| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:35:57 UTC |
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| Update Date | 2025-03-21 17:57:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00006007 |
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| Frequency | 1258.2 |
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| Structure | |
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| Chemical Formula | C6H12N2O3 |
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| Molecular Mass | 160.0848 |
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| SMILES | CCC(NC(=O)CN)C(=O)O |
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| InChI Key | XHUWGEILXFVFMR-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 | dipeptides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidscarbonyl compoundscarboxylic acidsfatty acids and conjugateshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesn-acyl-alpha amino acidsorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidalpha-amino acid amiden-acyl-alpha-amino acidfatty acidalpha-amino acid or derivativescarboxamide groupalpha-dipeptidesecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundn-acyl-alpha amino acid or derivatives |
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