| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:10:34 UTC |
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| Update Date | 2025-03-21 19:05:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00228576 |
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| Frequency | 9.4 |
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| Structure | |
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| Chemical Formula | C4H4ClN3O |
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| Molecular Mass | 145.0043 |
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| SMILES | Nc1ncc(Cl)c(=O)[nH]1 |
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| InChI Key | GOCAKGMHAFDMNQ-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 chloridesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganochloridesorganooxygen compoundsorganopnictogen compoundsprimary aminespyrimidones |
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| Substituents | aryl chloridelactamaromatic heteromonocyclic compoundazacycleorganochlorideheteroaromatic compoundpyrimidonehalopyrimidineorganohalogen compoundaryl halideorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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