Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:27:52 UTC |
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Update Date | 2025-03-21 18:40:13 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00129135 |
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Frequency | 19.7 |
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Structure | |
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Chemical Formula | C13H26N2O22S4 |
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Molecular Mass | 689.986 |
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SMILES | COC1OC(COS(=O)(=O)O)C(OC2C(COS(=O)(=O)O)OC(O)C(NS(=O)(=O)O)C2O)C(O)C1NOS(=O)(=O)O |
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InChI Key | MSFMYZWGUMKTNS-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 | carbohydrates and carbohydrate conjugates |
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Direct Parent | monosaccharides |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | acetalsalkyl sulfatesdialkyl ethershemiacetalshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanessecondary alcoholssulfuric acid monoamidessulfuric acid monoesters |
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Substituents | sulfuric acid monoesterethermonosaccharidedialkyl etherorganic oxideacetalalkyl sulfatealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhemiacetaloxaneorganoheterocyclic compoundalcoholorganic sulfuric acid or derivativesoxacyclesulfuric acid monoamidesecondary alcoholsulfate-esterhydrocarbon derivativeorganic nitrogen compoundsulfuric acid ester |
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