| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:08:15 UTC |
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| Update Date | 2025-03-21 22:10:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00504895 |
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| Frequency | 3.4 |
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| Structure | |
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| Chemical Formula | C5H6N2O2 |
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| Molecular Mass | 126.0429 |
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| SMILES | CC(C#N)=NCC(=O)O |
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| InChI Key | OZWAOZHUMNCPED-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 derivativesnitrilesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssecondary ketimines |
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| Substituents | aliphatic acyclic compoundketiminecarbonyl groupnitrilecarboxylic acidimineorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundsecondary ketimineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrileorganooxygen compound |
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