| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:58:48 UTC |
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| Update Date | 2025-03-24 19:50:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01055291 |
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| Frequency | 1.3 |
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| Structure | |
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| Chemical Formula | C4H6N2O |
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| Molecular Mass | 98.048 |
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| SMILES | CC(N)C(=O)C#N |
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| InChI Key | GEAGHVMKRXFPJT-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 | ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acyl cyanideshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundnitrileketoneorganic oxideacyl cyanideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundcarbonitrile |
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