| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:57 UTC |
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| Update Date | 2025-03-21 18:37:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00117533 |
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| Frequency | 31.1 |
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| Structure | |
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| Chemical Formula | C10H8N4OS |
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| Molecular Mass | 232.0419 |
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| SMILES | Nc1nc(=O)c2c([nH]1)Sc1ccccc1N2 |
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| InChI Key | ODKJUKBLHZYFBP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | thioethers |
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| Subclass | aryl thioethers |
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| Direct Parent | diarylthioethers |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,4-thiazinesazacyclic compoundsbenzenoidsbenzothiazinesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminespyrimidonessecondary aminesvinylogous amidesvinylogous thioesters |
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| Substituents | benzothiazinepyrimidonepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compounddiarylthioethervinylogous amidevinylogous thioesterpara-thiazineazacycleheteroaromatic compoundsecondary amineorganic oxygen compoundhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundamineorganooxygen compound |
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