| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:07:20 UTC |
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| Update Date | 2025-03-25 00:34:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02079507 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C4H9ClO2 |
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| Molecular Mass | 124.0291 |
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| SMILES | OCC(CO)CCl |
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| InChI Key | NDDOYTYNJXNMFY-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 | primary 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 chlorideorganochloridealkyl halidehydrocarbon derivativeorganohalogen compoundprimary alcohol |
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