| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:14 UTC |
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| Update Date | 2025-03-21 18:36:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00113336 |
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| Frequency | 23.4 |
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| Structure | |
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| Chemical Formula | C8H9ClN2O5S2 |
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| Molecular Mass | 311.9641 |
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| SMILES | COS(=O)(=O)c1cc2c(cc1Cl)NCNS2(=O)=O |
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| InChI Key | MMYZMEGKDOYBIU-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 | thiadiazines |
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| Subclass | benzothiadiazines |
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| Direct Parent | 1,2,4-benzothiadiazine-1,1-dioxides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl chloridesarylsulfonic acids and derivativesazacyclic compoundsbenzenoidshydrocarbon derivativesorganic oxidesorganochloridesorganooxygen compoundsorganopnictogen compoundsorganosulfonamidesorganosulfonic acid esterssecondary alkylarylaminessulfonyls |
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| Substituents | organosulfonic acid or derivativesorganochlorideorganosulfur compoundorganohalogen compoundorganosulfonic acid amideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1,2,4-benzothiadiazine-1,1-dioxidearyl chlorideazacyclesecondary amineorganosulfonic acid estersecondary aliphatic/aromatic aminearyl halidesulfonylorganic oxygen compoundarylsulfonic acid or derivativesorganic sulfonic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundamine |
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