| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:08:03 UTC |
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| Update Date | 2025-03-24 21:56:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01938538 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C5H11NOS |
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| Molecular Mass | 133.0561 |
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| SMILES | CNCCSC(C)=O |
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| InChI Key | BMQLAAUMJVCPJO-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 | amino acids and derivativescarbonyl compoundscarbothioic s-esterscarboxylic acids and derivativesdialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compoundssulfenyl compoundsthioesters |
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| Substituents | aliphatic acyclic compoundsecondary aliphatic aminethiocarboxylic acid or derivativescarbonyl groupsulfenyl compoundamino acid or derivativesthiocarboxylic acid estersecondary amineorganosulfur compoundcarboxylic acid derivativecarbothioic s-esterorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundthiolactoneorganooxygen compoundamine |
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