| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:52:30 UTC |
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| Update Date | 2025-03-24 22:24:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01183982 |
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| Frequency | 1.1 |
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| Structure | |
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| Chemical Formula | C6H7ClO |
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| Molecular Mass | 130.0185 |
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| SMILES | CC1=C(Cl)C(=O)CC1 |
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| InChI Key | KODDSHDLXJLETK-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 | carbonyl compounds |
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| Direct Parent | alpha-chloroketones |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | chloroalkenescyclic ketoneshydrocarbon derivativesorganic oxidesorganochloridesvinyl chlorides |
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| Substituents | chloroalkeneorganochloridecyclic ketoneorganohalogen compoundalpha-chloroketoneorganic oxidevinyl halidehaloalkenealiphatic homomonocyclic compoundhydrocarbon derivativevinyl chloride |
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