| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:38 UTC |
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| Update Date | 2025-03-25 00:59:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02234756 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H14O5S |
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| Molecular Mass | 294.0562 |
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| SMILES | Cc1cccc(C)c1Oc1ccccc1OS(=O)(=O)O |
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| InChI Key | DJKHGVVEAUZPHG-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 | benzene and substituted derivatives |
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| Subclass | diphenylethers |
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| Direct Parent | diphenylethers |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | diarylethershydrocarbon derivativesorganic oxidesphenol ethersphenoxy compoundsphenylsulfatessulfuric acid monoestersm-xylenes |
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| Substituents | diaryl etherphenol ethersulfuric acid monoesteretherorganic sulfuric acid or derivativesm-xylenearomatic homomonocyclic compoundxylenephenylsulfateorganic oxideorganic oxygen compoundsulfate-esterhydrocarbon derivativearylsulfatephenoxy compoundsulfuric acid esterdiphenyletherorganooxygen compound |
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