| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:22 UTC |
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| Update Date | 2025-03-25 01:00:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02245654 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H14OS2 |
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| Molecular Mass | 178.0486 |
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| SMILES | CCCCCSSC(C)=O |
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| InChI Key | IRCALCICNAOXIA-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 | carbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic disulfidesorganic oxidessulfenyl compoundsthiocarboxylic acids and derivatives |
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| Substituents | aliphatic acyclic compoundthiocarboxylic acid or derivativescarbonyl groupsulfenyl compoundorganosulfur compoundcarboxylic acid derivativeorganic oxideorganic oxygen compoundorganic disulfidehydrocarbon derivativethiolactoneorganooxygen compound |
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