| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:55:57 UTC |
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| Update Date | 2025-03-21 18:04:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00052674 |
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| Frequency | 77.8 |
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| Structure | |
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| Chemical Formula | C11H18N2O7 |
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| Molecular Mass | 290.1114 |
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| SMILES | CC(C)CC(NC(=O)NC(CC(=O)O)C(=O)O)C(=O)O |
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| InChI Key | DXEOSEJJLRPYEG-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 | leucine and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidsaspartic acid and derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativesn-carbamoyl-alpha amino acidsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundstricarboxylic acids and derivatives |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarbonic acid derivativecarboxylic acidn-carbamoyl-alpha-amino acidtricarboxylic acid or derivativesorganic oxideorganic oxygen compoundn-carbamoyl-alpha-amino acid or derivativesleucine or derivativesaspartic acid or derivativesorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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