| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:29:08 UTC |
|---|
| Update Date | 2025-03-21 18:41:02 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00132131 |
|---|
| Frequency | 19.1 |
|---|
| Structure | |
|---|
| Chemical Formula | C18H21FN2O |
|---|
| Molecular Mass | 300.1638 |
|---|
| SMILES | CN(C)CCCC1(c2ccc(F)cc2)OCc2ncccc21 |
|---|
| InChI Key | GDTRMYLFLCVBNY-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 | 2-halopyridinesaryl fluoridesazacyclic compoundsdialkyl ethersfluorobenzenesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganofluoridesorganopnictogen compoundsoxacyclic compoundspolyhalopyridinestrialkylamines |
|---|
| Substituents | aryl fluorideetherpolyhalopyridineorganohalogen compounddialkyl etherfluorobenzenephenylbutylaminearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinetertiary amineorganoheterocyclic compoundazacycleorganofluorideheteroaromatic compoundtertiary aliphatic aminemethylpyridinearyl halideoxacyclepyridineorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundhalobenzeneamineorganooxygen compound |
|---|
