| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:02:44 UTC |
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| Update Date | 2025-03-24 14:10:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00776995 |
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| Frequency | 1.9 |
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| Structure | |
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| Chemical Formula | C6H6O2S |
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| Molecular Mass | 142.0088 |
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| SMILES | CSc1cc(=O)cco1 |
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| InChI Key | UKCQJRLKZXPFEU-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 | alkylarylthioetherscyclic ketonesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsoxacyclic compoundspyranones and derivativessulfenyl compoundsvinylogous thioesters |
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| Substituents | vinylogous thioestersulfenyl compoundaromatic heteromonocyclic compoundheteroaromatic compoundcyclic ketonealkylarylthioetheraryl thioetheroxacycleorganic oxideorganic oxygen compoundpyranpyranonehydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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