| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:26 UTC |
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| Update Date | 2025-03-25 01:01:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02248097 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H11ClN2O2 |
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| Molecular Mass | 250.0509 |
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| SMILES | Cc1cn(Cc2ccc(Cl)cc2)c(=O)[nH]c1=O |
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| InChI Key | CTWCJFCPDSXELE-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 | aryl chloridesazacyclic compoundschlorobenzenesheteroaromatic compoundshydrocarbon derivativeslactamsorganic carbonic acids and derivativesorganic oxidesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsvinylogous amides |
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| Substituents | monocyclic benzene moietylactamaromatic heteromonocyclic compoundorganochloridepyrimidoneorganohalogen compoundorganic oxideorganonitrogen compoundorganopnictogen compoundaryl chloridechlorobenzenevinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundaryl halideorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneorganooxygen compound |
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