| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:07:49 UTC |
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| Update Date | 2025-03-21 18:30:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00080991 |
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| Frequency | 35.8 |
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| Structure | |
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| Chemical Formula | C6H8N2O3 |
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| Molecular Mass | 156.0535 |
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| SMILES | CC(=O)NC(CC#N)C(=O)O |
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| InChI Key | ZFXUKWJBUGIHTC-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 | n-acyl-alpha amino acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetamidesalpha amino acidscarbonyl compoundscarboxylic acidsfatty acids and conjugateshydrocarbon derivativesmonocarboxylic acids and derivativesnitrilesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupnitrilecarboxylic acidn-acyl-alpha-amino acidfatty acidcarboxamide groupsecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrileacetamideorganooxygen compound |
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