| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:09:40 UTC |
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| Update Date | 2025-03-21 18:31:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00085324 |
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| Frequency | 33.5 |
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| Structure | |
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| Chemical Formula | C8H11NO5 |
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| Molecular Mass | 201.0637 |
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| SMILES | CC(=O)NC(CCC(=O)O)C(O)=C=O |
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| InChI Key | NXMBNSXJLNXSGQ-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 | gamma amino acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetamidesamino fatty acidscarbonyl compoundscarboxylic acidsfatty acylshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidesynolates |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidgamma amino acid or derivativescarboxamide groupamino fatty acidmedium-chain hydroxy acidsecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundynolateorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidhydroxy fatty acidorganic nitrogen compoundacetamideorganooxygen compound |
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