| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:15:32 UTC |
|---|
| Update Date | 2025-03-25 00:59:23 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02236806 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C13H21NO4 |
|---|
| Molecular Mass | 255.1471 |
|---|
| SMILES | COc1cc(C(CO)OCCN(C)C)ccc1O |
|---|
| InChI Key | NSAIYGRSRXREFD-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | phenols |
|---|
| Subclass | methoxyphenols |
|---|
| Direct Parent | methoxyphenols |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesbenzylethersdialkyl ethershydrocarbon derivativesmethoxybenzenesorganopnictogen compoundsphenoxy compoundsprimary alcoholstrialkylamines |
|---|
| Substituents | phenol ethermonocyclic benzene moietyetherbenzylether1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etherdialkyl etherorganonitrogen compoundorganopnictogen compoundprimary alcoholtertiary aminealcoholtertiary aliphatic aminemethoxybenzenearomatic homomonocyclic compoundorganic oxygen compoundanisolehydrocarbon derivativeorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
|---|
