| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:44:20 UTC |
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| Update Date | 2025-03-24 14:02:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00732993 |
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| Frequency | 2.1 |
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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 | CCC(C)C(=O)N=O |
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| InChI Key | IUPKGJJEPGFKQT-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 acids and derivatives |
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| Direct Parent | carboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | c-nitroso compoundscarbonyl compoundshydrocarbon derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic nitroso compoundorganic 1,3-dipolar compoundcarboxylic acid derivativepropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundc-nitroso compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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