Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:26:02 UTC |
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Update Date | 2025-03-21 18:39:16 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00124715 |
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Frequency | 26.1 |
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Structure | |
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Chemical Formula | C16H29N3O6 |
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Molecular Mass | 359.2056 |
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SMILES | CC(C)CC(N=C(O)C(CC(C)C)NC(=O)CC(N)C(=O)O)C(=O)O |
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InChI Key | CXGKWYJYCDDRKU-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 acidsasparagine and derivativescarbonyl compoundscarboximidic acidscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesmethyl-branched fatty acidsmonoalkylaminesn-acyl aminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssecondary carboxylic acid amidesshort-chain hydroxy acids and derivatives |
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Substituents | fatty acylaliphatic acyclic compoundcarboximidic acidcarbonyl groupcarboxylic acidshort-chain hydroxy acidfatty amidefatty acidpropargyl-type 1,3-dipolar organic compoundorganic oxideleucine or derivativesorganonitrogen compoundalpha-amino acidorganopnictogen compoundasparagine or derivativesmethyl-branched fatty acidorganic 1,3-dipolar compoundcarboxamide groupbranched fatty acidn-acyl-aminesecondary carboxylic acid amideorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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