| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:39:55 UTC |
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| Update Date | 2025-03-25 01:31:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02431937 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H5ClN2 |
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| Molecular Mass | 128.0141 |
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| SMILES | Cc1cc(Cl)ncn1 |
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| InChI Key | MVAXKFAQKTWRAH-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 derivativesorganochloridesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aryl chloridearomatic heteromonocyclic compoundazacycleorganochlorideheteroaromatic compoundhalopyrimidineorganohalogen compoundaryl halideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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