| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:21 UTC |
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| Update Date | 2025-03-25 01:00:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02240913 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H16N2O5 |
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| Molecular Mass | 232.1059 |
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| SMILES | CC(C)C(NC(CC(=O)O)C(=O)O)C(N)=O |
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| InChI Key | LYAZYNJJZNKPAJ-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 | aspartic acid and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsbranched fatty acidscarbonyl compoundscarboxylic acidsdialkylaminesdicarboxylic acids and derivativesfatty amideshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidesvaline and derivatives |
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| Substituents | primary carboxylic acid amidefatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidfatty amidefatty acidorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundsecondary aliphatic aminevaline or derivativessecondary aminecarboxamide groupbranched fatty acidorganic oxygen compoundaspartic acid or derivativesdicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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