C)(c2ccc(Cl)cc2)C1 |
|---|
| InChI Key | YQPFGDBLYHUCRR-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | halobenzenes |
|---|
| Direct Parent | chlorobenzenes |
|---|
| Geometric Descriptor | aromatic heteromonocyclic compounds |
|---|
| Alternative Parents | aryl chloridesdialkyl ethershydrocarbon derivativesorganochloridesoxacyclic compoundstetrahydrofurans |
|---|
| Substituents | aryl chloridechlorobenzeneetheraromatic heteromonocyclic compoundtetrahydrofuranorganochlorideorganohalogen compounddialkyl etheraryl halideoxacycleorganic oxygen compoundhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
|---|