| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:48:51 UTC |
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| Update Date | 2025-03-21 18:01:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00035781 |
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| Frequency | 99.3 |
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| Structure | |
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| Chemical Formula | C13H20ClN5OS |
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| Molecular Mass | 329.1077 |
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| SMILES | CS(=O)CCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1 |
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| InChI Key | LJGQAAYEHKTUFQ-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 chloridescarboximidamideschlorobenzeneshydrocarbon derivativesiminesorganic oxidesorganochloridesorganopnictogen compoundssulfinyl compoundssulfoxides |
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| Substituents | monocyclic benzene moietyimineorganochlorideorganosulfur compoundorganohalogen compoundorganic oxidesulfinyl compoundorganopnictogen compound1-arylbiguanidearyl chloridechlorobenzenecarboximidamidearyl halidearomatic homomonocyclic compoundorganic oxygen compoundsulfoxidehydrocarbon derivativebenzenoidhalobenzene |
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