| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:55 UTC |
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| Update Date | 2025-03-21 18:37:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00117443 |
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| Frequency | 22.3 |
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| Structure | |
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| Chemical Formula | C7H13ClNO2+ |
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| Molecular Mass | 178.0629 |
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| SMILES | C[N+]1(C)CC(Cl)CC1C(=O)O |
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| InChI Key | CTULFDDUVIHZGY-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 | proline and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alkyl chloridesalpha amino acidsaminesazacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesn-alkylpyrrolidinesorganic cationsorganic oxidesorganic saltsorganochloridesorganopnictogen compoundspyrrolidine carboxylic acidstetraalkylammonium salts |
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| Substituents | carbonyl groupcarboxylic acidalkyl chlorideorganochlorideorganohalogen compoundorganic oxidepyrrolidine carboxylic acidaliphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundalkyl halideorganic cationorganic saltpyrrolidineorganoheterocyclic compoundproline or derivativestetraalkylammonium saltazacyclen-alkylpyrrolidinequaternary ammonium saltmonocarboxylic acid or derivativespyrrolidine carboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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