| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:17:39 UTC |
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| Update Date | 2025-03-21 19:09:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00245211 |
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| Frequency | 8.6 |
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| Structure | |
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| Chemical Formula | C5H8O2S |
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| Molecular Mass | 132.0245 |
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| SMILES | CCC(=O)C(=O)SC |
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| InChI Key | SIVLOBMYJUHKKD-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acyl thioesters |
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| Direct Parent | fatty acyl thioesters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbothioic s-esterscarboxylic acids and derivativeshydrocarbon derivativesketonesorganic oxidessulfenyl compoundsthioestersthiolactones |
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| Substituents | aliphatic acyclic compoundthiocarboxylic acid or derivativescarbonyl groupsulfenyl compoundthiocarboxylic acid esterorganosulfur compoundcarboxylic acid derivativecarbothioic s-esterketoneorganic oxideorganic oxygen compoundhydrocarbon derivativefatty acyl thioesterthiolactoneorganooxygen compound |
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