| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:08:30 UTC |
|---|
| Update Date | 2025-03-21 18:30:31 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00082569 |
|---|
| Frequency | 35.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C10H3Cl9O |
|---|
| Molecular Mass | 453.7381 |
|---|
| SMILES | ClC1=C(Cl)C2(Cl)C3(Cl)C4OC4(Cl)C(Cl)C3C1(Cl)C2(Cl)Cl |
|---|
| InChI Key | BJVYZMAHSGMYQM-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | oxocins |
|---|
| Subclass | oxocins |
|---|
| Direct Parent | oxocins |
|---|
| Geometric Descriptor | aliphatic heteropolycyclic compounds |
|---|
| Alternative Parents | alkyl chlorideschloroalkenesdialkyl ethersepoxideshydrocarbon derivativesorganochloridesoxacyclic compoundsoxanesvinyl chlorides |
|---|
| Substituents | etheralkyl chloridechloroalkeneorganochlorideoxiraneorganohalogen compounddialkyl etheraliphatic heteropolycyclic compoundoxacycleorganic oxygen compoundvinyl halidehaloalkenealkyl halidehydrocarbon derivativevinyl chlorideoxaneorganooxygen compoundoxocin |
|---|
