| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:24 UTC |
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| Update Date | 2025-03-21 18:29:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00077534 |
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| Frequency | 37.8 |
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| Structure | |
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| Chemical Formula | C13H18ClN5O4 |
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| Molecular Mass | 343.1047 |
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| SMILES | N=C(NC(=N)NC1OC(CO)C(O)C1O)Nc1ccc(Cl)cc1 |
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| InChI Key | MQGKEOZDTSWIKW-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 | aryl chloridescarboximidamideschlorobenzeneshydrocarbon derivativesiminesmonosaccharidesorganochloridesorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | monocyclic benzene moietyaromatic heteromonocyclic compoundimineorganochloridemonosaccharideorganohalogen compoundsaccharideorganopnictogen compound1-arylbiguanideprimary alcoholorganoheterocyclic compoundaryl chloridechlorobenzenealcoholtetrahydrofurancarboximidamidearyl halideoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativebenzenoidhalobenzeneorganooxygen compound |
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