| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:12 UTC |
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| Update Date | 2025-03-25 00:52:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02192540 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H39NO5 |
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| Molecular Mass | 385.2828 |
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| SMILES | CCCCCCCCCCCCCCC(=O)NC(CCC(=O)O)CC(=O)O |
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| InChI Key | NFGJULUGRIRXFB-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 | beta amino acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | amino fatty acidscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesmedium-chain fatty acidsn-acyl aminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidfatty amidefatty acidcarboxamide groupamino fatty acidn-acyl-aminebeta amino acid or derivativessecondary carboxylic acid amideorganic oxideorganic oxygen compoundorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidorganic nitrogen compoundorganooxygen compound |
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