| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:41 UTC |
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| Update Date | 2025-03-25 00:54:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02205091 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H12O14S3 |
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| Molecular Mass | 403.9389 |
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| SMILES | O=S(=O)(O)OC1CC(OS(=O)(=O)O)C(OS(=O)(=O)O)C(O)C1O |
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| InChI Key | NSPJNJKHGGMMFW-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 | alcohols and polyols |
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| Direct Parent | cyclohexanols |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | 1,2-diolsalkyl sulfatescyclitols and derivativeshydrocarbon derivativesorganic oxidessulfuric acid monoesters |
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| Substituents | sulfuric acid monoesterorganic sulfuric acid or derivativescyclohexanolcyclitol or derivativescyclic alcoholorganic oxidealkyl sulfatealiphatic homomonocyclic compoundsulfate-esterhydrocarbon derivativesulfuric acid ester1,2-diol |
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