| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:09 UTC |
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| Update Date | 2025-03-25 00:59:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235962 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H12Cl4O5 |
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| Molecular Mass | 375.9439 |
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| SMILES | OCC1OC(Oc2c(Cl)cc(Cl)cc2Cl)C(O)C(O)C1Cl |
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| InChI Key | JGIONHSAFWSQHF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenol ethers |
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| Subclass | phenol ethers |
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| Direct Parent | phenol ethers |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | acetalsalkyl chloridesaryl chlorideschlorobenzeneschlorohydrinshydrocarbon derivativesmonosaccharidesorganochloridesoxacyclic compoundsoxanesphenoxy compoundsprimary alcoholssecondary alcohols |
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| Substituents | phenol ethermonocyclic benzene moietychlorohydrinaromatic heteromonocyclic compoundalkyl chlorideorganochloridemonosaccharideorganohalogen compoundsaccharideacetalalkyl halideoxaneprimary alcoholorganoheterocyclic compoundaryl chloridechlorobenzenealcoholhalohydrinaryl halideoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativehalobenzenephenoxy compoundorganooxygen compound |
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