Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:52:27 UTC |
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Update Date | 2025-03-25 00:50:58 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02184036 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C12H19NO4 |
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Molecular Mass | 241.1314 |
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SMILES | NC(CCC1CC=C(CC(=O)O)CC1)C(=O)O |
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InChI Key | AMQPTJROKREMCL-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 homomonocyclic compounds |
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Alternative Parents | carbocyclic fatty acidscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesfatty acylshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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Substituents | fatty acylcarbocyclic fatty acidcarbonyl groupcarboxylic acidorganic oxideorganic oxygen compoundorganonitrogen compoundalpha-amino acidaliphatic homomonocyclic compounddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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