| Record Information | 
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| HMDB Status | Not Available | 
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| Creation Date | 2024-02-21 14:41:06 UTC | 
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| Update Date | 2025-03-25 00:46:55 UTC | 
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| HMDB ID | Not Available | 
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| Metabolite Identification | 
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| DeepMet ID | DMID02158222 | 
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| Frequency | 0.5 | 
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| Structure |  | 
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| Chemical Formula | C11H19NO2 | 
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| Molecular Mass | 197.1416 | 
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| SMILES | C=CC(CCCC(C)C)=NCC(=O)O | 
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| InChI Key | HTWLIESAWGWSHJ-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  | amino acids, peptides, and analogues | 
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| Direct Parent  | alpha amino acids | 
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| Geometric Descriptor  | aliphatic acyclic compounds | 
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| Alternative Parents  | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssecondary ketimines | 
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| Substituents  | aliphatic acyclic compoundketiminecarbonyl groupcarboxylic acidimineorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundsecondary ketimineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound | 
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