| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:43:06 UTC |
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| Update Date | 2025-03-24 21:45:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01879594 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C4H3ClN2O |
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| Molecular Mass | 129.9934 |
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| SMILES | O=c1ccnc(Cl)[nH]1 |
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| InChI Key | FETSYNXZMUAONO-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 | pyrimidones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyrimidinesaryl chloridesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aryl chloride2-halopyrimidinelactamaromatic heteromonocyclic compoundazacycleorganochlorideheteroaromatic compoundpyrimidonehalopyrimidineorganohalogen compoundaryl halideorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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