| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:19:34 UTC |
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| Update Date | 2025-03-24 20:01:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01104798 |
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| Frequency | 1.2 |
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| Structure | |
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| Chemical Formula | C6H8O2S |
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| Molecular Mass | 144.0245 |
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| SMILES | C=CC(=O)SCC(C)=O |
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| InChI Key | YAUNGCUKKQQVJO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | thiolactones |
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| Subclass | thiolactones |
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| Direct Parent | thiolactones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbothioic s-esterscarboxylic acids and derivativeshydrocarbon derivativesketonesorganic oxidessulfenyl compoundsthioesters |
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| Substituents | aliphatic acyclic compoundcarbonyl groupthiocarboxylic acid or derivativessulfenyl compoundthiocarboxylic acid esterorganosulfur compoundcarboxylic acid derivativecarbothioic s-esterketoneorganic oxideorganic oxygen compoundhydrocarbon derivativethiolactoneorganooxygen compound |
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