| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:35:03 UTC |
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| Update Date | 2025-03-25 00:20:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01287886 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C4H7NO |
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| Molecular Mass | 85.0528 |
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| SMILES | CC=NC(C)=O |
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| InChI Key | GIBNSWPQESNKRG-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 | imines |
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| Direct Parent | n-acylimines |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | n-acyliminealiphatic acyclic compoundcarbonyl grouporganic 1,3-dipolar compoundcarboxylic acid derivativepropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundorganopnictogen compoundhydrocarbon derivativeorganooxygen compound |
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