| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:59:27 UTC |
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| Update Date | 2025-03-21 18:06:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00060886 |
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| Frequency | 51.3 |
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| Structure | |
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| Chemical Formula | C12H23N2O3+ |
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| Molecular Mass | 243.1703 |
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| SMILES | COC(=O)C1CCCN1C(=O)C(C)[N+](C)(C)C |
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| InChI Key | FLEFHLXYIXVRJE-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 | n-acyl-alpha amino acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acid estersalpha amino acidsaminesazacyclic compoundscarbonyl compoundshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesn-acylpyrrolidinesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsproline and derivativespyrrolidine carboxylic acidstertiary carboxylic acid amidestetraalkylammonium salts |
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| Substituents | carbonyl groupn-acylpyrrolidineorganic oxidemethyl esterpyrrolidine carboxylic acidtertiary carboxylic acid amidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganic cationorganic saltpyrrolidineorganoheterocyclic compoundproline or derivativestetraalkylammonium saltalpha-amino acid esterazacyclen-acyl-alpha-amino acidquaternary ammonium saltcarboxamide groupmonocarboxylic acid or derivativespyrrolidine carboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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