| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:40 UTC |
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| Update Date | 2025-03-25 00:47:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161687 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H9NO2S |
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| Molecular Mass | 147.0354 |
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| SMILES | NCC1(O)CSC(=O)C1 |
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| InChI Key | BJPPCZBDSFROMD-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 | thiolanes |
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| Subclass | thiolanes |
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| Direct Parent | thiolanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarbothioic s-lactonescarboxylic acids and derivativeshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundstertiary alcoholsthioestersthiolactones |
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| Substituents | thiolanecarbothioic s-lactonealcoholthiocarboxylic acid or derivativescarbonyl groupthiocarboxylic acid estercarboxylic acid derivativetertiary alcoholorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundthiolactoneorganooxygen compound |
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