| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:45:44 UTC |
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| Update Date | 2025-03-25 00:48:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02168695 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H10O3S2 |
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| Molecular Mass | 182.0071 |
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| SMILES | CC(C)=CCSS(=O)(=O)O |
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| InChI Key | XAOUVJZZIXHOLS-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 thiosulfuric acids and derivatives |
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| Subclass | s-alkyl thiosulfates |
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| Direct Parent | s-alkyl thiosulfates |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesorganic oxidessulfenyl compounds |
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| Substituents | aliphatic acyclic compoundorganic oxideorganic oxygen compoundsulfenyl compoundhydrocarbon derivativeorganosulfur compounds-alkyl thiosulfate |
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