| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:03 UTC |
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| Update Date | 2025-03-25 00:46:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02155924 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H19N2O5+ |
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| Molecular Mass | 247.1288 |
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| SMILES | C[N+](C)(C)C(CCC(=O)C(N)C(=O)O)C(=O)O |
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| InChI Key | NCFPQNVUUXZWON-UHFFFAOYSA-O |
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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 | 1,3-dicarbonyl compoundsaminesamino fatty acidsbeta-hydroxy ketonesbeta-keto acids and derivativescarboxylic acidsdicarboxylic acids and derivativesfatty acylsgamma-amino ketoneshydrocarbon derivativesmedium-chain keto acids and derivativesmonoalkylaminesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | fatty acylbeta-hydroxy ketonealiphatic acyclic compoundcarbonyl groupcarboxylic acidbeta-keto acidketoneorganic oxidealpha-amino acidorganonitrogen compoundorganopnictogen compoundorganic cationorganic saltgamma-aminoketonetetraalkylammonium saltquaternary ammonium saltamino fatty acidorganic oxygen compoundketo aciddicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound1,3-dicarbonyl compoundamineorganooxygen compoundmedium-chain keto acid |
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