| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:33 UTC |
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| Update Date | 2025-03-21 18:37:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00116511 |
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| Frequency | 22.5 |
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| Structure | |
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| Chemical Formula | C6H12O2S |
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| Molecular Mass | 148.0558 |
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| SMILES | CC(C)C(=O)CS(C)=O |
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| InChI Key | KYCGCQIVGKCTHR-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 | sulfoxides |
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| Subclass | sulfoxides |
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| Direct Parent | sulfoxides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesketonesorganic oxidessulfinyl compounds |
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| Substituents | ketonealiphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundsulfinyl compoundsulfoxidehydrocarbon derivativeorganooxygen compound |
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