| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:03:14 UTC |
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| Update Date | 2025-03-24 20:08:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01354935 |
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| Frequency | 1.0 |
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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 | CC(C)C(=O)[N+](C)(C)[O-] |
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| InChI Key | ATNBQPNHZMIWEE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | amines |
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| Direct Parent | trisubstituted amine oxides and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganic oxoanionic compoundsorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acid derivativeorganic oxideorganic oxygen compoundtrisubstituted n-oxideorganopnictogen compoundhydrocarbon derivativeorganooxygen compoundorganic hyponitrite |
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