| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:02:17 UTC |
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| Update Date | 2025-03-25 00:54:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02206447 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H15NO7 |
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| Molecular Mass | 249.0849 |
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| SMILES | NC(CCCOC(CC(=O)O)C(=O)O)C(=O)O |
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| InChI Key | CKEUDAUOCDQAMO-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 | alpha amino acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdialkyl ethershydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundstricarboxylic acids and derivatives |
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| Substituents | aliphatic acyclic compoundcarbonyl groupethercarboxylic acidtricarboxylic acid or derivativesdialkyl etherorganic oxideorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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