| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:30 UTC |
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| Update Date | 2025-03-25 00:46:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154706 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H17N3O3 |
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| Molecular Mass | 299.127 |
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| SMILES | CC(=O)N1CCN(C(=O)c2cc(=O)c3ccccc3[nH]2)CC1 |
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| InChI Key | PBTYESJOBZLQQO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | quinolines and derivatives |
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| Subclass | quinoline carboxamides |
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| Direct Parent | quinoline carboxamides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridines2-heteroaryl carboxamidesacetamidesazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeshydroquinolineshydroquinolonesmethylpyridinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspiperazinespolyhalopyridinespyridinecarboxylic acids and derivativestertiary carboxylic acid amidesvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativescarbonyl grouppolyhalopyridinecarboxylic acid derivative2-heteroaryl carboxamideorganic oxidepiperazinearomatic heteropolycyclic compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compound2-halopyridineacetamidevinylogous amideazacycleheteroaromatic compounddihydroquinolinemethylpyridinecarboxamide groupdihydroquinolonepyridineorganic oxygen compound1,4-diazinanehydrocarbon derivativebenzenoidorganic nitrogen compoundquinoline-2-carboxamideorganooxygen compound |
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