| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:23 UTC |
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| Update Date | 2025-03-21 18:36:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00108867 |
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| Frequency | 24.6 |
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| Structure | |
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| Chemical Formula | C8H8O7S |
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| Molecular Mass | 247.9991 |
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| SMILES | O=S(=O)(O)OC1Oc2ccccc2OC1O |
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| InChI Key | UPBDCCKVCFJFMY-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 | benzodioxanes |
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| Subclass | benzo-1,4-dioxanes |
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| Direct Parent | benzo-1,4-dioxanes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl sulfatesbenzenoidshemiacetalshydrocarbon derivativesorganic oxidesorganooxygen compoundsoxacyclic compoundspara dioxinssulfuric acid monoesters |
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| Substituents | benzo-1,4-dioxanesulfuric acid monoesterorganic sulfuric acid or derivativesoxacycleorganic oxideorganic oxygen compoundpara-dioxinaromatic heteropolycyclic compoundalkyl sulfatesulfate-esterhemiacetalhydrocarbon derivativebenzenoidsulfuric acid esterorganooxygen compound |
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