| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:12 UTC |
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| Update Date | 2025-03-25 00:56:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02220333 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H6N4O3S |
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| Molecular Mass | 226.0161 |
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| SMILES | CSc1nc2c(=O)[nH]c(=O)[nH]c2c(=O)[nH]1 |
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| InChI Key | KZPMKTIGQUMEOU-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 | aryl thioethers |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkylarylthioethersazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrimidonessulfenyl compoundsvinylogous amides |
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| Substituents | vinylogous amidecarbonic acid derivativelactamsulfenyl compoundazacycleheteroaromatic compoundpyrimidonealkylarylthioetheraryl thioetherpyrimidineorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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