Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 10:53:38 UTC |
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Update Date | 2025-03-24 20:56:24 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01618193 |
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Frequency | 0.8 |
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Structure | |
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Chemical Formula | C4H5NO2 |
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Molecular Mass | 99.032 |
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SMILES | O=C(O)C1=NCC1 |
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InChI Key | WJQLZCLSXZKHMN-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 | ketimines |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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Substituents | ketiminecarbonyl groupcarboxylic acidazacycleorganic 1,3-dipolar compoundcarboxylic acid derivativepropargyl-type 1,3-dipolar organic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundorganopnictogen compoundhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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