| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:52 UTC |
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| Update Date | 2025-03-25 00:58:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232986 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H23NO3 |
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| Molecular Mass | 229.1678 |
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| SMILES | CCC(C)CC(NC(=O)C(C)CC)C(=O)O |
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| InChI Key | FWOKEYQJXSGQTC-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 | n-acyl-alpha amino acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidsamino fatty acidscarbonyl compoundscarboxylic acidshydrocarbon derivativesmedium-chain fatty acidsmethyl-branched fatty acidsmonocarboxylic acids and derivativesn-acyl aminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidfatty amidefatty acidorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundmedium-chain fatty acidmethyl-branched fatty acidn-acyl-alpha-amino acidcarboxamide groupamino fatty acidbranched fatty acidn-acyl-aminesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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