| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:52 UTC |
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| Update Date | 2025-03-25 00:59:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235315 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H8O4S |
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| Molecular Mass | 200.0143 |
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| SMILES | O=S1(=O)CC(O)Oc2ccccc21 |
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| InChI Key | CKDRNFIOJXGTKH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | benzoxathiins |
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| Subclass | benzoxathiins |
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| Direct Parent | benzoxathiins |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | benzenoidshemiacetalshydrocarbon derivativesorganic oxidesorganooxygen compoundsoxacyclic compoundsoxathiinssulfones |
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| Substituents | oxacycleorganic oxideorganic oxygen compound1,4-benzooxathiinaromatic heteropolycyclic compoundhemiacetalhydrocarbon derivativebenzenoidorganooxygen compoundsulfone1,4-oxathiin |
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