| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:48 UTC |
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| Update Date | 2025-03-25 01:01:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02246671 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H14O2S |
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| Molecular Mass | 174.0715 |
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| SMILES | CCC=C(O)CC(=O)CSC |
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| InChI Key | UPFWOEGTDSTJEW-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 | carbonyl compounds |
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| Direct Parent | beta-hydroxy ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | dialkylthioethershydrocarbon derivativesorganic oxidessulfenyl compounds |
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| Substituents | beta-hydroxy ketonealiphatic acyclic compoundsulfenyl compounddialkylthioetherorganosulfur compoundorganic oxidethioetherhydrocarbon derivative |
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