| Record Information |
|---|
| HMDB Status | expected |
|---|
| Creation Date | 2024-02-20 23:40:10 UTC |
|---|
| Update Date | 2025-03-21 17:58:38 UTC |
|---|
| HMDB ID | HMDB0038339 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00015773 |
|---|
| Name | alpha-Methoxy-1H-indole-3-propanoic acid |
|---|
| Frequency | 273.7 |
|---|
| Structure | |
|---|
| Chemical Formula | C12H13NO3 |
|---|
| Molecular Mass | 219.0895 |
|---|
| SMILES | COC(Cc1c[nH]c2ccccc12)C(=O)O |
|---|
| InChI Key | WTRLCCDSRUPILA-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | indoles and derivatives |
|---|
| Subclass | indoles |
|---|
| Direct Parent | indoles |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | azacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidsdialkyl ethersheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrroles |
|---|
| Substituents | carbonyl groupethercarboxylic acidazacycleindoleheteroaromatic compoundcarboxylic acid derivativedialkyl etherorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
|---|