| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:48:37 UTC |
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| Update Date | 2025-03-25 00:49:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02175316 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H16O3S |
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| Molecular Mass | 204.082 |
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| SMILES | CCCCC=CC(O)SCC(=O)O |
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| InChI Key | DPRAEMYDDSTLJZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | carboxylic acids |
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| Direct Parent | carboxylic acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessulfenyl compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativescarboxylic acidorganic oxygen compoundsulfenyl compoundhydrocarbon derivativeorganosulfur compoundorganooxygen compound |
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