| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:44:32 UTC |
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| Update Date | 2025-03-24 21:45:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01883071 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C7H7ClO |
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| Molecular Mass | 142.0185 |
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| SMILES | CC1=CC(C)=C(Cl)C1=O |
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| InChI Key | OQAAEUHIVJUMGS-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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