| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:36 UTC |
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| Update Date | 2025-03-25 00:47:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159338 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H14O9S |
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| Molecular Mass | 322.0359 |
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| SMILES | O=S(=O)(O)OC1C(O)COC(c2ccc(O)c(O)c2)C1O |
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| InChI Key | UVVCCIKMEFYOQT-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 | 1-hydroxy-2-unsubstituted benzenoids |
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| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-4-unsubstituted benzenoidsalkyl sulfatesbenzene and substituted derivativesdialkyl ethershydrocarbon derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanessecondary alcoholssulfuric acid monoesters |
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| Substituents | monocyclic benzene moietysulfuric acid monoesteretheraromatic heteromonocyclic compound1-hydroxy-2-unsubstituted benzenoidmonosaccharidedialkyl ethersaccharideorganic oxidealkyl sulfateoxaneorganoheterocyclic compoundalcoholorganic sulfuric acid or derivatives1-hydroxy-4-unsubstituted benzenoidoxacycleorganic oxygen compoundsecondary alcoholsulfate-esterhydrocarbon derivativesulfuric acid esterorganooxygen compound |
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