| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:03 UTC |
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| Update Date | 2025-03-25 00:50:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183161 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H12O4S2 |
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| Molecular Mass | 308.0177 |
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| SMILES | O=S(O)c1ccc2c(c1)OCC(c1ccc(O)cc1)S2 |
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| InChI Key | VZQHEEQKMFLBRH-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 | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersalkylarylthioethersbenzene and substituted derivativesbenzoxathiinshydrocarbon derivativesorganic oxidesoxacyclic compoundsoxathiinssulfinic acids |
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| Substituents | monocyclic benzene moietyethersulfinic acid derivative1-hydroxy-2-unsubstituted benzenoidalkyl aryl etheralkylarylthioetheraryl thioethersulfinic acidoxacycleorganic oxideorganic oxygen compound1,4-benzooxathiinaromatic heteropolycyclic compoundphenolhydrocarbon derivativebenzenoidorganoheterocyclic compoundorganooxygen compound1,4-oxathiin |
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