| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:13:35 UTC |
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| Update Date | 2025-03-21 18:33:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00094590 |
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| Frequency | 29.4 |
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| Structure | |
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| Chemical Formula | C11H6Cl3NO |
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| Molecular Mass | 272.9515 |
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| SMILES | Clc1ccc(Oc2ccc(Cl)cc2Cl)nc1 |
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| InChI Key | WISATVXQDWDYOW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | ethers |
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| Direct Parent | diarylethers |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesaryl chloridesazacyclic compoundsdichlorobenzenesheteroaromatic compoundshydrocarbon derivativesorganochloridesorganonitrogen compoundsorganopnictogen compoundsphenol ethersphenoxy compoundspolyhalopyridinespyridines and derivatives |
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| Substituents | diaryl etherphenol ethermonocyclic benzene moietyaromatic heteromonocyclic compoundpolyhalopyridineorganochlorideorganohalogen compound1,3-dichlorobenzeneorganonitrogen compoundorganopnictogen compound2-halopyridineorganoheterocyclic compoundaryl chloridechlorobenzeneazacycleheteroaromatic compoundaryl halidepyridinehydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzenephenoxy compound |
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