| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:09 UTC |
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| Update Date | 2025-03-21 18:02:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00041277 |
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| Frequency | 83.3 |
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| Structure | |
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| Chemical Formula | C8H10O10S2 |
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| Molecular Mass | 329.9715 |
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| SMILES | COc1ccc(C(OS(=O)(=O)O)OS(=O)(=O)O)c(O)c1 |
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| InChI Key | WEDRBFAFKRPWEV-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 sulfatesanisoleshydrocarbon derivativesmethoxybenzenesorganic oxidesphenoxy compoundssulfuric acid monoesters |
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| Substituents | phenol ethermonocyclic benzene moietysulfuric acid monoesteretherorganic sulfuric acid or derivativesmethoxyphenol1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidalkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundanisolealkyl sulfatesulfate-esterhydrocarbon derivativephenoxy compoundsulfuric acid esterorganooxygen compound |
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