| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:58:59 UTC |
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| Update Date | 2025-03-25 00:53:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02198930 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C22H29ClN8OS |
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| Molecular Mass | 488.1874 |
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| SMILES | N=C(NCCCCCCNC(=S)NN=Cc1ccccc1O)NC(=N)Nc1ccc(Cl)cc1 |
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| InChI Key | NLFGKNJFSBDWPJ-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 | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl chloridescarboximidamideschlorobenzeneshydrocarbon derivativesiminesorganochloridesorganooxygen compoundsorganopnictogen compoundsthiosemicarbazonesthioureas |
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| Substituents | monocyclic benzene moietythioureaimineorganochloride1-hydroxy-2-unsubstituted benzenoidorganosulfur compoundorganohalogen compoundthiosemicarbazoneorganopnictogen compound1-arylbiguanidearyl chloridechlorobenzenecarboximidamide1-hydroxy-4-unsubstituted benzenoidaryl halidearomatic homomonocyclic compoundorganic oxygen compoundphenolhydrocarbon derivativebenzenoidhalobenzeneorganooxygen compound |
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