| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:11:39 UTC |
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| Update Date | 2025-03-21 18:32:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00089917 |
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| Frequency | 31.4 |
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| Structure | |
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| Chemical Formula | C8H5NO4S |
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| Molecular Mass | 210.9939 |
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| SMILES | O=C1C(O)=NS(=O)(=O)c2ccccc21 |
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| InChI Key | YONINQDHTMWRRB-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 | benzothiazines |
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| Subclass | benzothiazines |
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| Direct Parent | benzothiazines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl ketonesazacyclic compoundsbenzenoidshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfonic acids and derivatives |
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| Substituents | organosulfonic acid or derivativesazacyclebenzothiazineketoneorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganic sulfonic acid or derivativesorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundaryl ketone |
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