| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:57:25 UTC |
|---|
| Update Date | 2025-03-21 18:05:17 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00056035 |
|---|
| Frequency | 57.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C17H21NO3 |
|---|
| Molecular Mass | 287.1521 |
|---|
| SMILES | COc1ccc2nccc(C(O)C3(O)CCCCC3)c2c1 |
|---|
| InChI Key | RSHPTTMYTWBYTI-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | quinolines and derivatives |
|---|
| Subclass | 4-quinolinemethanols |
|---|
| Direct Parent | 4-quinolinemethanols |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1,2-diols2-halopyridinesalkyl aryl ethersanisolesaromatic alcoholsazacyclic compoundscyclic alcohols and derivativescyclohexanolsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinestertiary alcohols |
|---|
| Substituents | aromatic alcoholphenol etheretherpolyhalopyridinealkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridine1,2-diolalcoholazacycleheteroaromatic compoundhydroxypyridinecyclohexanolmethylpyridine4-quinolinemethanolcyclic alcoholtertiary alcoholpyridineorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
|---|
