| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:08:38 UTC |
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| Update Date | 2025-03-21 18:30:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00082895 |
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| Frequency | 34.8 |
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| Structure | |
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| Chemical Formula | C9H11N3O7 |
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| Molecular Mass | 273.0597 |
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| SMILES | O=C(O)CCC(NC(=O)C1NC(=O)NC1=O)C(=O)O |
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| InChI Key | XZVBGLNJCYYEJK-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 heteromonocyclic compounds |
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| Alternative Parents | 1,3-dicarbonyl compoundsalpha amino acidsazacyclic compoundscarboxylic acidsdicarboximidesdicarboxylic acids and derivativesglutamic acid and derivativesheterocyclic fatty acidshydantoinshydrocarbon derivativesimidazolidinonesn-acyl-alpha amino acidsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | imidazolidinefatty acylcarbonyl groupcarboxylic acidheterocyclic fatty acidfatty acidalpha-amino acid or derivativesimidazolidinoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compounddicarboximideorganoheterocyclic compoundn-acyl-alpha amino acid or derivativescarbonic acid derivativeazacyclen-acyl-alpha-amino acidglutamic acid or derivativescarboxamide groupalpha-dipeptidesecondary carboxylic acid amideorganic oxygen compoundhydantoindicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compound1,3-dicarbonyl compoundorganooxygen compound |
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