| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:15 UTC |
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| Update Date | 2025-03-21 18:02:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00041497 |
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| Frequency | 88.3 |
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| Structure | |
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| Chemical Formula | C8H10ClN3 |
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| Molecular Mass | 183.0563 |
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| SMILES | CNC(=N)Nc1ccc(Cl)cc1 |
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| InChI Key | HRKXQOBEXVFOTB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | halobenzenes |
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| Direct Parent | chlorobenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl chloridescarboximidamidesguanidineshydrocarbon derivativesiminesorganochloridesorganopnictogen compounds |
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| Substituents | aryl chloridechlorobenzeneguanidineimineorganochloridecarboximidamideorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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