| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:16 UTC |
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| Update Date | 2025-03-21 18:38:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00122983 |
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| Frequency | 21.0 |
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| Structure | |
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| Chemical Formula | C11H10N2O2 |
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| Molecular Mass | 202.0742 |
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| SMILES | COc1ccc2nccc(C(N)=O)c2c1 |
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| InChI Key | KEMMSENPKNZJPE-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-halopyridinesalkyl aryl ethersanisolesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinesprimary carboxylic acid amidespyridinecarboxylic acids and derivatives |
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| Substituents | primary carboxylic acid amidepyridine carboxylic acid or derivativesphenol etheretherpolyhalopyridinealkyl aryl ethercarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineazacycleheteroaromatic compoundmethylpyridinecarboxamide groupquinoline-4-carboxamidepyridineorganic oxygen compoundanisolehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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