| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:57:18 UTC |
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| Update Date | 2025-03-25 00:52:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02195007 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H18O3S |
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| Molecular Mass | 194.0977 |
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| SMILES | CCCCCCS(=O)(=O)OCC |
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| InChI Key | WNIMXDGIDSPYDW-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 sulfonic acids and derivatives |
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| Subclass | sulfonic acid esters |
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| Direct Parent | sulfonic acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesorganic oxidesorganooxygen compoundsorganosulfonic acid esterssulfonyls |
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| Substituents | sulfonic acid esteraliphatic acyclic compoundorganosulfonic acid or derivativesorganic oxidesulfonylorganic oxygen compoundhydrocarbon derivativeorganosulfur compoundorganosulfonic acid esterorganooxygen compound |
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