| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:41 UTC |
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| Update Date | 2025-03-25 00:59:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02239350 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H11N3O2 |
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| Molecular Mass | 217.0851 |
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| SMILES | Cn1cc(C(N)=O)c(=O)c2ccc(N)cc21 |
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| InChI Key | OASSYLIOJVWPHP-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-3-carboxamides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesamino acids and derivativesazacyclic compoundsbenzenoidscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeshydroquinolineshydroquinolonesorganic oxidesorganooxygen compoundsorganopnictogen compoundspolyhalopyridinesprimary aminesprimary carboxylic acid amidespyridinecarboxylic acids and derivativesvinylogous amides |
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| Substituents | primary carboxylic acid amidepyridine carboxylic acid or derivativesamino acid or derivativespolyhalopyridinecarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinevinylogous amideazacycleheteroaromatic compounddihydroquinolinecarboxamide groupdihydroquinolonepyridineorganic oxygen compoundhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundamineorganooxygen compoundquinoline-3-carboxamide |
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