| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:02:37 UTC |
|---|
| Update Date | 2025-03-21 18:07:18 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00068440 |
|---|
| Frequency | 44.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C19H22N2O4 |
|---|
| Molecular Mass | 342.158 |
|---|
| SMILES | C=CC1(O)CN2CCC1OC2C(O)c1ccnc2ccc(OC)cc12 |
|---|
| InChI Key | PWCZCVANTARUFA-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 | 1,3-oxazinanes2-halopyridinesalkyl aryl ethersanisolesaromatic alcoholsazacyclic compoundshemiaminalsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspiperidinespolyhalopyridinessecondary alcoholstertiary alcohols |
|---|
| Substituents | aromatic alcoholphenol etheretherpolyhalopyridinealkyl aryl etherhemiaminalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinepiperidinealcoholazacycleheteroaromatic compoundhydroxypyridine1,3-oxazinanemethylpyridine4-quinolinemethanoloxazinaneoxacycletertiary alcoholpyridineorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
|---|
