| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:49:17 UTC |
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| Update Date | 2025-03-24 20:29:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01463843 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C4H9F2NO |
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| Molecular Mass | 125.0652 |
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| SMILES | NCCCC(O)(F)F |
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| InChI Key | PCFSRKGUZSZMMW-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 fluorides |
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| Direct Parent | alkyl fluorides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alcohols and polyolshydrocarbon derivativesmonoalkylaminesorganofluoridesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | alcoholaliphatic acyclic compoundalkyl fluorideorganofluorideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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