| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:46:02 UTC |
|---|
| Update Date | 2025-03-21 18:00:44 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00029068 |
|---|
| Frequency | 129.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C12H18Cl4O7 |
|---|
| Molecular Mass | 413.9807 |
|---|
| SMILES | OC1C(OC2(CCl)OC(CCl)C(O)C2O)OC(CCl)C(Cl)C1O |
|---|
| InChI Key | XKSVHODTAIJZNZ-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | ethers |
|---|
| Direct Parent | ketals |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | alkyl chlorideschlorohydrinshydrocarbon derivativesmonosaccharidesorganochloridesoxacyclic compoundsoxanessecondary alcoholstetrahydrofurans |
|---|
| Substituents | alcoholchlorohydrintetrahydrofuranhalohydrinalkyl chlorideorganochloridemonosaccharideorganohalogen compoundoxacyclesaccharideketalaliphatic heteromonocyclic compoundsecondary alcoholalkyl halidehydrocarbon derivativeoxaneorganoheterocyclic compound |
|---|
