| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:26:10 UTC |
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| Update Date | 2025-03-21 18:39:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00125024 |
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| Frequency | 20.5 |
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| Structure | |
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| Chemical Formula | C9H12N2O6 |
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| Molecular Mass | 244.0695 |
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| SMILES | O=C(O)CCC1NC(=O)C(CC(=O)O)NC1=O |
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| InChI Key | DMCFAMSXKWZQEI-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 heteromonocyclic compounds |
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| Alternative Parents | 2,5-dioxopiperazinesazacyclic compoundscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | carbonyl grouplactamcarboxylic acidazacyclecarboxamide group2,5-dioxopiperazinesecondary carboxylic acid amideorganic oxideorganic oxygen compounddioxopiperazinepiperazine1,4-diazinanealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino aciddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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