| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:52 UTC |
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| Update Date | 2025-03-25 00:46:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153151 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H12O2S |
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| Molecular Mass | 160.0558 |
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| SMILES | C=CCSCOC(=O)CC |
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| InChI Key | MGESTQFYYAKFIJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | thioacetals |
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| Subclass | monothioacetals |
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| Direct Parent | monothioacetals |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | allyl sulfur compoundscarbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessulfenyl compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupsulfenyl compoundallyl sulfur compoundcarboxylic acid derivativemonothioacetalorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
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