| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:08 UTC |
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| Update Date | 2025-03-25 00:50:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183345 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H8FNO |
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| Molecular Mass | 201.059 |
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| SMILES | O=C(c1cccnc1)c1cccc(F)c1 |
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| InChI Key | IEVCOTJIGFKWIC-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 | aryl fluoridesaryl ketonesazacyclic compoundsbenzoyl derivativesfluorobenzenesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganofluoridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyridinecarboxylic acids and derivatives |
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| Substituents | aryl fluoridepyridine carboxylic acid or derivativesmonocyclic benzene moietyaromatic heteromonocyclic compoundbenzoylorganohalogen compoundfluorobenzeneorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundazacycleorganofluoridearyl-phenylketoneheteroaromatic compoundaryl halidepyridinehydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzene |
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