| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:56:44 UTC |
|---|
| Update Date | 2025-03-25 00:52:27 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02193760 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C19H18Cl4FNO |
|---|
| Molecular Mass | 435.0127 |
|---|
| SMILES | CN(C)CCCC1(c2ccc(F)cc2)OCc2c(Cl)c(Cl)c(Cl)c(Cl)c21 |
|---|
| InChI Key | CNZOFLNIQGOMGG-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | phenylbutylamines |
|---|
| Direct Parent | phenylbutylamines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | aryl chloridesaryl fluoridesdialkyl ethersfluorobenzeneshydrocarbon derivativesisocoumaransorganochloridesorganofluoridesorganopnictogen compoundsoxacyclic compoundstrialkylamines |
|---|
| Substituents | aryl fluorideetherorganochlorideorganohalogen compounddialkyl etherfluorobenzenephenylbutylamineisocoumaranaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundtertiary amineorganoheterocyclic compoundaryl chlorideorganofluoridetertiary aliphatic aminearyl halideoxacycleorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundhalobenzeneamineorganooxygen compound |
|---|
