| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:45 UTC |
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| Update Date | 2025-03-25 00:49:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177968 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H15NO2S |
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| Molecular Mass | 261.0824 |
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| SMILES | Cc1ncc(CSc2ccccc2)c(CO)c1O |
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| InChI Key | RPJZOJXITQPJFZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | thiophenols |
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| Subclass | thiophenols |
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| Direct Parent | thiophenols |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesalkylarylthioethersaromatic alcoholsazacyclic compoundsbenzene and substituted derivativesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinessulfenyl compoundsthiophenol ethers |
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| Substituents | aromatic alcoholmonocyclic benzene moietyaromatic heteromonocyclic compoundpolyhalopyridinealkylarylthioetherorganosulfur compoundaryl thioetherthiophenolthiophenol etherorganonitrogen compoundorganopnictogen compound2-halopyridineorganoheterocyclic compoundalcoholsulfenyl compoundazacycleheteroaromatic compoundhydroxypyridinepyridineorganic oxygen compoundthioetherhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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