| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:32:27 UTC |
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| Update Date | 2025-03-24 20:22:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01425103 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C6H11NO |
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| Molecular Mass | 113.0841 |
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| SMILES | C=CCNCC(C)=O |
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| InChI Key | DDJPCDRFJLBROL-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 | dialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundsecondary aliphatic aminesecondary amineketoneorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundamine |
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