| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:59:41 UTC |
|---|
| Update Date | 2025-03-25 00:53:35 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02200539 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C17H19NO4 |
|---|
| Molecular Mass | 301.1314 |
|---|
| SMILES | COc1ccc(CC2Cc3cc(OC)c(O)cc3N2)cc1O |
|---|
| InChI Key | NJPWLKBVZZMFAS-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | phenols |
|---|
| Subclass | methoxyphenols |
|---|
| Direct Parent | methoxyphenols |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisolesazacyclic compoundshydrocarbon derivativesindolesindolinesmethoxybenzenesorganopnictogen compoundsphenoxy compoundssecondary alkylarylamines |
|---|
| Substituents | phenol ethermonocyclic benzene moietyetherindole1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compounddihydroindoleorganoheterocyclic compoundazacycleindole or derivatives1-hydroxy-4-unsubstituted benzenoidsecondary aminemethoxybenzenesecondary aliphatic/aromatic amineorganic oxygen compoundanisolehydrocarbon derivativeorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
|---|
