Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 00:14:24 UTC |
---|
Update Date | 2025-03-21 18:33:35 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00096587 |
---|
Frequency | 28.6 |
---|
Structure | |
---|
Chemical Formula | C11H17NO2 |
---|
Molecular Mass | 195.1259 |
---|
SMILES | Cc1ncc(CO)c(C(C)(C)C)c1O |
---|
InChI Key | WMYXGXYTKZDNKA-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | organoheterocyclic compounds |
---|
Class | pyridines and derivatives |
---|
Subclass | halopyridines |
---|
Direct Parent | polyhalopyridines |
---|
Geometric Descriptor | aromatic heteromonocyclic compounds |
---|
Alternative Parents | 2-halopyridinesaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesorganonitrogen compoundsorganopnictogen compounds |
---|
Substituents | aromatic alcoholalcoholaromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridinemethylpyridineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganooxygen compound |
---|