| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:45 UTC |
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| Update Date | 2025-03-25 00:47:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159649 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H10N2O2 |
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| Molecular Mass | 226.0742 |
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| SMILES | O=CNc1ccccc1C(=O)c1cccnc1 |
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| InChI Key | AJPLKGKNYTZVDB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl-phenylketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | anilidesaryl ketonesazacyclic compoundsbenzoyl derivativescarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesn-arylamidesorganic oxidesorganopnictogen compoundspyridinecarboxylic acids and derivativessecondary carboxylic acid amidesvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativesmonocyclic benzene moietyaromatic heteromonocyclic compoundbenzoyln-arylamidecarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundvinylogous amideazacyclearyl-phenylketoneheteroaromatic compoundcarboxamide groupanilidesecondary carboxylic acid amidepyridinehydrocarbon derivativebenzenoidorganic nitrogen compound |
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