Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:16 UTC |
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Update Date | 2025-03-21 18:35:02 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00103651 |
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Frequency | 26.2 |
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Structure | |
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Chemical Formula | C8H13NO5 |
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Molecular Mass | 203.0794 |
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SMILES | CC(=O)NC(OC(=O)C(C)C)C(=O)O |
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InChI Key | JCJJFNXTBLYAQL-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 acid esterscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidn-acyl-alpha-amino acidcarboxamide groupsecondary carboxylic acid amideorganic oxideorganic oxygen compoundcarboxylic acid esterorganonitrogen compoundalpha-amino aciddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundacetamideorganooxygen compound |
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