| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:30 UTC |
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| Update Date | 2025-03-21 18:02:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00037396 |
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| Frequency | 94.2 |
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| Structure | |
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| Chemical Formula | C8H10N2O4 |
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| Molecular Mass | 198.0641 |
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| SMILES | O=C(O)C1NC(=O)C2CCCN2C1=O |
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| InChI Key | DIVDASXLEGYFJX-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 | dipeptides |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-dicarbonyl compounds2,5-dioxopiperazinesalpha amino acidsazacyclic compoundscarboxylic acidshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesn-alkylpiperazinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspiperazine carboxylic acidspyrrolidinessecondary carboxylic acid amidestertiary carboxylic acid amides |
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| Substituents | carbonyl grouplactamcarboxylic acidalpha-amino acid or derivatives2,5-dioxopiperazinealiphatic heteropolycyclic compoundorganic oxidedioxopiperazinepiperazinetertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundazacyclen-alkylpiperazinepiperazine-2-carboxylic acidcarboxamide groupalpha-dipeptidesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compound1,4-diazinanehydrocarbon derivativeorganic nitrogen compound1,3-dicarbonyl compoundorganooxygen compound |
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