| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:07:10 UTC |
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| Update Date | 2025-03-21 18:29:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00079400 |
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| Frequency | 55.3 |
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| Structure | |
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| Chemical Formula | C7H6ClN3O2S |
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| Molecular Mass | 230.9869 |
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| SMILES | NS(=O)(=O)c1cc2nc[nH]c2cc1Cl |
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| InChI Key | QTEQUZCBKDTAHS-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 oxidesorganochloridesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamides |
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| Substituents | organosulfonic acid or derivativesorganochlorideorganosulfur compoundorganohalogen compoundorganosulfonic acid amideorganic oxidearomatic heteropolycyclic compoundbenzimidazoleimidazoleorganonitrogen compoundorganopnictogen compoundazolearyl chlorideazacycleaminosulfonyl compoundheteroaromatic compoundaryl halidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compound |
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