| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:56:25 UTC |
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| Update Date | 2025-03-24 20:32:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01480991 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C4H4FN3O |
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| Molecular Mass | 129.0338 |
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| SMILES | Nc1ncnc(O)c1F |
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| InChI Key | ISMLKBUZXYTHKE-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 | diazines |
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| Subclass | pyrimidines and pyrimidine derivatives |
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| Direct Parent | halopyrimidines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl fluoridesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyrimidinesimidolactamsorganofluoridesorganooxygen compoundsorganopnictogen compoundsprimary amines |
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| Substituents | aryl fluoridearomatic heteromonocyclic compoundazacycleorganofluorideheteroaromatic compoundhydroxypyrimidinehalopyrimidineorganohalogen compoundaryl halideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundimidolactamamineorganooxygen compound |
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