| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:48:18 UTC |
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| Update Date | 2025-03-25 00:49:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02174570 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H15NO3 |
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| Molecular Mass | 197.1052 |
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| SMILES | CCCC=CCCC(N=C=O)C(=O)O |
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| InChI Key | PTEDJHKWTFZIPW-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 | alpha amino acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | amino fatty acidscarbonyl compoundscarboxylic acidsfatty acylshydrocarbon derivativesisocyanatesmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidisocyanateorganic 1,3-dipolar compoundamino fatty acidpropargyl-type 1,3-dipolar organic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidorganic nitrogen compoundorganooxygen compound |
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