| Record Information |
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| HMDB Status | predicted |
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| Creation Date | 2024-02-20 23:45:25 UTC |
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| Update Date | 2025-03-21 18:00:29 UTC |
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| HMDB ID | HMDB0125614 |
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| Metabolite Identification |
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| DeepMet ID | DMID00027620 |
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| Name | {[3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methoxy}sulfonic acid |
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| Frequency | 137.1 |
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| Structure | |
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| Chemical Formula | C6H12O9S |
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| Molecular Mass | 260.0202 |
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| SMILES | O=S(=O)(O)OCC1OC(O)(CO)C(O)C1O |
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| InChI Key | JQZRNAMDPROKPU-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | organic sulfuric acids and derivatives |
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| Subclass | sulfuric acid esters |
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| Direct Parent | sulfuric acid monoesters |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alkyl sulfateshemiacetalshydrocarbon derivativesmonosaccharidesorganic oxidesoxacyclic compoundssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholsulfuric acid monoestertetrahydrofuranmonosaccharideoxacyclesaccharideorganic oxideorganic oxygen compoundalkyl sulfatealiphatic heteromonocyclic compoundsecondary alcoholsulfate-esterhemiacetalhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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