| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:01:19 UTC |
|---|
| Update Date | 2025-03-25 00:54:08 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02204260 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H4Cl3NO |
|---|
| Molecular Mass | 210.9358 |
|---|
| SMILES | Oc1cccnc1C(Cl)(Cl)Cl |
|---|
| InChI Key | BIXZWHLDDCMUQM-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-halopyridinesalkyl chloridesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
|---|
| Substituents | aromatic heteromonocyclic compoundazacyclealkyl chloridepolyhalopyridineorganochlorideheteroaromatic compoundhydroxypyridineorganohalogen compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundalkyl halidehydrocarbon derivative2-halopyridineorganic nitrogen compoundorganooxygen compound |
|---|