| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:23:28 UTC |
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| Update Date | 2025-03-24 14:18:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00827163 |
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| Frequency | 1.8 |
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| Structure | |
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| Chemical Formula | C6H14NO2+ |
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| Molecular Mass | 132.1019 |
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| SMILES | CCCCO[N+](=O)CC |
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| InChI Key | JPLGQXDFLWOUKD-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic 1,3-dipolar compounds |
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| Class | allyl-type 1,3-dipolar organic compounds |
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| Subclass | organic nitro compounds |
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| Direct Parent | organic nitro compounds |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl nitriteshydrocarbon derivativesn-organohydroxylaminesorganic cationsorganic oxidesorganic oxoazanium compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundn-organohydroxylamineorganic nitro compoundalkyl nitriteorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic oxoazaniumorganooxygen compound |
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