| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:00 UTC |
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| Update Date | 2025-03-25 00:51:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02187656 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H12O2S2 |
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| Molecular Mass | 180.0279 |
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| SMILES | CC(C)C(=O)CSS(C)=O |
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| InChI Key | FXOQBPPTTMEAMO-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 | thiosulfinic acid esters |
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| Subclass | thiosulfinic acid esters |
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| Direct Parent | thiosulfinic acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesketonesorganic oxidessulfenyl compoundssulfinyl compounds |
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| Substituents | ketonealiphatic acyclic compoundcarbonyl grouporganic oxidethiosulfinic acid esterorganic oxygen compoundsulfenyl compoundsulfinyl compoundhydrocarbon derivativeorganosulfur compoundorganooxygen compound |
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