| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:30:50 UTC |
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| Update Date | 2025-03-21 18:41:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00135972 |
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| Frequency | 18.4 |
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| Structure | |
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| Chemical Formula | C11H20N2O4 |
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| Molecular Mass | 244.1423 |
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| SMILES | CC(C)CC(N)C(=O)NCCCC(=O)C(=O)O |
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| InChI Key | ISXNBBKZLWPAHZ-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 acid amidesalpha amino acidsalpha-hydroxy ketonesalpha-keto acids and derivativesbranched fatty acidscarboxylic acidshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesn-acyl aminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidesshort-chain keto acids and derivatives |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidfatty amideshort-chain keto acidalpha-hydroxy ketoneketoneorganic oxideleucine or derivativesorganonitrogen compoundalpha-keto acidalpha-amino acidorganopnictogen compoundalpha-amino acid amidecarboxamide groupbranched fatty acidn-acyl-aminesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundketo acidhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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