| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:05 UTC |
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| Update Date | 2025-03-25 00:56:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02217731 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C4H5NO |
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| Molecular Mass | 83.0371 |
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| SMILES | C#CCC(N)=O |
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| InChI Key | OTDADMIMLSDQCC-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 | carboxylic acids and derivatives |
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| Subclass | carboxylic acid derivatives |
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| Direct Parent | primary carboxylic acid amides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetylidescarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | primary carboxylic acid amidealiphatic acyclic compoundcarbonyl groupacetylideorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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