| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:46:34 UTC |
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| Update Date | 2025-03-21 18:00:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00030287 |
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| Frequency | 122.8 |
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| Structure | |
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| Chemical Formula | C5H8OS |
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| Molecular Mass | 116.0296 |
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| SMILES | C=CCSC(C)=O |
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| InChI Key | MIRAUQNBKACECA-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 | allyl sulfur compoundscarbonyl compoundscarbothioic s-esterscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidessulfenyl compoundsthioesters |
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| Substituents | aliphatic acyclic compoundthiocarboxylic acid or derivativescarbonyl groupsulfenyl compoundthiocarboxylic acid esterallyl sulfur compoundorganosulfur compoundcarboxylic acid derivativecarbothioic s-esterorganic oxideorganic oxygen compoundhydrocarbon derivativethiolactoneorganooxygen compound |
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