| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:07:37 UTC |
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| Update Date | 2025-03-21 18:29:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00080499 |
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| Frequency | 36.1 |
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| Structure | |
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| Chemical Formula | C12H21N2O3+ |
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| Molecular Mass | 241.1547 |
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| SMILES | C[N+]1(C)CCCC1C(=O)N1CCCC1C(=O)O |
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| InChI Key | VOWFCBSRZKGKTF-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 acid amidesalpha amino acidsaminesazacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesn-acyl-alpha amino acidsn-acylpyrrolidinesn-alkylpyrrolidinesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsproline and derivativespyrrolidine carboxylic acidspyrrolidinecarboxamidestertiary carboxylic acid amidestetraalkylammonium salts |
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| Substituents | carbonyl groupcarboxylic acidn-acylpyrrolidinealpha-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 derivativesalpha-amino acid amidetetraalkylammonium saltazacyclen-acyl-alpha-amino acidn-alkylpyrrolidinequaternary ammonium saltcarboxamide groupalpha-dipeptidemonocarboxylic acid or derivativespyrrolidine carboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidine-2-carboxamideamineorganooxygen compound |
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