| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:23 UTC |
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| Update Date | 2025-03-25 00:52:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02192973 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H12O5S |
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| Molecular Mass | 196.0405 |
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| SMILES | CCCCC(C=O)OS(=O)(=O)O |
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| InChI Key | IHPRRKNCMDTIFJ-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 acyclic compounds |
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| Alternative Parents | aldehydesalkyl sulfateshydrocarbon derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundsulfuric acid monoestercarbonyl groupaldehydeorganic oxideorganic oxygen compoundalkyl sulfatesulfate-esterhydrocarbon derivativeorganooxygen compound |
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