| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:34 UTC |
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| Update Date | 2025-03-21 18:37:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00114135 |
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| Frequency | 23.2 |
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| Structure | |
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| Chemical Formula | C15H14O10S |
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| Molecular Mass | 386.0308 |
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| SMILES | O=S(=O)(O)OC1COc2cc(O)cc(O)c2OC1c1ccc(O)c(O)c1 |
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| InChI Key | GCQLXZXUNXHPNY-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 | ethers |
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| Direct Parent | alkyl aryl ethers |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl sulfatesbenzene and substituted derivativeshydrocarbon derivativesorganic oxidesoxacyclic compoundssulfuric acid monoesters |
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| Substituents | monocyclic benzene moietysulfuric acid monoesterorganic sulfuric acid or derivatives1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidalkyl aryl etheroxacycleorganic oxidearomatic heteropolycyclic compoundalkyl sulfatesulfate-esterphenolhydrocarbon derivativebenzenoidsulfuric acid esterorganoheterocyclic compound |
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