| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:35 UTC |
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| Update Date | 2025-03-25 00:55:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02214261 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H15N3O2 |
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| Molecular Mass | 245.1164 |
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| SMILES | CN(C)CC(=O)Nc1cccc2ccc(=O)[nH]c12 |
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| InChI Key | SUYAKGBUPSAGMO-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 heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesalpha amino acidsazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeshydroquinolineshydroquinoloneslactamsmethylpyridinesn-arylamidesorganic oxidesorganopnictogen compoundspolyhalopyridinespyridinonessecondary carboxylic acid amidestrialkylamines |
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| Substituents | carbonyl grouplactampolyhalopyridinen-arylamideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundquinolinealpha-amino acidorganopnictogen compound2-halopyridinetertiary amineorganoheterocyclic compoundalpha-amino acid amideazacycleheteroaromatic compoundtertiary aliphatic aminedihydroquinolinemethylpyridinecarboxamide groupsecondary carboxylic acid amidedihydroquinolonepyridineorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundpyridinoneamineorganooxygen compound |
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