| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:47:36 UTC |
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| Update Date | 2025-03-21 18:01:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00032779 |
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| Frequency | 111.2 |
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| Structure | |
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| Chemical Formula | C6H7Cl5 |
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| Molecular Mass | 253.899 |
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| SMILES | ClC1CC(Cl)C(Cl)C(Cl)C1Cl |
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| InChI Key | SCTBPPSXYXJCFE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organohalogen compounds |
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| Class | alkyl halides |
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| Subclass | cyclohexyl halides |
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| Direct Parent | cyclohexyl halides |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | alkyl chlorideshydrocarbon derivativesorganochlorides |
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| Substituents | alkyl chlorideorganochloridealiphatic homomonocyclic compoundcyclohexyl halidehydrocarbon derivative |
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