| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:08:29 UTC |
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| Update Date | 2025-03-21 18:30:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00082538 |
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| Frequency | 70.7 |
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| Structure | |
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| Chemical Formula | C7H6ClN3O3S |
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| Molecular Mass | 246.9818 |
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| SMILES | NS(=O)(=O)c1cc2[nH]c(=O)[nH]c2cc1Cl |
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| InChI Key | SWRMNRZNXFVKGO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | benzimidazoles |
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| Subclass | benzimidazoles |
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| Direct Parent | benzimidazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aminosulfonyl compoundsaryl chloridesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesimidazolesorganic carbonic acids and derivativesorganic oxidesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfonamides |
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| Substituents | organosulfonic acid or derivativesorganochlorideorganosulfur compoundorganohalogen compoundorganosulfonic acid amideorganic oxidearomatic heteropolycyclic compoundbenzimidazoleimidazoleorganonitrogen compoundorganopnictogen compoundazolearyl chloridecarbonic acid derivativeazacycleaminosulfonyl compoundheteroaromatic compoundaryl halidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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