Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:51:28 UTC |
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Update Date | 2025-03-25 00:50:35 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02181859 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C10H15NO6 |
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Molecular Mass | 245.0899 |
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SMILES | O=C(O)C(CO)NC(=O)C1(O)CC=CC(O)C1 |
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InChI Key | NKZBWTAIDYFFAX-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 homomonocyclic compounds |
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Alternative Parents | alpha amino acidsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary alcoholssecondary alcoholssecondary carboxylic acid amidesserine and derivativestertiary alcohols |
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Substituents | carbonyl groupcarboxylic acidbeta-hydroxy acidorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundprimary alcoholalcoholn-acyl-alpha-amino acidhydroxy acidcarboxamide groupsecondary carboxylic acid amidetertiary alcoholmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivativeorganic nitrogen compoundserine or derivativesorganooxygen compound |
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