| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:38 UTC |
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| Update Date | 2025-03-21 18:37:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00116739 |
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| Frequency | 22.5 |
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| Structure | |
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| Chemical Formula | C8H13NO3 |
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| Molecular Mass | 171.0895 |
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| SMILES | CC(C(=O)O)N1CCCCC1=O |
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| InChI Key | YHEDRPWAMWYZIK-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 | alanine and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdelta lactamshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspiperidinonestertiary carboxylic acid amides |
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| Substituents | carbonyl grouplactamcarboxylic acidazacyclecarboxamide groupdelta-lactamorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundtertiary carboxylic acid amidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundalanine or derivativespiperidinonehydrocarbon derivativeorganic nitrogen compoundpiperidineorganoheterocyclic compoundorganooxygen compound |
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