| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:42:34 UTC |
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| Update Date | 2025-03-21 21:55:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00444141 |
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| Frequency | 4.0 |
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| Structure | |
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| Chemical Formula | C5H9NOS |
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| Molecular Mass | 131.0405 |
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| SMILES | C=CC(=O)SCCN |
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| InChI Key | KXAZPROGXOUDDG-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 | carbonyl compoundscarbothioic s-esterscarboxylic acids and derivativeshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfenyl compoundsthioesters |
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| Substituents | aliphatic acyclic compoundcarbonyl groupthiocarboxylic acid or derivativessulfenyl compoundthiocarboxylic acid esterorganosulfur compoundcarboxylic acid derivativecarbothioic s-esterorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundthiolactoneorganooxygen compound |
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