| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:49 UTC |
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| Update Date | 2025-03-25 00:59:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02239682 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H13NO2S |
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| Molecular Mass | 175.0667 |
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| SMILES | NCC1CSC(CC(=O)O)C1 |
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| InChI Key | BHPNJJIVWBTMEK-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 compoundscarboxylic acidsdialkylthioethershydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | thiolanecarbonyl groupcarboxylic aciddialkylthioethercarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundthioetheraliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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