Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:49:46 UTC |
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Update Date | 2025-03-21 18:02:26 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00038001 |
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Frequency | 92.3 |
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Structure | |
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Chemical Formula | C9H15NO6 |
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Molecular Mass | 233.0899 |
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SMILES | O=C(O)CC(N=C(O)CCCCO)C(=O)O |
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InChI Key | RVOVQIYPCZETEO-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 | alcohols and polyolsalpha amino acidscarbonyl compoundscarboximidic acidscarboxylic acidsdicarboxylic acids and derivativesfatty acids and conjugateshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundsshort-chain hydroxy acids and derivatives |
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Substituents | alcoholaliphatic acyclic compoundcarboximidic acidcarbonyl groupcarboxylic acidshort-chain hydroxy acidfatty acidorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundaspartic acid or derivativesorganonitrogen compoundalpha-amino aciddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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