Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 03:53:29 UTC |
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Update Date | 2025-03-21 22:59:41 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00612396 |
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Frequency | 2.6 |
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Structure | |
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Chemical Formula | C4H9ClO |
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Molecular Mass | 108.0342 |
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SMILES | CC(O)CCCl |
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InChI Key | AKMIPCJUTXDZKR-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 | alcohols and polyols |
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Direct Parent | secondary alcohols |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | alkyl chlorideshydrocarbon derivativesorganochlorides |
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Substituents | aliphatic acyclic compoundalkyl chlorideorganochloridesecondary alcoholalkyl halidehydrocarbon derivativeorganohalogen compound |
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