| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:36:28 UTC |
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| Update Date | 2025-03-21 17:57:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00007215 |
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| Frequency | 704.1 |
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| Structure | |
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| Chemical Formula | C7H15NO15S3 |
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| Molecular Mass | 448.9604 |
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| SMILES | COC1OC(COS(=O)(=O)O)C(OS(=O)(=O)O)C(O)C1NOS(=O)(=O)O |
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| InChI Key | QSCRFFQVVFTLCF-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 sulfateshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanessecondary alcoholssulfuric acid monoesters |
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| Substituents | alcoholsulfuric acid monoesterorganic sulfuric acid or derivativesmonosaccharideoxacycleorganic oxideacetalalkyl sulfatealiphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundsulfate-esterhydrocarbon derivativeorganic nitrogen compoundoxanesulfuric acid esterorganoheterocyclic compound |
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