| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:00 UTC |
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| Update Date | 2025-03-21 18:37:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00115187 |
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| Frequency | 22.9 |
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| Structure | |
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| Chemical Formula | C10H13FN2O |
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| Molecular Mass | 196.1012 |
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| SMILES | CCNCC(=O)Nc1ccc(F)cc1 |
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| InChI Key | VBGOBBKAJCGKJP-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 | alpha amino acid amides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alpha amino acidsanilidesaryl fluoridescarbonyl compoundscarboxylic acids and derivativesdialkylaminesfluorobenzeneshydrocarbon derivativesn-arylamidesorganic oxidesorganofluoridesorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | aryl fluoridemonocyclic benzene moietycarbonyl groupn-arylamideorganohalogen compoundfluorobenzeneorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundsecondary aliphatic aminealpha-amino acid amideorganofluoridesecondary aminecarboxamide grouparyl halidearomatic homomonocyclic compoundanilidesecondary carboxylic acid amideorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneorganooxygen compoundamine |
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