| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:01:08 UTC |
|---|
| Update Date | 2025-03-25 00:54:04 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02203859 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C13H16N2O |
|---|
| Molecular Mass | 216.1263 |
|---|
| SMILES | OC1CCC(c2c[nH]c3ncccc23)CC1 |
|---|
| InChI Key | WQXJCSLKJKAEJT-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrrolopyridines |
|---|
| Subclass | pyrrolopyridines |
|---|
| Direct Parent | pyrrolopyridines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 2-halopyridinesazacyclic compoundscyclic alcohols and derivativescyclohexanolsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinespyrroles |
|---|
| Substituents | alcoholazacyclepyrrolopyridinepolyhalopyridineheteroaromatic compoundhydroxypyridinecyclohexanolcyclic alcoholpyridineorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganooxygen compound |
|---|
