| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:15:00 UTC |
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| Update Date | 2025-03-24 21:33:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01813524 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C5H9NO2 |
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| Molecular Mass | 115.0633 |
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| SMILES | CCNC(=O)CC=O |
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| InChI Key | CNSQBBYLYQXGGP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | alpha-hydrogen aldehydes |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | aliphatic acyclic compoundcarboxamide groupcarboxylic acid derivativesecondary carboxylic acid amideorganic oxidealpha-hydrogen aldehydeorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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