Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:31 UTC |
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Update Date | 2025-03-21 18:35:10 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00104244 |
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Frequency | 26.0 |
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Structure | |
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Chemical Formula | C7H14N2O4 |
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Molecular Mass | 190.0954 |
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SMILES | CNC(C)C(=O)NC(CO)C(=O)O |
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InChI Key | CXPUUBPCKGZTJX-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 | alanine and derivativesalpha amino acid amidesalpha amino acidsamino acidsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdialkylamineshydrocarbon derivativesmonocarboxylic acids and derivativesn-acyl-alpha amino acidsorganic oxidesorganopnictogen compoundsprimary alcoholssecondary carboxylic acid amidesserine and derivatives |
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Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acid or derivativesamino acidalpha-amino acid or derivativesbeta-hydroxy acidorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundprimary alcoholn-acyl-alpha amino acid or derivativesalcoholsecondary aliphatic aminealpha-amino acid amiden-acyl-alpha-amino acidhydroxy acidsecondary aminecarboxamide groupn-substituted-alpha-amino acidalpha-dipeptidesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundalanine or derivativeshydrocarbon derivativeorganic nitrogen compoundserine or derivativesorganooxygen compoundamine |
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