| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:38:08 UTC |
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| Update Date | 2025-03-24 14:30:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00862282 |
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| Frequency | 1.7 |
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| Structure | |
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| Chemical Formula | C6H13NO2 |
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| Molecular Mass | 131.0946 |
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| SMILES | CCCCCC=[N+]([O-])O |
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| InChI Key | ZQAPOCLGNCLLLE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | nitronic acids |
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| Subclass | nitronic acids |
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| Direct Parent | nitronic acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | allyl-type 1,3-dipolar organic compoundshydrocarbon derivativesorganic oxidesorganic oxoanionic compoundsorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | nitronic acidaliphatic acyclic compoundorganic oxideorganic oxygen compoundallyl-type 1,3-dipolar organic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic 1,3-dipolar compoundorganic nitrogen compoundorganic hyponitrite |
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