| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:35:58 UTC |
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| Update Date | 2025-03-21 17:57:09 UTC |
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| HMDB ID | HMDB0028726 |
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| Metabolite Identification |
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| DeepMet ID | DMID00006055 |
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| Name | Asparaginylasparagine |
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| Frequency | 864.1 |
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| Structure | |
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| Chemical Formula | C8H14N4O5 |
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| Molecular Mass | 246.0964 |
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| SMILES | NC(=O)CC(N)C(=O)NC(CC(N)=O)C(=O)O |
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| InChI Key | RJUHZPRQRQLCFL-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 acidsasparagine and derivativescarbonyl compoundscarboxylic acidsfatty acids and conjugateshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesn-acyl aminesn-acyl-alpha amino acidsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidessecondary carboxylic acid amides |
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| Substituents | primary carboxylic acid amidefatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidfatty amidefatty acidalpha-amino acid or derivativesorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundasparagine or derivativesn-acyl-alpha amino acid or derivativesalpha-amino acid amiden-acyl-alpha-amino acidcarboxamide groupn-acyl-aminealpha-dipeptidesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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