| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:47:36 UTC |
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| Update Date | 2025-03-21 18:01:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00032781 |
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| Frequency | 111.2 |
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| Structure | |
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| Chemical Formula | C8H10O6S |
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| Molecular Mass | 234.0198 |
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| SMILES | COc1cc(O)cc(OS(=O)(=O)OC)c1 |
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| InChI Key | UPELRESYBKTNGG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenols |
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| Subclass | methoxyphenols |
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| Direct Parent | methoxyphenols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersalkyl sulfatesanisolesarylsulfateshydrocarbon derivativesmethoxybenzenesorganic oxidesphenoxy compoundssulfuric acid diesters |
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| Substituents | phenol ethermonocyclic benzene moietyetherorganic sulfuric acid or derivativesmethoxyphenol1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidalkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundsulfuric acid diesteranisolealkyl sulfatehydrocarbon derivativearylsulfatephenoxy compoundsulfuric acid esterorganooxygen compound |
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