| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:23:57 UTC |
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| Update Date | 2025-03-21 18:38:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00119881 |
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| Frequency | 21.7 |
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| Structure | |
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| Chemical Formula | C8H6O3S |
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| Molecular Mass | 182.0038 |
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| SMILES | O=C1CS(=O)(=O)c2ccccc21 |
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| InChI Key | LXCYNALXWGQUIK-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl alkyl ketones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | benzenoidshydrocarbon derivativesorganic oxidesorganoheterocyclic compoundsorganooxygen compoundssulfones |
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| Substituents | organic oxidearyl alkyl ketonearomatic heteropolycyclic compoundhydrocarbon derivativebenzenoidorganoheterocyclic compoundsulfone |
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