| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:10:36 UTC |
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| Update Date | 2025-03-21 20:49:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00368015 |
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| Frequency | 5.1 |
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| Structure | |
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| Chemical Formula | C7H7NO |
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| Molecular Mass | 121.0528 |
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| SMILES | C=Cc1cccc(=O)[nH]1 |
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| InChI Key | QMKJWALTZPZTOS-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 | pyridines and derivatives |
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| Subclass | hydropyridines |
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| Direct Parent | pyridinones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyridines and derivatives |
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| Substituents | lactamaromatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundpyridinoneorganooxygen compound |
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