| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:58:45 UTC |
|---|
| Update Date | 2025-03-21 18:05:49 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00059186 |
|---|
| Frequency | 53.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C16H14N2O |
|---|
| Molecular Mass | 250.1106 |
|---|
| SMILES | COc1ccc2nccc(Nc3ccccc3)c2c1 |
|---|
| InChI Key | YCNIXJQEYBVSLH-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | quinolines and derivatives |
|---|
| Subclass | quinolines and derivatives |
|---|
| Direct Parent | quinolines and derivatives |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 2-halopyridinesalkyl aryl ethersanisolesazacyclic compoundsbenzene and substituted derivativesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganopnictogen compoundspolyhalopyridinessecondary amines |
|---|
| Substituents | phenol ethermonocyclic benzene moietyetherazacyclepolyhalopyridineheteroaromatic compoundmethylpyridinealkyl aryl ethersecondary aminepyridineorganic oxygen compoundaromatic heteropolycyclic compoundanisoleorganonitrogen compoundquinolineorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundorganooxygen compoundamine |
|---|
