| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:45 UTC |
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| Update Date | 2025-03-25 00:51:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02184740 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H20ClN7 |
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| Molecular Mass | 297.1469 |
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| SMILES | N=C(NCCCC(N)N)NC(=N)Nc1ccc(Cl)cc1 |
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| InChI Key | PJGQNPXXBTXDEN-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | guanidines |
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| Direct Parent | 1-arylbiguanides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aminalsaryl chloridescarboximidamideschlorobenzeneshydrocarbon derivativesiminesmonoalkylaminesorganochloridesorganopnictogen compounds |
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| Substituents | aryl chloridechlorobenzenemonocyclic benzene moietyimineorganochloridecarboximidamideaminalorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganopnictogen compoundhydrocarbon derivative1-arylbiguanidebenzenoidprimary aliphatic aminehalobenzene |
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