| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:45:21 UTC |
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| Update Date | 2025-03-25 00:48:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02167833 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H15NOS |
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| Molecular Mass | 173.0874 |
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| SMILES | CC(C)CC1CC(N)C(=O)S1 |
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| InChI Key | WRDPFHYTCBJVRE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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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 compoundsthioestersthiolactonesthiolanes |
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| Substituents | thiolanecarbothioic s-lactonethiocarboxylic acid or derivativescarbonyl groupthiocarboxylic acid esterorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundthiolactoneorganoheterocyclic compoundorganooxygen compound |
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