| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:19:45 UTC |
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| Update Date | 2025-03-21 22:15:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00531999 |
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| Frequency | 3.2 |
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| Structure | |
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| Chemical Formula | C6H7NOS |
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| Molecular Mass | 141.0248 |
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| SMILES | CSc1ccc(C=O)[nH]1 |
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| InChI Key | QFCLPWSKYKUTBY-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 heteromonocyclic compounds |
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| Alternative Parents | alkylarylthioethersaryl-aldehydesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrrolessulfenyl compounds |
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| Substituents | sulfenyl compoundaromatic heteromonocyclic compoundazacycleheteroaromatic compoundaldehydealkylarylthioetheraryl thioetherorganic oxidearyl-aldehydeorganic oxygen compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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