| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:57:34 UTC |
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| Update Date | 2025-03-21 18:05:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00056376 |
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| Frequency | 56.5 |
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| Structure | |
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| Chemical Formula | C18H25ClN6OS |
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| Molecular Mass | 408.1499 |
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| SMILES | CN(C)Cc1ccc(CSCCNC(=N)NC(=N)Nc2ccc(Cl)cc2)o1 |
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| InChI Key | RDHXXVBCRVZPTN-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 heteromonocyclic compounds |
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| Alternative Parents | aralkylaminesaryl chloridescarboximidamideschlorobenzenesdialkylthioethersfuransheteroaromatic compoundshydrocarbon derivativesiminesorganochloridesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundssulfenyl compoundstrialkylamines |
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| Substituents | furanmonocyclic benzene moietyaromatic heteromonocyclic compoundimineorganochlorideorganosulfur compoundorganohalogen compoundaralkylamineorganopnictogen compound1-arylbiguanidetertiary amineorganoheterocyclic compoundaryl chloridechlorobenzenesulfenyl compounddialkylthioetherheteroaromatic compoundtertiary aliphatic aminecarboximidamidearyl halideoxacycleorganic oxygen compoundthioetherhydrocarbon derivativebenzenoidhalobenzeneamineorganooxygen compound |
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