| Record Information |
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| HMDB Status | quantified |
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| Creation Date | 2024-02-21 00:20:13 UTC |
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| Update Date | 2025-03-21 18:36:29 UTC |
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| HMDB ID | HMDB0005015 |
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| Metabolite Identification |
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| DeepMet ID | DMID00110877 |
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| Name | Gabapentin |
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| Frequency | 24.0 |
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| Structure | |
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| Chemical Formula | C9H17NO2 |
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| Molecular Mass | 171.1259 |
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| SMILES | NCC1(CC(=O)O)CCCCC1 |
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| InChI Key | UGJMXCAKCUNAIE-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 | gamma amino acids and derivatives |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | carbonyl groupcarboxylic acidgamma amino acid or derivativesorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundaliphatic homomonocyclic compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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