| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:10 UTC |
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| Update Date | 2025-03-21 18:05:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00057816 |
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| Frequency | 54.8 |
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| Structure | |
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| Chemical Formula | C10H14N4O6 |
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| Molecular Mass | 286.0913 |
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| SMILES | NC(=O)CCC(NC(=O)C1CC(=O)NC(=O)N1)C(=O)O |
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| InChI Key | HFMPXNZPCDQQIE-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 | alpha amino acid amidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdiazinanesdicarboximidesfatty amidesglutamine and derivativesheterocyclic fatty acidshydrocarbon derivativesmonocarboxylic acids and derivativesn-acyl ureasn-acyl-alpha amino acidsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidespyrimidonessecondary carboxylic acid amides |
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| Substituents | primary carboxylic acid amidefatty acylcarbonyl groupcarboxylic acidglutamine or derivativesheterocyclic fatty acidfatty amidefatty acidpyrimidonealpha-amino acid or derivativespyrimidine1,3-diazinaneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compounddicarboximideureideorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesn-acyl ureacarbonic acid derivativealpha-amino acid amideazacyclen-acyl-alpha-amino acidcarboxamide groupalpha-dipeptidesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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