| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:42:10 UTC |
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| Update Date | 2025-03-24 21:18:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01735424 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C4H9NO2S |
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| Molecular Mass | 135.0354 |
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| SMILES | NCC(O)CC(=O)S |
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| InChI Key | VSGVLYCSKGCPHD-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 | alkylthiolscarbodithioic acidscarbonyl compoundscarbothioic s-acidscarboxylic acids and derivativeshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfur compoundssecondary alcoholsthiocarboxylic acids and derivatives |
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| Substituents | alcoholaliphatic acyclic compoundthiocarboxylic acid or derivativescarbonyl groupcarbodithioic acidorganosulfur compoundcarboxylic acid derivativecarbothioic s-acidorganic oxideorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundthiolactonealkylthiolorganooxygen compound |
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