| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:48:48 UTC |
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| Update Date | 2025-03-24 21:47:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01893105 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C5H9ClO |
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| Molecular Mass | 120.0342 |
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| SMILES | CC(Cl)C(C)C=O |
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| InChI Key | JQAPARIZICHJFH-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 | alkyl chlorides |
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| Direct Parent | alkyl chlorides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | aldehydeshydrocarbon derivativesorganic oxidesorganochlorides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundalkyl chlorideorganochloridealdehydehydrocarbon derivativeorganooxygen compound |
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