Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 02:04:49 UTC |
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Update Date | 2025-03-21 20:46:50 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00354416 |
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Frequency | 5.3 |
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Structure | |
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Chemical Formula | C7H6S |
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Molecular Mass | 122.019 |
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SMILES | c1ccc2c(c1)CS2 |
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InChI Key | KUGJQUKMALCUKX-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 | alkylarylthioethersbenzenoidshydrocarbon derivativesorganoheterocyclic compounds |
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Substituents | aromatic heteropolycyclic compoundhydrocarbon derivativebenzenoidalkylarylthioetheraryl thioetherorganoheterocyclic compound |
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