| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:09:41 UTC |
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| Update Date | 2025-03-21 18:31:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00085356 |
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| Frequency | 33.5 |
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| Structure | |
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| Chemical Formula | C6H12O4S |
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| Molecular Mass | 180.0456 |
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| SMILES | OCC1SCC(O)C(O)C1O |
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| InChI Key | IHFROQCVGFICCX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | thianes |
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| Subclass | thianes |
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| Direct Parent | thianes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | dialkylthioethershydrocarbon derivativesprimary alcoholssecondary alcohols |
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| Substituents | alcoholorganic oxygen compoundthioetherdialkylthioetheraliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativeprimary alcoholorganooxygen compoundthiane |
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