| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:03:30 UTC |
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| Update Date | 2025-03-21 18:28:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00070521 |
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| Frequency | 42.6 |
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| Structure | |
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| Chemical Formula | C15H32N3O4+ |
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| Molecular Mass | 318.2387 |
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| SMILES | C[N+](C)(C)CCCCC(NCCCCC(N)C(=O)O)C(=O)O |
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| InChI Key | DMPDHRXFLOUTBS-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 | amino acidsamino fatty acidscarbonyl compoundscarboxylic acidsdialkylaminesdicarboxylic acids and derivativeshydrocarbon derivativesmedium-chain fatty acidsmonoalkylaminesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidfatty acidorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundmedium-chain fatty acidorganic cationorganic saltsecondary aliphatic aminetetraalkylammonium saltquaternary ammonium saltsecondary amineamino fatty acidorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundamineorganooxygen compound |
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