| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:30:06 UTC |
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| Update Date | 2025-03-21 18:41:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00134287 |
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| Frequency | 18.7 |
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| Structure | |
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| Chemical Formula | C13H23N2O5+ |
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| Molecular Mass | 287.1601 |
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| SMILES | C[N+](C)(C)C(CCC(=O)O)C(=O)N1CCCC1C(=O)O |
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| InChI Key | XEPNTZVOEQZFRR-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 | dipeptides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsaminesazacyclic compoundscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesheterocyclic fatty acidshydrocarbon derivativesn-acyl-alpha amino acidsn-acylpyrrolidinesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsproline and derivativespyrrolidine carboxylic acidstertiary carboxylic acid amidestetraalkylammonium salts |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidheterocyclic fatty acidn-acylpyrrolidinefatty acidalpha-amino acid or derivativesorganic oxidepyrrolidine carboxylic acidtertiary carboxylic acid amidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganic cationorganic saltpyrrolidineorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesproline or derivativestetraalkylammonium saltazacyclen-acyl-alpha-amino acidquaternary ammonium saltcarboxamide groupalpha-dipeptidepyrrolidine carboxylic acid or derivativesorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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