| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:38:10 UTC |
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| Update Date | 2025-03-21 17:57:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00011208 |
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| Frequency | 414.1 |
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| Structure | |
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| Chemical Formula | C7H7ClN2O5S2 |
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| Molecular Mass | 297.9485 |
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| SMILES | O=S(=O)(O)c1cc2c(cc1Cl)NCNS2(=O)=O |
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| InChI Key | BNZCNUSVDCWJIJ-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 | 1-sulfo,2-unsubstituted aromatic compoundsaryl chloridesarylsulfonic acids and derivativesazacyclic compoundsbenzenoidshydrocarbon derivativesorganic oxidesorganochloridesorganopnictogen compoundsorganosulfonamidesorganosulfonic acidssecondary alkylarylaminessulfonyls |
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| Substituents | organosulfonic acid or derivativesorganochlorideorganosulfonic acidorganosulfur compoundorganohalogen compoundorganosulfonic acid amideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1,2,4-benzothiadiazine-1,1-dioxidearyl chloride1-sulfo,2-unsubstituted aromatic compoundazacyclesecondary aminesecondary aliphatic/aromatic aminearyl halidesulfonylorganic oxygen compoundarylsulfonic acid or derivativesorganic sulfonic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundamine |
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