| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:18 UTC |
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| Update Date | 2025-03-25 00:55:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02213646 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H12BrN5 |
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| Molecular Mass | 269.0276 |
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| SMILES | CNC(=N)NC(=N)Nc1ccc(Br)cc1 |
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| InChI Key | VSVSTLLLBHGLJO-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 | aryl bromidesbromobenzenescarboximidamideshydrocarbon derivativesiminesorganobromidesorganopnictogen compounds |
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| Substituents | monocyclic benzene moietyiminebromobenzenecarboximidamideorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganobromideorganopnictogen compoundhydrocarbon derivative1-arylbiguanidebenzenoidhalobenzenearyl bromide |
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