| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:12 UTC |
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| Update Date | 2025-03-25 00:57:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222656 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H18O9S |
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| Molecular Mass | 350.0672 |
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| SMILES | O=S(=O)(O)OCC1OC(O)C(O)C(OCc2ccccc2)C1O |
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| InChI Key | REOMRVCDUJQWET-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 | benzylethers |
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| Direct Parent | benzylethers |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkyl sulfatesdialkyl ethershemiacetalshydrocarbon derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanessecondary alcoholssulfuric acid monoesters |
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| Substituents | alcoholsulfuric acid monoesteretherorganic sulfuric acid or derivativesbenzyletheraromatic heteromonocyclic compoundmonosaccharidedialkyl etheroxacyclesaccharideorganic oxideorganic oxygen compoundalkyl sulfatesecondary alcoholsulfate-esterhemiacetalhydrocarbon derivativeoxanesulfuric acid esterorganoheterocyclic compoundorganooxygen compound |
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