Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:45:26 UTC |
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Update Date | 2025-03-25 00:48:24 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02168018 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C8H16O4S2 |
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Molecular Mass | 240.049 |
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SMILES | CC(CSCC(O)C(O)CS)C(=O)O |
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InChI Key | HLMFRRLFWAYMSC-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 | 1,2-diols |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | alkylthiolscarbonyl compoundscarboxylic acidsdialkylthioethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessecondary alcoholssulfenyl compounds |
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Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidsulfenyl compounddialkylthioetherorganosulfur compoundcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesthioethersecondary alcoholhydrocarbon derivativealkylthiol1,2-diol |
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